A0A077ZCE3_TRITR Loading...

Protein dpy 19 3

AlphaFold DB , UniProt , Accession A0A077ZCE3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 723 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	36.6	Very low	243 Å²	243	167.7 Å²	167.7	100%	1.197	86%	0.859	S	S	*	*				0	122.3	0	-70.4	172.8	-177.8	0	0	107.4
2	V	37.5	Very low	36.6	Very low	115 Å²	115	167.9 Å²	167.9	70%	0.697	85%	0.849	S	S	*	*			cis	-162.1	147.4	-4.3	149.1	0	0	0	0	104.4
3	H	37.8	Very low	36.3	Very low	173 Å²	173	171.2 Å²	171.2	80%	0.801	85%	0.845	S	S	*	*			trans	76.1	112.5	176.1	-60	-51.8	0	0	0	117.9
4	S	36.8	Very low	36.3	Very low	115 Å²	115	172.4 Å²	172.4	80%	0.804	85%	0.847	S	S	*	*				65.8	135.7	50.9	-145.8	0	0	0	0	112.1
5	A	35.9	Very low	36	Very low	87 Å²	87	168.5 Å²	168.5	72%	0.719	84%	0.844	S	S	*	*			cis	-159.7	163.7	18.6	0	0	0	0	0	112
6	T	33.9	Very low	36.1	Very low	139 Å²	139	166.9 Å²	166.9	85%	0.853	85%	0.846	S	S	*	*			trans	-55.3	150.3	168.9	32.5	0	0	0	0	117.2
7	S	38.9	Very low	35.9	Very low	124 Å²	124	164 Å²	164	87%	0.867	84%	0.844	S	S	*	*			trans	-160	135.5	131.1	64	0	0	0	0	113.5
8	V	34.5	Very low	35.9	Very low	136 Å²	136	159.2 Å²	159.2	82%	0.824	84%	0.841	S	S	*	*			trans	-96.4	138.9	174.1	166.1	0	0	0	0	108.3
9	R	39.8	Very low	35.6	Very low	234 Å²	234	161.4 Å²	161.4	88%	0.883	84%	0.843	S	S	*	*			trans	-139.2	116.4	164.1	-130.9	176.7	-173.1	177.7	3.1	111.2
10	R	34	Very low	35.7	Very low	240 Å²	240	160.9 Å²	160.9	91%	0.906	85%	0.847	S	S	*	*			trans	-103.7	131	173.2	-145.6	178.8	-171.3	-179.6	2.8	106.9
11	R	39.4	Very low	35.5	Very low	239 Å²	239	158.4 Å²	158.4	90%	0.902	84%	0.843	S	S	*	*			trans	-129.9	150.7	163.9	-96.6	-173.4	178.5	178.8	-0.9	109.9
12	K	35.6	Very low	35.6	Very low	170 Å²	170	152.4 Å²	152.4	74%	0.739	83%	0.825	S	S	*	*			trans	-124.6	154.7	-152.7	-152.9	-165.6	-173.5	173.8	0	108.8
13	R	33.5	Very low	35.6	Very low	211 Å²	211	155.7 Å²	155.7	80%	0.796	83%	0.83	S	S	*	*			trans	72	143.4	162.9	-65.7	176.8	170.3	173	-5.5	115.2
14	E	36.2	Very low	35.4	Very low	187 Å²	187	155 Å²	155	87%	0.874	83%	0.83	S	S	*	*			cis	-149.7	157.1	43.6	-72.5	170.1	157.1	0	0	113.6
15	S	31.1	Very low	35.3	Very low	115 Å²	115	153 Å²	153	80%	0.804	83%	0.828	S	S	*	*			trans	-99.9	131.9	171.8	55	0	0	0	0	110.6
16	V	37.4	Very low	35.1	Very low	143 Å²	143	157.4 Å²	157.4	87%	0.867	83%	0.834	S	S	*	*			trans	-136.5	126.2	161.8	178.6	0	0	0	0	109.4
17	S	33	Very low	35.2	Very low	117 Å²	117	160.1 Å²	160.1	82%	0.818	83%	0.834	S	S	*	*			trans	-82	137.7	176.7	158.4	0	0	0	0	110.7
18	G	36.1	Very low	34.8	Very low	77 Å²	77	160.1 Å²	160.1	79%	0.794	83%	0.834	S	S	*	*			trans	-156	101.3	169.4	0	0	0	0	0	111.5
19	K	31.3	Very low	34.9	Very low	202 Å²	202	158.4 Å²	158.4	88%	0.878	83%	0.834	S	S	*	*			trans	-78	129	167.7	-87.2	175.8	172.6	174.6	0	109.4
20	V	36.7	Very low	34.5	Very low	150 Å²	150	155.2 Å²	155.2	91%	0.909	83%	0.833	S	S	*	*			trans	-141.6	132.4	149.5	178.8	0	0	0	0	108.8
21	S	31.9	Very low	34.4	Very low	110 Å²	110	149.4 Å²	149.4	77%	0.769	83%	0.83	S	S	*	*			trans	-100.5	136.9	-175.8	178.4	0	0	0	0	110.3
22	S	37.2	Very low	34.2	Very low	117 Å²	117	143.8 Å²	143.8	82%	0.818	82%	0.821	S	S	*	*			trans	-155.4	94.5	155.5	65.1	0	0	0	0	112.3
23	K	35.8	Very low	34.1	Very low	183 Å²	183	141.1 Å²	141.1	80%	0.796	82%	0.821	S	S	*	*			trans	35.8	121.9	135.7	-75.3	-176.8	171.2	-179	0	122.6
24	I	33.9	Very low	34	Very low	159 Å²	159	136.4 Å²	136.4	82%	0.815	82%	0.821	S	S	*	*				77.2	119.7	121.5	-57.5	167.1	0	0	0	118.9
25	G	34.8	Very low	33.7	Very low	74 Å²	74	133.3 Å²	133.3	76%	0.763	82%	0.82	S	S	*	*			trans	173.6	61.5	168.5	0	0	0	0	0	114.2
26	E	32.2	Very low	34.1	Very low	178 Å²	178	132.5 Å²	132.5	83%	0.832	81%	0.814	S	S	*	*			trans	15.9	116.2	146.8	-137.1	172.5	-160.3	0	0	120.1
27	K	36.4	Very low	34.6	Very low	197 Å²	197	134 Å²	134	86%	0.857	81%	0.811	S	S	*	*				174.8	121.6	119.3	-94.3	170.8	-175.8	179.2	0	112.2
28	S	30.3	Very low	35.6	Very low	124 Å²	124	130.5 Å²	130.5	87%	0.867	79%	0.79	S	S	*	*			trans	-69.8	125.8	174.5	36.7	0	0	0	0	112.2
29	A	36.2	Very low	37.3	Very low	99 Å²	99	130.9 Å²	130.9	82%	0.818	78%	0.778	S	S	*	*			trans	-150.4	113.2	158.6	0	0	0	0	0	110.5	S31	A29-S31 PolarHBondContact O-N 3.47Å
30	L	31.3	Very low	39.5	Very low	168 Å²	168	131.5 Å²	131.5	88%	0.88	78%	0.775	S	S	*	*			trans	-24.2	114.4	168.6	-130.6	73.7	0	0	0	115.1	V32	L30-V32 PolarHBondContact O-N 3.42Å
31	S	33.2	Very low	41.8	Very low	118 Å²	118	130 Å²	130	83%	0.825	76%	0.761	S	S	*	*			trans	-87.2	102.1	165.5	58.3	0	0	0	0	110.1	A29	A29-S31 PolarHBondContact O-N 3.47Å
32	V	33.9	Very low	44.3	Very low	120 Å²	120	129.6 Å²	129.6	73%	0.727	75%	0.75	S	S	*	*			trans	-72.4	129	166.3	178	0	0	0	0	108.7	L30 S34	L30-V32 PolarHBondContact O-N 3.42Å; V32-S34 PolarHBondContact O-N 3.13Å
33	P	33.1	Very low	46.5	Very low	114 Å²	114	130.3 Å²	130.3	74%	0.74	74%	0.735	S	S	*	*			trans	-73.9	127.9	178	28.4	-30.3	0	0	0	110.7	S35	P33-S35 PolarHBondContact O-N 3.12Å; P33-S35 VanDerWaalsContact O-N 3.12Å
34	S	31.7	Very low	48.9	Very low	113 Å²	113	129.2 Å²	129.2	79%	0.79	73%	0.725	S	S	*	*			trans	-74.6	95.4	179.3	57.4	0	0	0	0	112	V32 S36	V32-S34 PolarHBondContact O-N 3.13Å; S34-S36 PolarHBondContact O-N 3.47Å; S34-S36 VanDerWaalsContact O-N 3.13Å
35	S	30.3	Very low	51.6	Low	122 Å²	122	126.1 Å²	126.1	85%	0.853	71%	0.71	S	S	*	*			trans	-78.4	86.9	169.4	55	0	0	0	0	111	P33	P33-S35 PolarHBondContact O-N 3.12Å; P33-S35 VanDerWaalsContact O-N 3.12Å
36	S	39.4	Very low	54.1	Low	97 Å²	97	130 Å²	130	68%	0.678	70%	0.703	S	S	*	*			trans	-107.5	53.8	173.5	64.3	0	0	0	0	112.9	S34	S34-S36 PolarHBondContact O-N 3.47Å; S34-S36 VanDerWaalsContact O-N 3.13Å
37	H	47.6	Very low	56.8	Low	174 Å²	174	128.2 Å²	128.2	81%	0.806	69%	0.689	S	S	*	*			trans	-120.6	67	165.6	-82.7	-5.4	0	0	0	110.7	P39	H37-P39 WeakPolarHBondContact O-CD 3.46Å; H37-P39 VanDerWaalsContact O-N 3.16Å
38	A	55.4	Low	59.3	Low	45 Å²	45	123.6 Å²	123.6	37%	0.372	67%	0.672	S	S	.	*			trans	-54	123.1	158.9	0	0	0	0	0	108	R40 L42 R43	A38-R40 PolarHBondContact O-N 2.95Å; A38-L42 HydrophobicContact CB-CD2 4.42Å; A38-R43 PolarHBondContact O-NE 3.46Å; A38-R43 PolarHBondContact O-NH2 2.82Å; A38-R43 VanDerWaalsContact O-NH2 3.08Å
39	P	70.1	Confident	62.3	Low	84 Å²	84	120.2 Å²	120.2	55%	0.545	65%	0.651	S	S	.	*			trans	-57.9	141.1	-173.2	17.7	-27.5	0	0	0	109.7	H37 L41 L42 R43	H37-P39 WeakPolarHBondContact O-CD 3.46Å; H37-P39 VanDerWaalsContact O-N 3.16Å; P39-L41 PolarHBondContact O-N 3.49Å; P39-L42 HydrophobicContact CG-CB 4.13Å; P39-L42 PolarHBondContact O-N 2.89Å; P39-R43 PolarHBondContact O-N 2.98Å
40	R	79.1	Confident	64.9	Low	215 Å²	215	117.1 Å²	117.1	81%	0.811	62%	0.621	S	S	*	*	H	α-helix	trans	-50.1	-30.9	-177.8	-69.7	179.4	-179	174.2	0.9	112.3	A38 R44	A38-R40 PolarHBondContact O-N 2.95Å; R40-R44 WeakPolarHBondContact O-CG 3.45Å; R40-R44 PolarHBondContact O-N 3.14Å; R40-R44 VanDerWaalsContact O-N 3.14Å
41	L	83.9	Confident	67.7	Low	120 Å²	120	115.5 Å²	115.5	63%	0.628	60%	0.604	S	S	*	*	H	α-helix	trans	-61.4	-50.3	174.7	-173.9	64.2	0	0	0	112.4	P39 R43 R44 L45	P39-L41 PolarHBondContact O-N 3.49Å; L41-R43 VanDerWaalsContact C-N 3.3Å; L41-R43 PolarHBondContact O-N 2.85Å; L41-R44 WeakPolarHBondContact O-CA 3.44Å; L41-R44 WeakPolarHBondContact O-CB 3.34Å; L41-R44 PolarHBondContact O-N 3.31Å; L41-L45 HydrophobicContact CD1-CG 4.45Å; L41-L45 HydrophobicContact CG-CD1 4.05Å; L41-L45 HydrophobicContact CG-CG 4.39Å; L41-L45 WeakPolarHBondContact O-CG 3.42Å; L41-L45 PolarHBondContact O-N 3.42Å
42	L	84.2	Confident	70.6	Confident	101 Å²	101	113.4 Å²	113.4	53%	0.529	59%	0.586	S	S	.	*	H	α-helix	trans	-59.9	-39.9	-179.7	-168.4	72.4	0	0	0	111.7	A38 P39 R44 L45 Y46	A38-L42 HydrophobicContact CB-CD2 4.42Å; P39-L42 HydrophobicContact CG-CB 4.13Å; P39-L42 PolarHBondContact O-N 2.89Å; L42-R44 VanDerWaalsContact C-N 3.34Å; L42-R44 PolarHBondContact O-N 3.25Å; L42-L45 PolarHBondContact O-N 3.16Å; L42-Y46 VanDerWaalsContact O-CB 3.28Å; L42-Y46 WeakPolarHBondContact O-CB 3.46Å; L42-Y46 PolarHBondContact O-N 3.37Å
43	R	84.1	Confident	73.5	Confident	132 Å²	132	110.4 Å²	110.4	50%	0.498	57%	0.57	S	S	.	*	H	α-helix	trans	-67.7	-29.7	174.3	-81.2	-174.3	-101.7	-162.5	-8.9	113.6	A38 P39 L41 R47	A38-R43 PolarHBondContact O-NE 3.46Å; A38-R43 PolarHBondContact O-NH2 2.82Å; A38-R43 VanDerWaalsContact O-NH2 3.08Å; P39-R43 PolarHBondContact O-N 2.98Å; L41-R43 VanDerWaalsContact C-N 3.3Å; L41-R43 PolarHBondContact O-N 2.85Å; R43-R47 WeakPolarHBondContact O-CG 3.42Å; R43-R47 PolarHBondContact O-N 3.08Å; R43-R47 PolarHBondContact O-NE 3.49Å
44	R	87	Confident	76.5	Confident	159 Å²	159	105.2 Å²	105.2	60%	0.6	54%	0.536	S	S	*	.	H	α-helix	trans	-72.8	-49	172.5	-75.9	179.9	179.1	-175.2	-0.4	110.4	R40 L41 L42 Y46 R47 I48	R40-R44 WeakPolarHBondContact O-CG 3.45Å; R40-R44 PolarHBondContact O-N 3.14Å; R40-R44 VanDerWaalsContact O-N 3.14Å; L41-R44 WeakPolarHBondContact O-CA 3.44Å; L41-R44 WeakPolarHBondContact O-CB 3.34Å; L41-R44 PolarHBondContact O-N 3.31Å; L42-R44 VanDerWaalsContact C-N 3.34Å; L42-R44 PolarHBondContact O-N 3.25Å; R44-Y46 VanDerWaalsContact C-N 3.35Å; R44-Y46 PolarHBondContact O-N 3.39Å; R44-R47 PolarHBondContact O-N 3.43Å; R44-R47 VanDerWaalsContact O-N 3.16Å; R44-I48 WeakPolarHBondContact O-CG1 3.28Å; R44-I48 PolarHBondContact O-N 2.94Å
45	L	90.2	Very high	79.5	Confident	94 Å²	94	104.5 Å²	104.5	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-57.4	-46.1	177.4	-69	174.1	0	0	0	111.7	L41 L42 R47 I48 A49	L41-L45 HydrophobicContact CD1-CG 4.45Å; L41-L45 HydrophobicContact CG-CD1 4.05Å; L41-L45 HydrophobicContact CG-CG 4.39Å; L41-L45 WeakPolarHBondContact O-CG 3.42Å; L41-L45 PolarHBondContact O-N 3.42Å; L42-L45 PolarHBondContact O-N 3.16Å; L45-R47 VanDerWaalsContact C-N 3.35Å; L45-R47 PolarHBondContact O-N 3.43Å; L45-I48 PolarHBondContact O-N 2.87Å; L45-A49 WeakPolarHBondContact O-CB 3.36Å; L45-A49 PolarHBondContact O-N 3.47Å
46	Y	87.7	Confident	82.7	Confident	157 Å²	157	104 Å²	104	62%	0.616	51%	0.51	S	S	*	.	H	α-helix	trans	-58.6	-43.2	175.9	178.8	-103.9	0	0	0	112.7	L42 R44 A49 I50	L42-Y46 VanDerWaalsContact O-CB 3.28Å; L42-Y46 WeakPolarHBondContact O-CB 3.46Å; L42-Y46 PolarHBondContact O-N 3.37Å; R44-Y46 VanDerWaalsContact C-N 3.35Å; R44-Y46 PolarHBondContact O-N 3.39Å; Y46-A49 PolarHBondContact O-N 2.91Å; Y46-I50 HydrophobicContact CD1-CD1 3.71Å; Y46-I50 HydrophobicContact CD2-CD1 4.44Å; Y46-I50 HydrophobicContact CE1-CD1 3.18Å; Y46-I50 HydrophobicContact CE1-CG1 4.31Å; Y46-I50 HydrophobicContact CE2-CD1 4Å; Y46-I50 HydrophobicContact CE2-CG1 4.38Å; Y46-I50 HydrophobicContact CG-CD1 4.32Å; Y46-I50 WeakPolarHBondContact O-CG1 3.38Å; Y46-I50 PolarHBondContact O-N 2.88Å
47	R	87.5	Confident	85.4	Confident	140 Å²	140	101.4 Å²	101.4	53%	0.528	49%	0.488	S	S	.	.	H	α-helix	trans	-65.2	-45.1	176.5	-78	-175.1	-69.7	-160.9	2.6	111.9	R43 R44 L45 A49 I50 Y51	R43-R47 WeakPolarHBondContact O-CG 3.42Å; R43-R47 PolarHBondContact O-N 3.08Å; R43-R47 PolarHBondContact O-NE 3.49Å; R44-R47 PolarHBondContact O-N 3.43Å; R44-R47 VanDerWaalsContact O-N 3.16Å; L45-R47 VanDerWaalsContact C-N 3.35Å; L45-R47 PolarHBondContact O-N 3.43Å; R47-A49 VanDerWaalsContact C-N 3.33Å; R47-A49 PolarHBondContact O-N 3Å; R47-I50 PolarHBondContact O-N 2.99Å; R47-Y51 HydrophobicContact CB-CE2 4.26Å; R47-Y51 WeakPolarHBondContact O-CD2 3.33Å; R47-Y51 PolarHBondContact O-N 3.23Å
48	I	89.8	Confident	87.8	Confident	100 Å²	100	93.2 Å²	93.2	51%	0.513	45%	0.45	S	S	.	.	H	α-helix	trans	-59.2	-47.2	176.8	-66.3	165.5	0	0	0	109.8	R44 L45 I50 Y51 V52	R44-I48 WeakPolarHBondContact O-CG1 3.28Å; R44-I48 PolarHBondContact O-N 2.94Å; L45-I48 PolarHBondContact O-N 2.87Å; I48-I50 PolarHBondContact O-N 3.44Å; I48-Y51 PolarHBondContact O-N 3.16Å; I48-Y51 VanDerWaalsContact O-N 3.16Å; I48-V52 HydrophobicContact CG2-CG2 4.4Å; I48-V52 WeakPolarHBondContact O-CG2 3.47Å; I48-V52 PolarHBondContact O-N 3.4Å
49	A	91.7	Very high	89.8	Confident	52 Å²	52	94.6 Å²	94.6	43%	0.43	45%	0.454	S	S	.	.	H	α-helix	trans	-57.5	-45.8	177.9	0	0	0	0	0	112.1	L45 Y46 R47 Y51 V52 C53	L45-A49 WeakPolarHBondContact O-CB 3.36Å; L45-A49 PolarHBondContact O-N 3.47Å; Y46-A49 PolarHBondContact O-N 2.91Å; R47-A49 VanDerWaalsContact C-N 3.33Å; R47-A49 PolarHBondContact O-N 3Å; A49-Y51 PolarHBondContact O-N 3.27Å; A49-V52 PolarHBondContact O-N 3.32Å; A49-C53 PolarHBondContact O-N 3.03Å; A49-C53 PolarHBondContact O-SG 3.26Å
50	I	91.2	Very high	91.2	Very high	35 Å²	35	93.5 Å²	93.5	18%	0.179	45%	0.452	C	S	.	.	H	α-helix	trans	-64.9	-40.5	177	-60.3	163.2	0	0	0	111.6	Y46 R47 I48 V52 C53 C54 Y183 L189	Y46-I50 HydrophobicContact CD1-CD1 3.71Å; Y46-I50 HydrophobicContact CD2-CD1 4.44Å; Y46-I50 HydrophobicContact CE1-CD1 3.18Å; Y46-I50 HydrophobicContact CE1-CG1 4.31Å; Y46-I50 HydrophobicContact CE2-CD1 4Å; Y46-I50 HydrophobicContact CE2-CG1 4.38Å; Y46-I50 HydrophobicContact CG-CD1 4.32Å; Y46-I50 WeakPolarHBondContact O-CG1 3.38Å; Y46-I50 PolarHBondContact O-N 2.88Å; R47-I50 PolarHBondContact O-N 2.99Å; I48-I50 PolarHBondContact O-N 3.44Å; I50-V52 VanDerWaalsContact C-N 3.31Å; I50-V52 PolarHBondContact O-N 3.07Å; I50-C53 PolarHBondContact O-N 3.33Å; I50-C54 WeakPolarHBondContact O-CB 3.46Å; I50-C54 PolarHBondContact O-N 2.99Å; I50-Y183 HydrophobicContact CG2-CE2 3.79Å; I50-Y183 WeakPolarHBondContact CG2-OH 3.39Å; I50-L189 HydrophobicContact CG2-CD1 4.26Å; I50-L189 HydrophobicContact CG2-CD2 4.27Å; I50-L189 HydrophobicContact CG2-CG 4.29Å
51	Y	90.9	Very high	92	Very high	133 Å²	133	83.9 Å²	83.9	52%	0.522	42%	0.417	S	S	.	.	H	α-helix	trans	-61.4	-41.2	176	-74.1	-61.3	0	0	0	111.6	R47 I48 A49 C54 I55 Y183	R47-Y51 HydrophobicContact CB-CE2 4.26Å; R47-Y51 WeakPolarHBondContact O-CD2 3.33Å; R47-Y51 PolarHBondContact O-N 3.23Å; I48-Y51 PolarHBondContact O-N 3.16Å; I48-Y51 VanDerWaalsContact O-N 3.16Å; A49-Y51 PolarHBondContact O-N 3.27Å; Y51-C54 WeakPolarHBondContact O-CB 2.96Å; Y51-C54 PolarHBondContact O-N 3.39Å; Y51-I55 WeakPolarHBondContact O-CG1 3.04Å; Y51-I55 PolarHBondContact O-N 2.92Å; Y51-Y183 AromaticContact CD1-CE1 3.68Å; Y51-Y183 HydrophobicContact CD1-CE1 3.68Å; Y51-Y183 AromaticContact CE1-CE1 3.67Å; Y51-Y183 HydrophobicContact CE1-CE1 3.67Å
52	V	94.4	Very high	92.7	Very high	74 Å²	74	78.3 Å²	78.3	45%	0.448	39%	0.389	S	S	.	.	H	α-helix	trans	-62.7	-46.9	174.1	173.6	0	0	0	0	110.6	I48 A49 I50 C54 I55 L56	I48-V52 HydrophobicContact CG2-CG2 4.4Å; I48-V52 WeakPolarHBondContact O-CG2 3.47Å; I48-V52 PolarHBondContact O-N 3.4Å; A49-V52 PolarHBondContact O-N 3.32Å; I50-V52 VanDerWaalsContact C-N 3.31Å; I50-V52 PolarHBondContact O-N 3.07Å; V52-C54 VanDerWaalsContact C-N 3.3Å; V52-C54 PolarHBondContact O-N 3.34Å; V52-I55 PolarHBondContact O-N 2.63Å; V52-I55 VanDerWaalsContact O-N 3.15Å; V52-L56 HydrophobicContact CG1-CD1 4.02Å; V52-L56 HydrophobicContact CG1-CG 4.35Å; V52-L56 WeakPolarHBondContact O-CG 3.28Å; V52-L56 PolarHBondContact O-N 3.34Å
53	C	94.9	Very high	93.4	Very high	57 Å²	57	77 Å²	77	39%	0.385	39%	0.387	S	S	.	.	H	α-helix	trans	-59.2	-40.1	175.7	-67.3	0	0	0	0	112.4	A49 I50 L56 I57 L189	A49-C53 PolarHBondContact O-N 3.03Å; A49-C53 PolarHBondContact O-SG 3.26Å; I50-C53 PolarHBondContact O-N 3.33Å; C53-L56 PolarHBondContact O-N 3.01Å; C53-I57 WeakPolarHBondContact O-CB 3.47Å; C53-I57 VanDerWaalsContact O-CG1 3.32Å; C53-I57 WeakPolarHBondContact O-CG1 3.35Å; C53-I57 PolarHBondContact O-N 2.78Å; C53-L189 HydrophobicContact CB-CD1 3.99Å
54	C	94.8	Very high	94	Very high	6 Å²	6	74.1 Å²	74.1	4%	0.041	38%	0.379	C	S	.	.	H	α-helix	trans	-60.6	-47.4	174.7	179.5	0	0	0	0	111.2	I50 Y51 V52 L56 I57 S58 Y183 L189	I50-C54 WeakPolarHBondContact O-CB 3.46Å; I50-C54 PolarHBondContact O-N 2.99Å; Y51-C54 WeakPolarHBondContact O-CB 2.96Å; Y51-C54 PolarHBondContact O-N 3.39Å; V52-C54 VanDerWaalsContact C-N 3.3Å; V52-C54 PolarHBondContact O-N 3.34Å; C54-L56 VanDerWaalsContact C-N 3.34Å; C54-L56 PolarHBondContact O-N 3.47Å; C54-I57 PolarHBondContact O-N 3Å; C54-S58 VanDerWaalsContact O-CB 3.31Å; C54-S58 WeakPolarHBondContact O-CB 3.48Å; C54-S58 PolarHBondContact O-N 3.49Å; C54-S58 PolarHBondContact O-OG 3.26Å; C54-Y183 HydrophobicContact CB-CD1 3.94Å; C54-Y183 HydrophobicContact CB-CD2 4.35Å; C54-Y183 HydrophobicContact CB-CE1 4.19Å; C54-Y183 HydrophobicContact CB-CG 4.02Å; C54-Y183 WeakPolarHBondContact SG-CB 3.38Å; C54-Y183 WeakPolarHBondContact SG-CD1 3.24Å; C54-L189 VanDerWaalsContact CA-CD2 3.5Å; C54-L189 HydrophobicContact CB-CD2 3.59Å
55	I	95.8	Very high	94.5	Very high	98 Å²	98	66.6 Å²	66.6	50%	0.503	35%	0.35	S	S	.	.	H	α-helix	trans	-61.8	-45.2	179	-67.9	165.8	0	0	0	110	Y51 V52 S58 V59	Y51-I55 WeakPolarHBondContact O-CG1 3.04Å; Y51-I55 PolarHBondContact O-N 2.92Å; V52-I55 PolarHBondContact O-N 2.63Å; V52-I55 VanDerWaalsContact O-N 3.15Å; I55-S58 PolarHBondContact O-N 3.41Å; I55-V59 HydrophobicContact CG2-CG2 4.22Å; I55-V59 WeakPolarHBondContact O-CB 3.42Å; I55-V59 WeakPolarHBondContact O-CG2 3.37Å; I55-V59 PolarHBondContact O-N 3.36Å
56	L	97.4	Very high	94.8	Very high	112 Å²	112	64.1 Å²	64.1	59%	0.586	34%	0.339	S	S	*	.	H	α-helix	trans	-61.9	-44.7	178.7	-68.9	174.5	0	0	0	112.3	V52 C53 C54 V59 A60	V52-L56 HydrophobicContact CG1-CD1 4.02Å; V52-L56 HydrophobicContact CG1-CG 4.35Å; V52-L56 WeakPolarHBondContact O-CG 3.28Å; V52-L56 PolarHBondContact O-N 3.34Å; C53-L56 PolarHBondContact O-N 3.01Å; C54-L56 VanDerWaalsContact C-N 3.34Å; C54-L56 PolarHBondContact O-N 3.47Å; L56-V59 PolarHBondContact O-N 3.45Å; L56-A60 VanDerWaalsContact O-CB 3.3Å; L56-A60 WeakPolarHBondContact O-CB 3.35Å; L56-A60 PolarHBondContact O-N 2.97Å
57	I	96.3	Very high	95.3	Very high	42 Å²	42	62 Å²	62	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-47.7	175.9	-73.4	169.4	0	0	0	110.7	C53 C54 V59 A60 S61 L189 L193	C53-I57 WeakPolarHBondContact O-CB 3.47Å; C53-I57 VanDerWaalsContact O-CG1 3.32Å; C53-I57 WeakPolarHBondContact O-CG1 3.35Å; C53-I57 PolarHBondContact O-N 2.78Å; C54-I57 PolarHBondContact O-N 3Å; I57-V59 VanDerWaalsContact C-N 3.32Å; I57-V59 PolarHBondContact O-N 2.83Å; I57-A60 PolarHBondContact O-N 2.96Å; I57-S61 WeakPolarHBondContact O-CB 3.37Å; I57-S61 PolarHBondContact O-N 3.01Å; I57-S61 PolarHBondContact O-OG 2.91Å; I57-L189 HydrophobicContact CD1-CB 4.12Å; I57-L189 HydrophobicContact CD1-CD1 4.23Å; I57-L189 HydrophobicContact CD1-CD2 4.3Å; I57-L189 HydrophobicContact CD1-CG 4.46Å; I57-L193 HydrophobicContact CG2-CD2 3.49Å; I57-L193 VanDerWaalsContact CG2-CD2 3.49Å; I57-L193 HydrophobicContact CG2-CG 3.79Å
58	S	97.7	Very high	95.6	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.007	31%	0.309	C	S	.	.	H	α-helix	trans	-59.3	-43.3	178	-66.9	0	0	0	0	111.9	C54 I55 G62 A176 C179 C180	C54-S58 VanDerWaalsContact O-CB 3.31Å; C54-S58 WeakPolarHBondContact O-CB 3.48Å; C54-S58 PolarHBondContact O-N 3.49Å; C54-S58 PolarHBondContact O-OG 3.26Å; I55-S58 PolarHBondContact O-N 3.41Å; S58-G62 PolarHBondContact O-N 3.15Å; S58-A176 WeakPolarHBondContact CB-O 3.49Å; S58-A176 WeakPolarHBondContact O-CA 3.3Å; S58-A176 VanDerWaalsContact O-CB 3.28Å; S58-A176 WeakPolarHBondContact O-CB 3.46Å; S58-A176 PolarHBondContact OG-O 3.32Å; S58-C179 WeakPolarHBondContact OG-CB 3.32Å; S58-C180 PolarHBondContact OG-N 3.16Å; S58-C180 PolarHBondContact OG-SG 3.49Å
59	V	97.9	Very high	95.9	Very high	75 Å²	75	51.5 Å²	51.5	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-67.1	-43.5	177.1	170.8	0	0	0	0	110.6	I55 L56 I57 S61 G62 C63	I55-V59 HydrophobicContact CG2-CG2 4.22Å; I55-V59 WeakPolarHBondContact O-CB 3.42Å; I55-V59 WeakPolarHBondContact O-CG2 3.37Å; I55-V59 PolarHBondContact O-N 3.36Å; L56-V59 PolarHBondContact O-N 3.45Å; I57-V59 VanDerWaalsContact C-N 3.32Å; I57-V59 PolarHBondContact O-N 2.83Å; V59-S61 PolarHBondContact O-N 2.92Å; V59-G62 CarbonylContact O-C 3.27Å; V59-G62 PolarHBondContact O-N 3.49Å; V59-C63 WeakPolarHBondContact O-CB 3.21Å; V59-C63 PolarHBondContact O-N 3.3Å; V59-C63 PolarHBondContact O-SG 2.93Å
60	A	98.1	Very high	96	Very high	61 Å²	61	52.5 Å²	52.5	50%	0.504	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-44.7	177.1	0	0	0	0	0	112.1	L56 I57 G62 C63 F64	L56-A60 VanDerWaalsContact O-CB 3.3Å; L56-A60 WeakPolarHBondContact O-CB 3.35Å; L56-A60 PolarHBondContact O-N 2.97Å; I57-A60 PolarHBondContact O-N 2.96Å; A60-G62 VanDerWaalsContact C-N 3.34Å; A60-G62 PolarHBondContact O-N 3.5Å; A60-C63 PolarHBondContact O-N 3.01Å; A60-F64 PolarHBondContact O-N 2.85Å
61	S	97.8	Very high	96.2	Very high	12 Å²	12	53.5 Å²	53.5	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-57.7	-45.4	171.8	-77.6	0	0	0	0	111.9	I57 V59 F64 L65 L175 S196	I57-S61 WeakPolarHBondContact O-CB 3.37Å; I57-S61 PolarHBondContact O-N 3.01Å; I57-S61 PolarHBondContact O-OG 2.91Å; V59-S61 PolarHBondContact O-N 2.92Å; S61-F64 PolarHBondContact O-N 3.42Å; S61-L65 PolarHBondContact O-N 3.11Å; S61-L175 WeakPolarHBondContact O-CD2 3.48Å; S61-S196 VanDerWaalsContact CB-OG 3.28Å; S61-S196 WeakPolarHBondContact CB-OG 3.4Å; S61-S196 WeakPolarHBondContact OG-CB 3.49Å; S61-S196 PolarHBondContact OG-OG 3.03Å
62	G	98.1	Very high	96.3	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-47.7	175.5	0	0	0	0	0	112.9	S58 V59 A60 F64 L65 V66 G172	S58-G62 PolarHBondContact O-N 3.15Å; V59-G62 CarbonylContact O-C 3.27Å; V59-G62 PolarHBondContact O-N 3.49Å; A60-G62 VanDerWaalsContact C-N 3.34Å; A60-G62 PolarHBondContact O-N 3.5Å; G62-F64 VanDerWaalsContact C-N 3.32Å; G62-F64 PolarHBondContact O-N 3.05Å; G62-L65 WeakPolarHBondContact O-CB 3.46Å; G62-L65 PolarHBondContact O-N 2.76Å; G62-L65 VanDerWaalsContact O-N 3.13Å; G62-V66 WeakPolarHBondContact O-CG2 3.3Å; G62-V66 PolarHBondContact O-N 3.48Å; G62-G172 VanDerWaalsContact CA-O 3.25Å; G62-G172 WeakPolarHBondContact CA-O 3.29Å; G62-G172 WeakPolarHBondContact O-CA 3.47Å
63	C	98.2	Very high	96.2	Very high	74 Å²	74	44.7 Å²	44.7	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-38.5	177.5	-71.5	0	0	0	0	112.2	V59 A60 L65 V66 Y67	V59-C63 WeakPolarHBondContact O-CB 3.21Å; V59-C63 PolarHBondContact O-N 3.3Å; V59-C63 PolarHBondContact O-SG 2.93Å; A60-C63 PolarHBondContact O-N 3.01Å; C63-L65 VanDerWaalsContact C-N 3.34Å; C63-V66 PolarHBondContact O-N 3.46Å; C63-Y67 WeakPolarHBondContact O-CB 3.46Å; C63-Y67 PolarHBondContact O-N 2.97Å
64	F	97.3	Very high	96.1	Very high	71 Å²	71	43.5 Å²	43.5	31%	0.311	23%	0.233	S	C	.	.	H	α-helix	trans	-61.3	-42.8	173.8	179.6	-96.8	0	0	0	111.7	A60 S61 G62 Y67 Y68 L200 F549 Y553	A60-F64 PolarHBondContact O-N 2.85Å; S61-F64 PolarHBondContact O-N 3.42Å; G62-F64 VanDerWaalsContact C-N 3.32Å; G62-F64 PolarHBondContact O-N 3.05Å; F64-Y67 PolarHBondContact O-N 2.72Å; F64-Y68 WeakPolarHBondContact O-CB 3.31Å; F64-Y68 PolarHBondContact O-N 3.48Å; F64-L200 HydrophobicContact CD1-CD1 3.65Å; F64-L200 HydrophobicContact CD1-CD2 3.91Å; F64-L200 HydrophobicContact CD1-CG 4.45Å; F64-L200 HydrophobicContact CE1-CD1 3.73Å; F64-L200 HydrophobicContact CE1-CD2 4Å; F64-L200 HydrophobicContact CE1-CG 4.46Å; F64-F549 AromaticContact CE1-CE1 3.97Å; F64-F549 HydrophobicContact CE1-CE1 3.97Å; F64-F549 HydrophobicContact CE1-CZ 4.28Å; F64-F549 HydrophobicContact CZ-CE1 4.07Å; F64-Y553 HydrophobicContact CE2-CE2 4.29Å; F64-Y553 HydrophobicContact CZ-CD2 4.16Å; F64-Y553 AromaticContact CZ-CE2 3.88Å; F64-Y553 HydrophobicContact CZ-CE2 3.88Å
65	L	96.7	Very high	96	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-39.7	175.4	174.8	60.7	0	0	0	112.3	S61 G62 C63 Y68 A69 G171 L175 F199 L200 L203	S61-L65 PolarHBondContact O-N 3.11Å; G62-L65 WeakPolarHBondContact O-CB 3.46Å; G62-L65 PolarHBondContact O-N 2.76Å; G62-L65 VanDerWaalsContact O-N 3.13Å; C63-L65 VanDerWaalsContact C-N 3.34Å; L65-Y68 PolarHBondContact O-N 3.18Å; L65-A69 WeakPolarHBondContact O-CB 3.34Å; L65-A69 PolarHBondContact O-N 3.31Å; L65-G171 WeakPolarHBondContact CD2-O 3.49Å; L65-L175 HydrophobicContact CB-CD2 3.92Å; L65-L175 HydrophobicContact CD2-CB 3.91Å; L65-L175 HydrophobicContact CD2-CD2 4.01Å; L65-F199 HydrophobicContact CD2-CE1 3.71Å; L65-F199 HydrophobicContact CD2-CZ 4.36Å; L65-L200 HydrophobicContact CB-CD2 4.46Å; L65-L200 HydrophobicContact CD1-CD2 4.32Å; L65-L203 HydrophobicContact CD1-CD1 3.48Å; L65-L203 VanDerWaalsContact CD1-CD1 3.48Å; L65-L203 HydrophobicContact CD1-CD2 4.35Å
66	V	97.2	Very high	95.8	Very high	43 Å²	43	42 Å²	42	26%	0.261	23%	0.226	S	C	.	.	H	α-helix	trans	-60.2	-48.9	174.4	178.4	0	0	0	0	110.4	G62 C63 A69 H70 F168	G62-V66 WeakPolarHBondContact O-CG2 3.3Å; G62-V66 PolarHBondContact O-N 3.48Å; C63-V66 PolarHBondContact O-N 3.46Å; V66-A69 PolarHBondContact O-N 2.86Å; V66-H70 VanDerWaalsContact O-CB 3.31Å; V66-H70 WeakPolarHBondContact O-CB 3.49Å; V66-H70 PolarHBondContact O-N 2.82Å; V66-F168 HydrophobicContact CG1-CB 4.14Å
67	Y	96.8	Very high	95.5	Very high	112 Å²	112	38.2 Å²	38.2	44%	0.439	21%	0.206	S	C	.	.	H	α-helix	trans	-58.8	-48.2	177.4	171.1	-97.6	0	0	0	111.7	C63 F64 A69 H70 M71	C63-Y67 WeakPolarHBondContact O-CB 3.46Å; C63-Y67 PolarHBondContact O-N 2.97Å; F64-Y67 PolarHBondContact O-N 2.72Å; Y67-A69 PolarHBondContact O-N 2.73Å; Y67-H70 PolarHBondContact O-N 3.01Å; Y67-M71 HydrophobicContact CE2-CE 4.16Å; Y67-M71 WeakPolarHBondContact O-CB 3.39Å; Y67-M71 PolarHBondContact O-N 2.68Å
68	Y	95.2	Very high	95.2	Very high	20 Å²	20	42.3 Å²	42.3	8%	0.078	22%	0.219	C	C	.	.	H	α-helix	trans	-59.1	-48	178	178.5	-87.6	0	0	0	111.7	F64 L65 S72 L203 F549 Y553 M557	F64-Y68 WeakPolarHBondContact O-CB 3.31Å; F64-Y68 PolarHBondContact O-N 3.48Å; L65-Y68 PolarHBondContact O-N 3.18Å; Y68-S72 WeakPolarHBondContact O-CB 3.37Å; Y68-S72 PolarHBondContact O-N 3.06Å; Y68-L203 HydrophobicContact CD1-CD2 3.59Å; Y68-L203 HydrophobicContact CE1-CD2 3.23Å; Y68-F549 HydrophobicContact CD2-CZ 4.19Å; Y68-F549 HydrophobicContact CE2-CE2 4.45Å; Y68-F549 HydrophobicContact CE2-CZ 4.03Å; Y68-Y553 AromaticContact CD2-CD2 3.55Å; Y68-Y553 HydrophobicContact CD2-CD2 3.55Å; Y68-Y553 AromaticContact CD2-CE2 3.85Å; Y68-Y553 HydrophobicContact CD2-CE2 3.85Å; Y68-Y553 AromaticContact CE2-CD2 3.67Å; Y68-Y553 HydrophobicContact CE2-CD2 3.67Å; Y68-Y553 HydrophobicContact CE2-CE2 4.35Å; Y68-M557 HydrophobicContact CD2-CE 3.33Å; Y68-M557 HydrophobicContact CE2-CE 3.61Å; Y68-M557 HydrophobicContact CG-CE 4.08Å
69	A	95.1	Very high	94.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-42.8	-179.3	0	0	0	0	0	111.9	L65 V66 Y67 H73 F168 V209	L65-A69 WeakPolarHBondContact O-CB 3.34Å; L65-A69 PolarHBondContact O-N 3.31Å; V66-A69 PolarHBondContact O-N 2.86Å; Y67-A69 PolarHBondContact O-N 2.73Å; A69-H73 VanDerWaalsContact O-CB 3.23Å; A69-H73 WeakPolarHBondContact O-CB 3.48Å; A69-H73 PolarHBondContact O-N 3.46Å; A69-F168 HydrophobicContact CB-CB 4.39Å; A69-F168 HydrophobicContact CB-CD1 3.71Å; A69-F168 HydrophobicContact CB-CE1 4.16Å; A69-F168 HydrophobicContact CB-CG 4.04Å; A69-V209 HydrophobicContact CB-CG1 4.24Å
70	H	95.1	Very high	94.5	Very high	73 Å²	73	41.2 Å²	41.2	34%	0.338	21%	0.214	S	C	.	.	H	α-helix	trans	-63.5	-49.2	176.8	179.8	91.8	0	0	0	111.6	V66 Y67 H73 E74 D165 F168	V66-H70 VanDerWaalsContact O-CB 3.31Å; V66-H70 WeakPolarHBondContact O-CB 3.49Å; V66-H70 PolarHBondContact O-N 2.82Å; Y67-H70 PolarHBondContact O-N 3.01Å; H70-H73 WeakPolarHBondContact O-CB 3.29Å; H70-H73 PolarHBondContact O-N 2.96Å; H70-E74 PolarHBondContact O-N 2.6Å; H70-D165 IonicContact CE1-OD1 3.52Å; H70-D165 IonicContact CG-OD1 2.83Å; H70-D165 IonicContact ND1-OD1 3.88Å; H70-D165 PolarHBondContact ND1-OD1 3.31Å; H70-F168 HydrophobicContact CB-CD2 3.95Å; H70-F168 HydrophobicContact CB-CE2 4.18Å
71	M	94.6	Very high	94.2	Very high	56 Å²	56	45.5 Å²	45.5	28%	0.276	22%	0.221	S	C	.	.	H	α-helix	trans	-68.5	-39.3	-178.9	-169.3	58.9	73.4	0	0	112	Y67 H73 E74 N75 M557	Y67-M71 HydrophobicContact CE2-CE 4.16Å; Y67-M71 WeakPolarHBondContact O-CB 3.39Å; Y67-M71 PolarHBondContact O-N 2.68Å; M71-H73 VanDerWaalsContact C-N 3.31Å; M71-H73 PolarHBondContact O-N 2.72Å; M71-E74 PolarHBondContact O-N 2.73Å; M71-N75 VanDerWaalsContact O-CB 3.25Å; M71-N75 WeakPolarHBondContact O-CB 3.31Å; M71-N75 VanDerWaalsContact O-CG 3.26Å; M71-N75 PolarHBondContact O-N 3.48Å; M71-M557 HydrophobicContact CB-CE 4.16Å; M71-M557 HydrophobicContact CB-SD 3.89Å; M71-M557 HydrophobicContact CG-CE 4.38Å; M71-M557 HydrophobicContact CG-SD 3.46Å; M71-M557 WeakPolarHBondContact CG-SD 3.38Å
72	S	92.5	Very high	93.9	Very high	7 Å²	7	45.3 Å²	45.3	5%	0.049	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-41.3	173.1	177.4	0	0	0	0	111.5	Y68 L76	Y68-S72 WeakPolarHBondContact O-CB 3.37Å; Y68-S72 PolarHBondContact O-N 3.06Å; S72-L76 VanDerWaalsContact O-CB 3.27Å; S72-L76 WeakPolarHBondContact O-CB 3.46Å; S72-L76 WeakPolarHBondContact O-CD1 3.37Å; S72-L76 WeakPolarHBondContact O-CG 3.21Å; S72-L76 PolarHBondContact O-N 3Å
73	H	93.2	Very high	93.5	Very high	14 Å²	14	53.2 Å²	53.2	7%	0.065	25%	0.248	C	C	.	.	H	α-helix	trans	-64.6	-43.3	176.1	-174.6	72.3	0	0	0	112.5	A69 H70 M71 L77 F79 F168	A69-H73 VanDerWaalsContact O-CB 3.23Å; A69-H73 WeakPolarHBondContact O-CB 3.48Å; A69-H73 PolarHBondContact O-N 3.46Å; H70-H73 WeakPolarHBondContact O-CB 3.29Å; H70-H73 PolarHBondContact O-N 2.96Å; M71-H73 VanDerWaalsContact C-N 3.31Å; M71-H73 PolarHBondContact O-N 2.72Å; H73-L77 WeakPolarHBondContact CE1-CD1 3.49Å; H73-L77 WeakPolarHBondContact O-CB 3.48Å; H73-L77 PolarHBondContact O-N 2.81Å; H73-F79 AromaticContact CD2-CD1 3.82Å; H73-F79 AromaticContact CD2-CG 3.71Å; H73-F79 AromaticContact NE2-CD1 3.41Å; H73-F79 WeakPolarHBondContact NE2-CD1 3.48Å; H73-F79 AromaticContact NE2-CD2 3.4Å; H73-F79 WeakPolarHBondContact NE2-CD2 3.34Å; H73-F79 AromaticContact NE2-CE1 3.76Å; H73-F79 AromaticContact NE2-CE2 3.76Å; H73-F79 AromaticContact NE2-CG 3.21Å; H73-F79 WeakPolarHBondContact NE2-CG 3.31Å; H73-F79 AromaticContact NE2-CZ 3.93Å; H73-F168 HydrophobicContact CB-CE2 4.16Å; H73-F168 HydrophobicContact CB-CZ 3.66Å; H73-F168 AromaticContact CG-CZ 3.74Å
74	E	93.4	Very high	93.1	Very high	33 Å²	33	54 Å²	54	15%	0.154	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-45.3	176.9	-173.1	61.6	-163.6	0	0	111.4	H70 M71 L76 W78 F79 S80	H70-E74 PolarHBondContact O-N 2.6Å; M71-E74 PolarHBondContact O-N 2.73Å; E74-L76 VanDerWaalsContact C-N 3.34Å; E74-L76 PolarHBondContact O-N 3.32Å; E74-W78 WeakPolarHBondContact O-CA 3.13Å; E74-W78 PolarHBondContact O-N 3.17Å; E74-F79 PolarHBondContact OE2-N 2.78Å; E74-S80 WeakPolarHBondContact OE1-CB 3.48Å; E74-S80 PolarHBondContact OE1-N 3.31Å; E74-S80 PolarHBondContact OE1-OG 3.11Å; E74-S80 WeakPolarHBondContact OE2-CB 3.3Å; E74-S80 PolarHBondContact OE2-N 3.34Å
75	N	92.6	Very high	92.8	Very high	15 Å²	15	52 Å²	52	8%	0.08	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-35.9	178.6	-78.1	3.5	0	0	0	113	M71 T556 M557 E559 L560 R561	M71-N75 VanDerWaalsContact O-CB 3.25Å; M71-N75 WeakPolarHBondContact O-CB 3.31Å; M71-N75 VanDerWaalsContact O-CG 3.26Å; M71-N75 PolarHBondContact O-N 3.48Å; N75-T556 PolarHBondContact ND2-O 2.89Å; N75-M557 WeakPolarHBondContact ND2-CA 3.5Å; N75-M557 PolarHBondContact ND2-O 3.2Å; N75-E559 WeakPolarHBondContact CB-O 3.16Å; N75-L560 HydrophobicContact CB-CD2 4.18Å; N75-L560 WeakPolarHBondContact OD1-CD2 3.44Å; N75-R561 PolarHBondContact O-N 3.27Å
76	L	90.4	Very high	92.6	Very high	58 Å²	58	54 Å²	54	30%	0.304	25%	0.247	S	C	.	.	H	α-helix	trans	-81.1	-27.4	-177.1	-74.7	172	0	0	0	114.2	S72 E74 R561	S72-L76 VanDerWaalsContact O-CB 3.27Å; S72-L76 WeakPolarHBondContact O-CB 3.46Å; S72-L76 WeakPolarHBondContact O-CD1 3.37Å; S72-L76 WeakPolarHBondContact O-CG 3.21Å; S72-L76 PolarHBondContact O-N 3Å; E74-L76 VanDerWaalsContact C-N 3.34Å; E74-L76 PolarHBondContact O-N 3.32Å; L76-R561 CarbonylContact C-O 3.58Å; L76-R561 WeakPolarHBondContact O-CB 3.33Å
77	L	90.5	Very high	92.5	Very high	32 Å²	32	52.6 Å²	52.6	17%	0.168	24%	0.237	C	C	.	.	H	α-helix	trans	-120.1	-18.2	-173.2	-60.3	179.5	0	0	0	113.8	H73 F79 L82 F563	H73-L77 WeakPolarHBondContact CE1-CD1 3.49Å; H73-L77 WeakPolarHBondContact O-CB 3.48Å; H73-L77 PolarHBondContact O-N 2.81Å; L77-F79 HydrophobicContact CB-CB 4.17Å; L77-F79 HydrophobicContact CD1-CD2 4.1Å; L77-F79 PolarHBondContact O-N 2.87Å; L77-L82 WeakPolarHBondContact O-CD1 3.49Å; L77-F563 HydrophobicContact CB-CB 4.28Å; L77-F563 HydrophobicContact CD2-CB 4.09Å; L77-F563 HydrophobicContact CD2-CD2 3.97Å; L77-F563 HydrophobicContact CD2-CG 4.45Å; L77-F563 WeakPolarHBondContact O-CB 3.39Å; L77-F563 PolarHBondContact O-N 2.89Å
78	W	90.3	Very high	92.4	Very high	127 Å²	127	47.4 Å²	47.4	48%	0.481	22%	0.217	S	C	.	.			trans	55.2	39.3	-162.6	-148.8	-2.1	0	0	0	112.9	E74 S80 K81 L82 E562	E74-W78 WeakPolarHBondContact O-CA 3.13Å; E74-W78 PolarHBondContact O-N 3.17Å; W78-S80 VanDerWaalsContact C-N 3.31Å; W78-S80 PolarHBondContact O-N 3.2Å; W78-S80 VanDerWaalsContact O-N 3.15Å; W78-K81 HydrophobicContact CD2-CB 4.32Å; W78-K81 HydrophobicContact CD2-CG 4.43Å; W78-K81 HydrophobicContact CG-CB 4.1Å; W78-K81 HydrophobicContact CG-CG 4.24Å; W78-K81 PolarHBondContact O-N 2.7Å; W78-L82 PolarHBondContact O-N 3.1Å; W78-E562 HydrophobicContact CB-CG 4.43Å; W78-E562 HydrophobicContact CE3-CB 4.1Å; W78-E562 HydrophobicContact CE3-CG 3.93Å
79	F	91.6	Very high	92.3	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.018	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-40.8	-161.4	-168.6	-111.1	0	0	0	113.9	H73 E74 L77 K81 L82 R87 S90 M91 I160 L161	H73-F79 AromaticContact CD2-CD1 3.82Å; H73-F79 AromaticContact CD2-CG 3.71Å; H73-F79 AromaticContact NE2-CD1 3.41Å; H73-F79 WeakPolarHBondContact NE2-CD1 3.48Å; H73-F79 AromaticContact NE2-CD2 3.4Å; H73-F79 WeakPolarHBondContact NE2-CD2 3.34Å; H73-F79 AromaticContact NE2-CE1 3.76Å; H73-F79 AromaticContact NE2-CE2 3.76Å; H73-F79 AromaticContact NE2-CG 3.21Å; H73-F79 WeakPolarHBondContact NE2-CG 3.31Å; H73-F79 AromaticContact NE2-CZ 3.93Å; E74-F79 PolarHBondContact OE2-N 2.78Å; L77-F79 HydrophobicContact CB-CB 4.17Å; L77-F79 HydrophobicContact CD1-CD2 4.1Å; L77-F79 PolarHBondContact O-N 2.87Å; F79-K81 PolarHBondContact O-N 2.76Å; F79-L82 HydrophobicContact CD2-CD1 4.38Å; F79-L82 PolarHBondContact O-N 3.05Å; F79-R87 HydrophobicContact CD2-CB 4.24Å; F79-R87 HydrophobicContact CD2-CG 4.01Å; F79-R87 HydrophobicContact CE2-CB 3.55Å; F79-R87 HydrophobicContact CE2-CG 3.78Å; F79-R87 HydrophobicContact CZ-CB 3.86Å; F79-R87 HydrophobicContact CZ-CG 4.1Å; F79-R87 WeakPolarHBondContact O-CD 3.35Å; F79-R87 PolarHBondContact O-NE 3.19Å; F79-S90 WeakPolarHBondContact CE2-OG 3.28Å; F79-M91 HydrophobicContact CZ-CE 4.1Å; F79-I160 HydrophobicContact CZ-CD1 4.13Å; F79-I160 HydrophobicContact CZ-CG1 4.01Å; F79-L161 HydrophobicContact CD1-CD2 3.78Å; F79-L161 HydrophobicContact CE1-CD2 3.78Å
80	S	90.5	Very high	92.1	Very high	49 Å²	49	47.3 Å²	47.3	34%	0.343	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.9	179.7	76.6	0	0	0	0	113.7	E74 W78 R87	E74-S80 WeakPolarHBondContact OE1-CB 3.48Å; E74-S80 PolarHBondContact OE1-N 3.31Å; E74-S80 PolarHBondContact OE1-OG 3.11Å; E74-S80 WeakPolarHBondContact OE2-CB 3.3Å; E74-S80 PolarHBondContact OE2-N 3.34Å; W78-S80 VanDerWaalsContact C-N 3.31Å; W78-S80 PolarHBondContact O-N 3.2Å; W78-S80 VanDerWaalsContact O-N 3.15Å; S80-R87 PolarHBondContact O-NH2 3.36Å
81	K	91.2	Very high	91.9	Very high	151 Å²	151	43.9 Å²	43.9	66%	0.657	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-18	-178	-61.4	-52.9	-175.9	-176.6	0	114.5	W78 F79	W78-K81 HydrophobicContact CD2-CB 4.32Å; W78-K81 HydrophobicContact CD2-CG 4.43Å; W78-K81 HydrophobicContact CG-CB 4.1Å; W78-K81 HydrophobicContact CG-CG 4.24Å; W78-K81 PolarHBondContact O-N 2.7Å; F79-K81 PolarHBondContact O-N 2.76Å
82	L	90.4	Very high	91.6	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.042	22%	0.215	C	C	.	.	S	Bend	trans	-61.1	151.4	175	-65.7	178.8	0	0	0	112.1	L77 W78 F79 E86 R87 F563	L77-L82 WeakPolarHBondContact O-CD1 3.49Å; W78-L82 PolarHBondContact O-N 3.1Å; F79-L82 HydrophobicContact CD2-CD1 4.38Å; F79-L82 PolarHBondContact O-N 3.05Å; L82-E86 HydrophobicContact CB-CB 4.01Å; L82-E86 HydrophobicContact CD1-CB 4.41Å; L82-E86 HydrophobicContact CD2-CB 4.24Å; L82-E86 HydrophobicContact CG-CB 4.45Å; L82-R87 HydrophobicContact CB-CG 3.64Å; L82-R87 HydrophobicContact CD1-CG 4.35Å; L82-R87 VanDerWaalsContact O-CZ 3.29Å; L82-R87 PolarHBondContact O-NE 3.2Å; L82-R87 VanDerWaalsContact O-NE 3.1Å; L82-R87 PolarHBondContact O-NH2 3.4Å; L82-F563 HydrophobicContact CD1-CB 3.67Å; L82-F563 HydrophobicContact CD1-CD1 4.22Å; L82-F563 HydrophobicContact CD1-CG 4.23Å; L82-F563 HydrophobicContact CD2-CB 4.16Å
83	R	90.9	Very high	91.5	Very high	169 Å²	169	49.8 Å²	49.8	64%	0.638	23%	0.225	S	C	*	.			trans	-68.9	158.8	168.7	-58.7	176.1	-174	-175.2	4.7	109.9	V85 E86 R87	R83-V85 VanDerWaalsContact C-N 3.32Å; R83-V85 PolarHBondContact O-N 3.38Å; R83-E86 HydrophobicContact CB-CG 4.46Å; R83-E86 VanDerWaalsContact CB-OE2 3.27Å; R83-E86 WeakPolarHBondContact CB-OE2 3.44Å; R83-E86 WeakPolarHBondContact CG-OE2 3.34Å; R83-E86 PolarHBondContact N-OE2 2.96Å; R83-E86 WeakPolarHBondContact O-CB 3.23Å; R83-E86 PolarHBondContact O-N 3.42Å; R83-R87 WeakPolarHBondContact O-CG 3.25Å; R83-R87 PolarHBondContact O-N 3.34Å
84	E	89.9	Confident	91.4	Very high	90 Å²	90	50.6 Å²	50.6	42%	0.421	23%	0.229	S	C	.	.	H	α-helix	trans	-52.6	-47.5	-178.2	-171.9	177.1	169.5	0	0	112.7	E86 R87 E88 K103	E84-E86 VanDerWaalsContact C-N 3.33Å; E84-E86 PolarHBondContact O-N 3.43Å; E84-R87 WeakPolarHBondContact O-CB 3.4Å; E84-R87 PolarHBondContact O-N 2.88Å; E84-E88 WeakPolarHBondContact O-CG 3.36Å; E84-E88 PolarHBondContact O-N 3.42Å; E84-K103 IonicContact OE1-NZ 2.8Å
85	V	91.2	Very high	91.4	Very high	29 Å²	29	49.9 Å²	49.9	18%	0.176	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-39.8	178.2	178.1	0	0	0	0	111.9	R83 E88 I89 M572 Y573	R83-V85 VanDerWaalsContact C-N 3.32Å; R83-V85 PolarHBondContact O-N 3.38Å; V85-E88 PolarHBondContact O-N 2.93Å; V85-I89 HydrophobicContact CG1-CD1 3.77Å; V85-I89 HydrophobicContact CG1-CG1 4.35Å; V85-I89 WeakPolarHBondContact O-CG1 3.4Å; V85-I89 PolarHBondContact O-N 2.84Å; V85-M572 HydrophobicContact CG1-CB 4.27Å; V85-Y573 HydrophobicContact CG2-CE1 4.22Å
86	E	93.1	Very high	91.4	Very high	44 Å²	44	49.2 Å²	49.2	21%	0.206	22%	0.221	C	C	.	.	H	α-helix	trans	-68.1	-40.5	178.9	-68.4	165.5	149.5	0	0	111.2	L82 R83 E84 E88 I89 S90 F563 V569	L82-E86 HydrophobicContact CB-CB 4.01Å; L82-E86 HydrophobicContact CD1-CB 4.41Å; L82-E86 HydrophobicContact CD2-CB 4.24Å; L82-E86 HydrophobicContact CG-CB 4.45Å; R83-E86 HydrophobicContact CB-CG 4.46Å; R83-E86 VanDerWaalsContact CB-OE2 3.27Å; R83-E86 WeakPolarHBondContact CB-OE2 3.44Å; R83-E86 WeakPolarHBondContact CG-OE2 3.34Å; R83-E86 PolarHBondContact N-OE2 2.96Å; R83-E86 WeakPolarHBondContact O-CB 3.23Å; R83-E86 PolarHBondContact O-N 3.42Å; E84-E86 VanDerWaalsContact C-N 3.33Å; E84-E86 PolarHBondContact O-N 3.43Å; E86-E88 VanDerWaalsContact C-N 3.3Å; E86-E88 PolarHBondContact O-N 3.38Å; E86-I89 PolarHBondContact O-N 3.39Å; E86-S90 PolarHBondContact O-N 3.22Å; E86-F563 HydrophobicContact CB-CD1 4.4Å; E86-V569 HydrophobicContact CG-CG2 3.85Å
87	R	93.8	Very high	91.6	Very high	14 Å²	14	46.4 Å²	46.4	5%	0.053	21%	0.207	C	C	.	.	H	α-helix	trans	-60.6	-41.7	172.6	-64.7	-178	-168.8	146.9	-5.5	111.1	F79 S80 L82 R83 E84 S90 M91 E158 I160	F79-R87 HydrophobicContact CD2-CB 4.24Å; F79-R87 HydrophobicContact CD2-CG 4.01Å; F79-R87 HydrophobicContact CE2-CB 3.55Å; F79-R87 HydrophobicContact CE2-CG 3.78Å; F79-R87 HydrophobicContact CZ-CB 3.86Å; F79-R87 HydrophobicContact CZ-CG 4.1Å; F79-R87 WeakPolarHBondContact O-CD 3.35Å; F79-R87 PolarHBondContact O-NE 3.19Å; S80-R87 PolarHBondContact O-NH2 3.36Å; L82-R87 HydrophobicContact CB-CG 3.64Å; L82-R87 HydrophobicContact CD1-CG 4.35Å; L82-R87 VanDerWaalsContact O-CZ 3.29Å; L82-R87 PolarHBondContact O-NE 3.2Å; L82-R87 VanDerWaalsContact O-NE 3.1Å; L82-R87 PolarHBondContact O-NH2 3.4Å; R83-R87 WeakPolarHBondContact O-CG 3.25Å; R83-R87 PolarHBondContact O-N 3.34Å; E84-R87 WeakPolarHBondContact O-CB 3.4Å; E84-R87 PolarHBondContact O-N 2.88Å; R87-S90 WeakPolarHBondContact O-CB 3.5Å; R87-S90 PolarHBondContact O-N 3.3Å; R87-S90 PolarHBondContact O-OG 3.07Å; R87-M91 PolarHBondContact O-N 3.41Å; R87-E158 IonicContact CZ-OE1 2.63Å; R87-E158 IonicContact CZ-OE2 3.09Å; R87-E158 IonicContact NH1-OE1 3.44Å; R87-E158 PolarHBondContact NH1-OE1 3.42Å; R87-E158 VanDerWaalsContact NH1-OE1 3.17Å; R87-E158 IonicContact NH1-OE2 2.94Å; R87-E158 PolarHBondContact NH1-OE2 3.29Å; R87-E158 IonicContact NH2-OE1 2.78Å; R87-E158 PolarHBondContact NH2-OE1 3.43Å; R87-I160 HydrophobicContact CB-CD1 3.61Å
88	E	94.3	Very high	91.9	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-66.6	-41.4	177.8	-73.1	178.5	175.9	0	0	112.9	E84 V85 E86 S90 M91 Y99 K103 I160 C598	E84-E88 WeakPolarHBondContact O-CG 3.36Å; E84-E88 PolarHBondContact O-N 3.42Å; V85-E88 PolarHBondContact O-N 2.93Å; E86-E88 VanDerWaalsContact C-N 3.3Å; E86-E88 PolarHBondContact O-N 3.38Å; E88-S90 VanDerWaalsContact C-N 3.27Å; E88-S90 PolarHBondContact O-N 3.23Å; E88-M91 WeakPolarHBondContact O-CB 3.29Å; E88-M91 PolarHBondContact O-N 3.16Å; E88-M91 VanDerWaalsContact O-N 3.08Å; E88-Y99 HydrophobicContact CG-CD1 4.23Å; E88-Y99 HydrophobicContact CG-CE1 3.77Å; E88-K103 WeakPolarHBondContact OE1-CD 3.41Å; E88-K103 VanDerWaalsContact OE1-CE 3.29Å; E88-K103 WeakPolarHBondContact OE1-CE 3.46Å; E88-K103 IonicContact OE1-NZ 3.88Å; E88-K103 PolarHBondContact OE1-NZ 3.49Å; E88-K103 IonicContact OE2-NZ 2.7Å; E88-K103 PolarHBondContact OE2-NZ 3.31Å; E88-I160 HydrophobicContact CG-CD1 4.01Å; E88-C598 WeakPolarHBondContact OE2-CA 3.38Å
89	I	93.1	Very high	92.1	Very high	10 Å²	10	39 Å²	39	5%	0.051	18%	0.176	C	C	.	.	H	α-helix	trans	-63.4	-36.4	175.3	-66.9	165	0	0	0	110.7	V85 E86 M91 R92 F563 T568 V569 M572	V85-I89 HydrophobicContact CG1-CD1 3.77Å; V85-I89 HydrophobicContact CG1-CG1 4.35Å; V85-I89 WeakPolarHBondContact O-CG1 3.4Å; V85-I89 PolarHBondContact O-N 2.84Å; E86-I89 PolarHBondContact O-N 3.39Å; I89-M91 PolarHBondContact O-N 3.23Å; I89-R92 WeakPolarHBondContact O-CG 3.09Å; I89-F563 HydrophobicContact CB-CE1 4.27Å; I89-F563 HydrophobicContact CB-CZ 4.29Å; I89-F563 HydrophobicContact CG2-CE1 4.05Å; I89-F563 HydrophobicContact CG2-CZ 3.7Å; I89-T568 HydrophobicContact CD1-CG2 4.14Å; I89-T568 HydrophobicContact CG1-CG2 4.17Å; I89-T568 HydrophobicContact CG2-CG2 3.6Å; I89-V569 HydrophobicContact CD1-CB 4.18Å; I89-V569 HydrophobicContact CD1-CG2 3.55Å; I89-M572 HydrophobicContact CD1-CB 4.44Å; I89-M572 HydrophobicContact CD1-CG 3.99Å; I89-M572 HydrophobicContact CG1-CG 4.11Å
90	S	92.1	Very high	92.3	Very high	9 Å²	9	39.2 Å²	39.2	6%	0.063	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-24.8	175.8	86.1	0	0	0	0	112.8	F79 E86 R87 E88 R92	F79-S90 WeakPolarHBondContact CE2-OG 3.28Å; E86-S90 PolarHBondContact O-N 3.22Å; R87-S90 WeakPolarHBondContact O-CB 3.5Å; R87-S90 PolarHBondContact O-N 3.3Å; R87-S90 PolarHBondContact O-OG 3.07Å; E88-S90 VanDerWaalsContact C-N 3.27Å; E88-S90 PolarHBondContact O-N 3.23Å; S90-R92 VanDerWaalsContact C-N 3.26Å; S90-R92 PolarHBondContact O-N 2.93Å
91	M	90.7	Very high	92.6	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	16%	0.163	C	C	.	.	S	Bend	trans	-79.9	68.5	172.4	-61.7	-166.4	177.1	0	0	111.3	F79 R87 E88 I89 R95 G96 Y99 I160 Y163 T164	F79-M91 HydrophobicContact CZ-CE 4.1Å; R87-M91 PolarHBondContact O-N 3.41Å; E88-M91 WeakPolarHBondContact O-CB 3.29Å; E88-M91 PolarHBondContact O-N 3.16Å; E88-M91 VanDerWaalsContact O-N 3.08Å; I89-M91 PolarHBondContact O-N 3.23Å; M91-R95 HydrophobicContact CB-CB 4.16Å; M91-G96 WeakPolarHBondContact O-CA 3.34Å; M91-G96 PolarHBondContact O-N 3.3Å; M91-Y99 HydrophobicContact CE-CD2 4.39Å; M91-Y99 HydrophobicContact CE-CG 4.39Å; M91-Y99 VanDerWaalsContact SD-CB 3.54Å; M91-Y99 HydrophobicContact SD-CD1 3.88Å; M91-Y99 HydrophobicContact SD-CD2 4.09Å; M91-Y99 HydrophobicContact SD-CG 3.54Å; M91-Y99 VanDerWaalsContact SD-CG 3.54Å; M91-I160 HydrophobicContact CE-CD1 3.84Å; M91-I160 HydrophobicContact CE-CG1 3.47Å; M91-I160 VanDerWaalsContact CE-CG1 3.47Å; M91-I160 HydrophobicContact SD-CD1 4.44Å; M91-Y163 HydrophobicContact CE-CD1 4.3Å; M91-T164 VanDerWaalsContact CE-OG1 3.29Å; M91-T164 WeakPolarHBondContact CE-OG1 3.3Å
92	R	88.9	Confident	92.9	Very high	144 Å²	144	29.7 Å²	29.7	54%	0.543	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	154.2	-177.6	-64.9	-175.3	172.5	171.2	-3.4	113.5	I89 S90 R95 D565	I89-R92 WeakPolarHBondContact O-CG 3.09Å; S90-R92 VanDerWaalsContact C-N 3.26Å; S90-R92 PolarHBondContact O-N 2.93Å; R92-R95 PolarHBondContact O-N 2.82Å; R92-D565 IonicContact CZ-OD2 3.29Å; R92-D565 IonicContact NH2-OD2 3.52Å; R92-D565 PolarHBondContact NH2-OD2 3.15Å
93	T	89.9	Confident	93.1	Very high	42 Å²	42	31.3 Å²	31.3	26%	0.258	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	-128.8	172.5	72.4	0	0	0	0	113.8	R95 G96 L97 Q590 A593	T93-R95 PolarHBondContact O-N 3.44Å; T93-G96 PolarHBondContact O-N 3.08Å; T93-L97 PolarHBondContact O-N 3.14Å; T93-Q590 HydrophobicContact CG2-CB 3.81Å; T93-Q590 HydrophobicContact CG2-CG 3.66Å; T93-A593 WeakPolarHBondContact O-CB 3.21Å
94	E	90.9	Very high	93.3	Very high	31 Å²	31	25.5 Å²	25.5	15%	0.145	12%	0.118	C	C	.	.	H	α-helix	trans	-60	-31.3	-177.5	-64.9	178.6	-145.1	0	0	112.8	L97 Y98 L215 P607	E94-L97 WeakPolarHBondContact O-CB 3.39Å; E94-L97 PolarHBondContact O-N 3.01Å; E94-Y98 HydrophobicContact CB-CD2 4.33Å; E94-Y98 HydrophobicContact CB-CE2 3.62Å; E94-Y98 WeakPolarHBondContact O-CD2 3.27Å; E94-Y98 PolarHBondContact O-N 2.83Å; E94-Y98 PolarHBondContact OE2-OH 2.9Å; E94-L215 HydrophobicContact CB-CD2 4.18Å; E94-P607 HydrophobicContact CG-CB 3.84Å
95	R	93.1	Very high	93.7	Very high	19 Å²	19	21.2 Å²	21.2	7%	0.072	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-47.1	-177.7	-60.8	170	62.9	-159.6	-1.9	111.3	M91 R92 T93 L97 Y98 Y99 G213 L215	M91-R95 HydrophobicContact CB-CB 4.16Å; R92-R95 PolarHBondContact O-N 2.82Å; T93-R95 PolarHBondContact O-N 3.44Å; R95-L97 VanDerWaalsContact C-N 3.32Å; R95-Y98 PolarHBondContact O-N 3.26Å; R95-Y99 WeakPolarHBondContact O-CB 3.42Å; R95-Y99 PolarHBondContact O-N 3.42Å; R95-G213 WeakPolarHBondContact CD-O 3.48Å; R95-G213 WeakPolarHBondContact CG-O 3.46Å; R95-G213 PolarHBondContact NE-O 3.04Å; R95-L215 HydrophobicContact CG-CD2 3.74Å; R95-L215 HydrophobicContact CG-CG 4.04Å
96	G	93.4	Very high	93.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-67	-36.2	176.5	0	0	0	0	0	111.7	M91 T93 Y99 S100 C597	M91-G96 WeakPolarHBondContact O-CA 3.34Å; M91-G96 PolarHBondContact O-N 3.3Å; T93-G96 PolarHBondContact O-N 3.08Å; G96-Y99 PolarHBondContact O-N 3.21Å; G96-S100 WeakPolarHBondContact O-CB 3.34Å; G96-S100 PolarHBondContact O-N 3.41Å; G96-C597 WeakPolarHBondContact O-CB 3.49Å; G96-C597 PolarHBondContact O-SG 3.44Å
97	L	94.6	Very high	93.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.1	-49.3	174	-171.5	64.6	0	0	0	111.5	T93 E94 R95 S100 Y101 T124 A593 K596 H606 H608	T93-L97 PolarHBondContact O-N 3.14Å; E94-L97 WeakPolarHBondContact O-CB 3.39Å; E94-L97 PolarHBondContact O-N 3.01Å; R95-L97 VanDerWaalsContact C-N 3.32Å; L97-S100 WeakPolarHBondContact O-CB 3.27Å; L97-S100 PolarHBondContact O-N 2.85Å; L97-S100 PolarHBondContact O-OG 3.08Å; L97-Y101 HydrophobicContact CD1-CE2 4.42Å; L97-Y101 HydrophobicContact CG-CE2 3.96Å; L97-Y101 VanDerWaalsContact O-CD2 3.3Å; L97-Y101 WeakPolarHBondContact O-CD2 3.2Å; L97-Y101 WeakPolarHBondContact O-CE2 3.33Å; L97-T124 HydrophobicContact CD1-CG2 4.32Å; L97-A593 HydrophobicContact CB-CB 4.05Å; L97-K596 HydrophobicContact CD1-CD 4.01Å; L97-H606 HydrophobicContact CD2-CB 4.09Å; L97-H608 HydrophobicContact CD2-CB 4.44Å
98	Y	95.3	Very high	93.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.4	-43.8	178.2	-56.6	-38.2	0	0	0	111.8	E94 R95 S100 Y101 Y102 I138 L215 R216	E94-Y98 HydrophobicContact CB-CD2 4.33Å; E94-Y98 HydrophobicContact CB-CE2 3.62Å; E94-Y98 WeakPolarHBondContact O-CD2 3.27Å; E94-Y98 PolarHBondContact O-N 2.83Å; E94-Y98 PolarHBondContact OE2-OH 2.9Å; R95-Y98 PolarHBondContact O-N 3.26Å; Y98-S100 PolarHBondContact O-N 2.85Å; Y98-Y101 PolarHBondContact O-N 3.41Å; Y98-Y101 VanDerWaalsContact O-N 3.13Å; Y98-Y102 PolarHBondContact O-N 3.28Å; Y98-I138 HydrophobicContact CD1-CG2 4.36Å; Y98-L215 HydrophobicContact CE2-CD2 4.49Å; Y98-R216 HydrophobicContact CD2-CG 4.27Å; Y98-R216 HydrophobicContact CE1-CG 4.48Å; Y98-R216 HydrophobicContact CE2-CG 3.85Å; Y98-R216 VanDerWaalsContact CZ-NE 3.32Å; Y98-R216 VanDerWaalsContact OH-CZ 3.3Å; Y98-R216 PolarHBondContact OH-NE 2.92Å; Y98-R216 PolarHBondContact OH-NH2 3.15Å
99	Y	95.9	Very high	93.9	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-59	-37.1	175.9	-179.9	-111.7	0	0	0	112	E88 M91 R95 G96 Y101 Y102 K103 I160 Y163	E88-Y99 HydrophobicContact CG-CD1 4.23Å; E88-Y99 HydrophobicContact CG-CE1 3.77Å; M91-Y99 HydrophobicContact CE-CD2 4.39Å; M91-Y99 HydrophobicContact CE-CG 4.39Å; M91-Y99 VanDerWaalsContact SD-CB 3.54Å; M91-Y99 HydrophobicContact SD-CD1 3.88Å; M91-Y99 HydrophobicContact SD-CD2 4.09Å; M91-Y99 HydrophobicContact SD-CG 3.54Å; M91-Y99 VanDerWaalsContact SD-CG 3.54Å; R95-Y99 WeakPolarHBondContact O-CB 3.42Å; R95-Y99 PolarHBondContact O-N 3.42Å; G96-Y99 PolarHBondContact O-N 3.21Å; Y99-Y101 VanDerWaalsContact C-N 3.27Å; Y99-Y101 PolarHBondContact O-N 3.38Å; Y99-Y102 AromaticContact CD2-CD1 3.76Å; Y99-Y102 HydrophobicContact CD2-CD1 3.76Å; Y99-Y102 HydrophobicContact CD2-CE1 4.46Å; Y99-Y102 AromaticContact CE2-CD1 3.53Å; Y99-Y102 HydrophobicContact CE2-CD1 3.53Å; Y99-Y102 AromaticContact CE2-CE1 3.86Å; Y99-Y102 HydrophobicContact CE2-CE1 3.86Å; Y99-Y102 PolarHBondContact O-N 2.92Å; Y99-K103 HydrophobicContact CE1-CB 4.23Å; Y99-K103 HydrophobicContact CE1-CD 4.09Å; Y99-K103 VanDerWaalsContact O-CB 3.31Å; Y99-K103 WeakPolarHBondContact O-CB 3.45Å; Y99-K103 PolarHBondContact O-N 3.4Å; Y99-I160 HydrophobicContact CD1-CD1 4.4Å; Y99-I160 HydrophobicContact CD2-CG1 4.46Å; Y99-I160 HydrophobicContact CE1-CD1 3.77Å; Y99-I160 HydrophobicContact CE1-CG1 4.08Å; Y99-I160 HydrophobicContact CE2-CB 3.96Å; Y99-I160 HydrophobicContact CE2-CD1 4.39Å; Y99-I160 HydrophobicContact CE2-CG1 3.78Å; Y99-I160 VanDerWaalsContact OH-CB 3.3Å; Y99-I160 WeakPolarHBondContact OH-CB 3.39Å; Y99-Y163 AromaticContact CD2-CD1 3.4Å; Y99-Y163 HydrophobicContact CD2-CD1 3.4Å; Y99-Y163 VanDerWaalsContact CD2-CD1 3.4Å; Y99-Y163 AromaticContact CD2-CE1 3.81Å; Y99-Y163 HydrophobicContact CD2-CE1 3.81Å; Y99-Y163 AromaticContact CD2-CG 3.93Å; Y99-Y163 HydrophobicContact CD2-CG 3.93Å; Y99-Y163 HydrophobicContact CE2-CD1 4.18Å; Y99-Y163 HydrophobicContact CE2-CG 4.39Å; Y99-Y163 HydrophobicContact CG-CD1 4.26Å; Y99-Y163 HydrophobicContact CG-CE1 4.31Å
100	S	95.7	Very high	94	Very high	10 Å²	10	31.1 Å²	31.1	7%	0.07	16%	0.161	C	C	.	.	H	α-helix	trans	-58.3	-36.5	177.1	79.5	0	0	0	0	113.2	G96 L97 Y98 Q104 K596	G96-S100 WeakPolarHBondContact O-CB 3.34Å; G96-S100 PolarHBondContact O-N 3.41Å; L97-S100 WeakPolarHBondContact O-CB 3.27Å; L97-S100 PolarHBondContact O-N 2.85Å; L97-S100 PolarHBondContact O-OG 3.08Å; Y98-S100 PolarHBondContact O-N 2.85Å; S100-Q104 WeakPolarHBondContact O-CB 3.27Å; S100-Q104 PolarHBondContact O-N 2.98Å; S100-K596 PolarHBondContact OG-NZ 2.86Å
101	Y	96.3	Very high	94	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-72.7	-41.7	176.8	-54.8	-55.2	0	0	0	111.9	L97 Y98 Y99 Q104 L105 L118 T124 V132 F136 I138	L97-Y101 HydrophobicContact CD1-CE2 4.42Å; L97-Y101 HydrophobicContact CG-CE2 3.96Å; L97-Y101 VanDerWaalsContact O-CD2 3.3Å; L97-Y101 WeakPolarHBondContact O-CD2 3.2Å; L97-Y101 WeakPolarHBondContact O-CE2 3.33Å; Y98-Y101 PolarHBondContact O-N 3.41Å; Y98-Y101 VanDerWaalsContact O-N 3.13Å; Y99-Y101 VanDerWaalsContact C-N 3.27Å; Y99-Y101 PolarHBondContact O-N 3.38Å; Y101-Q104 PolarHBondContact O-N 3.44Å; Y101-L105 WeakPolarHBondContact O-CG 3.13Å; Y101-L105 PolarHBondContact O-N 2.88Å; Y101-L118 HydrophobicContact CD1-CD2 3.57Å; Y101-L118 HydrophobicContact CE1-CD2 4.33Å; Y101-L118 HydrophobicContact CG-CD2 4.36Å; Y101-T124 WeakPolarHBondContact OH-CG2 3.41Å; Y101-T124 PolarHBondContact OH-OG1 3.14Å; Y101-V132 HydrophobicContact CD1-CG1 3.68Å; Y101-V132 HydrophobicContact CD2-CG1 4.06Å; Y101-V132 HydrophobicContact CE1-CB 4.38Å; Y101-V132 HydrophobicContact CE1-CG1 3.45Å; Y101-V132 VanDerWaalsContact CE1-CG1 3.45Å; Y101-V132 HydrophobicContact CE1-CG2 3.92Å; Y101-V132 HydrophobicContact CE2-CG1 3.89Å; Y101-V132 HydrophobicContact CG-CG1 3.98Å; Y101-F136 HydrophobicContact CE2-CD2 4.16Å; Y101-F136 AromaticContact CZ-CD2 3.94Å; Y101-F136 WeakPolarHBondContact OH-CD2 3.32Å; Y101-F136 VanDerWaalsContact OH-CE2 3.23Å; Y101-F136 WeakPolarHBondContact OH-CE2 3.49Å; Y101-I138 HydrophobicContact CD2-CB 4.48Å; Y101-I138 HydrophobicContact CD2-CD1 4.31Å; Y101-I138 HydrophobicContact CD2-CG2 3.62Å; Y101-I138 HydrophobicContact CE2-CG2 3.98Å; Y101-I138 HydrophobicContact CG-CD1 4.1Å; Y101-I138 HydrophobicContact CG-CG2 4.49Å
102	Y	96.8	Very high	94.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.1	-48.3	172.6	167	-95	0	0	0	111	Y98 Y99 Q104 L105 V106 L144 A145 P159 F162 Y163	Y98-Y102 PolarHBondContact O-N 3.28Å; Y99-Y102 AromaticContact CD2-CD1 3.76Å; Y99-Y102 HydrophobicContact CD2-CD1 3.76Å; Y99-Y102 HydrophobicContact CD2-CE1 4.46Å; Y99-Y102 AromaticContact CE2-CD1 3.53Å; Y99-Y102 HydrophobicContact CE2-CD1 3.53Å; Y99-Y102 AromaticContact CE2-CE1 3.86Å; Y99-Y102 HydrophobicContact CE2-CE1 3.86Å; Y99-Y102 PolarHBondContact O-N 2.92Å; Y102-Q104 PolarHBondContact O-N 3.26Å; Y102-L105 PolarHBondContact O-N 3.17Å; Y102-L105 VanDerWaalsContact O-N 3.16Å; Y102-V106 HydrophobicContact CD1-CG2 4.38Å; Y102-V106 HydrophobicContact CD2-CG2 4.2Å; Y102-V106 HydrophobicContact CE1-CG2 3.91Å; Y102-V106 HydrophobicContact CE2-CG2 3.7Å; Y102-V106 WeakPolarHBondContact O-CG2 3.48Å; Y102-V106 PolarHBondContact O-N 3.02Å; Y102-L144 HydrophobicContact CD2-CB 4.12Å; Y102-L144 HydrophobicContact CE2-CB 3.99Å; Y102-A145 HydrophobicContact CD2-CB 3.91Å; Y102-A145 HydrophobicContact CE2-CB 4.11Å; Y102-P159 HydrophobicContact CE1-CB 3.86Å; Y102-P159 VanDerWaalsContact CE1-O 3.28Å; Y102-P159 WeakPolarHBondContact CE1-O 3.22Å; Y102-P159 PolarHBondContact OH-O 3.49Å; Y102-P159 VanDerWaalsContact OH-O 3.07Å; Y102-F162 WeakPolarHBondContact OH-CD1 3.46Å; Y102-Y163 HydrophobicContact CD1-CD2 4.05Å; Y102-Y163 HydrophobicContact CD1-CG 4.08Å; Y102-Y163 AromaticContact CD2-CD2 3.95Å; Y102-Y163 HydrophobicContact CD2-CD2 3.95Å; Y102-Y163 HydrophobicContact CD2-CE2 4.49Å; Y102-Y163 HydrophobicContact CE1-CD2 4.41Å; Y102-Y163 HydrophobicContact CE1-CG 4.28Å; Y102-Y163 HydrophobicContact CE2-CD2 4.32Å; Y102-Y163 AromaticContact CG-CD2 3.8Å; Y102-Y163 HydrophobicContact CG-CD2 3.8Å; Y102-Y163 HydrophobicContact CG-CE2 4.23Å; Y102-Y163 HydrophobicContact CG-CG 4.3Å
103	K	95.8	Very high	94.5	Very high	41 Å²	41	35.5 Å²	35.5	18%	0.178	19%	0.191	C	C	.	.	H	α-helix	trans	-55.1	-50.4	176.6	-177.9	177.6	178.1	178.5	0	110.3	E84 E88 Y99 L105 V106 H107	E84-K103 IonicContact OE1-NZ 2.8Å; E88-K103 WeakPolarHBondContact OE1-CD 3.41Å; E88-K103 VanDerWaalsContact OE1-CE 3.29Å; E88-K103 WeakPolarHBondContact OE1-CE 3.46Å; E88-K103 IonicContact OE1-NZ 3.88Å; E88-K103 PolarHBondContact OE1-NZ 3.49Å; E88-K103 IonicContact OE2-NZ 2.7Å; E88-K103 PolarHBondContact OE2-NZ 3.31Å; Y99-K103 HydrophobicContact CE1-CB 4.23Å; Y99-K103 HydrophobicContact CE1-CD 4.09Å; Y99-K103 VanDerWaalsContact O-CB 3.31Å; Y99-K103 WeakPolarHBondContact O-CB 3.45Å; Y99-K103 PolarHBondContact O-N 3.4Å; K103-L105 VanDerWaalsContact C-N 3.35Å; K103-L105 PolarHBondContact O-N 3.21Å; K103-V106 PolarHBondContact O-N 3.06Å; K103-H107 PolarHBondContact O-CD2 2.95Å; K103-H107 PolarHBondContact O-N 3.31Å
104	Q	95.4	Very high	94.8	Very high	47 Å²	47	33.5 Å²	33.5	22%	0.22	18%	0.178	C	C	.	.	H	α-helix	trans	-56	-47	176.5	-176.7	175.4	-7.3	0	0	112.1	S100 Y101 Y102 V106 H107 S108 E117	S100-Q104 WeakPolarHBondContact O-CB 3.27Å; S100-Q104 PolarHBondContact O-N 2.98Å; Y101-Q104 PolarHBondContact O-N 3.44Å; Y102-Q104 PolarHBondContact O-N 3.26Å; Q104-V106 VanDerWaalsContact C-N 3.34Å; Q104-V106 PolarHBondContact O-N 3.49Å; Q104-H107 PolarHBondContact O-N 2.83Å; Q104-S108 WeakPolarHBondContact O-CB 3.17Å; Q104-S108 PolarHBondContact O-N 3.42Å; Q104-S108 PolarHBondContact O-OG 2.76Å; Q104-E117 PolarHBondContact NE2-OE2 3.4Å
105	L	96.7	Very high	95	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.2	-34.9	179.3	-71.5	168.2	0	0	0	113.4	Y101 Y102 K103 L111 L115 L118 V142 A145 R149	Y101-L105 WeakPolarHBondContact O-CG 3.13Å; Y101-L105 PolarHBondContact O-N 2.88Å; Y102-L105 PolarHBondContact O-N 3.17Å; Y102-L105 VanDerWaalsContact O-N 3.16Å; K103-L105 VanDerWaalsContact C-N 3.35Å; K103-L105 PolarHBondContact O-N 3.21Å; L105-L111 HydrophobicContact CB-CD1 4.18Å; L105-L111 HydrophobicContact CD2-CD1 3.98Å; L105-L115 HydrophobicContact CD2-CD2 3.95Å; L105-L115 HydrophobicContact CD2-CG 3.95Å; L105-L118 HydrophobicContact CD1-CD1 3.76Å; L105-L118 HydrophobicContact CD2-CD1 3.82Å; L105-L118 HydrophobicContact CG-CD1 3.66Å; L105-V142 HydrophobicContact CD1-CB 4.34Å; L105-V142 HydrophobicContact CD1-CG2 3.86Å; L105-A145 HydrophobicContact CB-CB 3.6Å; L105-A145 HydrophobicContact CD1-CB 4.15Å; L105-R149 WeakPolarHBondContact O-CD 3.5Å; L105-R149 PolarHBondContact O-NH1 2.98Å
106	V	95.5	Very high	95.1	Very high	13 Å²	13	41.2 Å²	41.2	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-70.9	-43.3	177.9	170.3	0	0	0	0	111.5	Y102 K103 Q104 A145 Y148 P159	Y102-V106 HydrophobicContact CD1-CG2 4.38Å; Y102-V106 HydrophobicContact CD2-CG2 4.2Å; Y102-V106 HydrophobicContact CE1-CG2 3.91Å; Y102-V106 HydrophobicContact CE2-CG2 3.7Å; Y102-V106 WeakPolarHBondContact O-CG2 3.48Å; Y102-V106 PolarHBondContact O-N 3.02Å; K103-V106 PolarHBondContact O-N 3.06Å; Q104-V106 VanDerWaalsContact C-N 3.34Å; Q104-V106 PolarHBondContact O-N 3.49Å; V106-A145 HydrophobicContact CG2-CB 4.1Å; V106-Y148 HydrophobicContact CB-CD1 4.49Å; V106-Y148 HydrophobicContact CG1-CD1 3.73Å; V106-Y148 HydrophobicContact CG1-CE1 3.63Å; V106-Y148 HydrophobicContact CG2-CD1 3.87Å; V106-P159 HydrophobicContact CG1-CB 4.12Å; V106-P159 HydrophobicContact CG1-CG 3.98Å
107	H	93.6	Very high	95.2	Very high	115 Å²	115	44.4 Å²	44.4	53%	0.532	22%	0.224	S	C	.	.	H	α-helix	trans	-85.9	-14.5	-176.7	-65.9	-68.5	0	0	0	114.4	K103 Q104	K103-H107 PolarHBondContact O-CD2 2.95Å; K103-H107 PolarHBondContact O-N 3.31Å; Q104-H107 PolarHBondContact O-N 2.83Å
108	S	94.5	Very high	95.3	Very high	10 Å²	10	44.4 Å²	44.4	7%	0.07	22%	0.224	C	C	.	.	S	Bend	trans	-60	141.8	175.4	-69.2	0	0	0	0	112	Q104 S110 G114 R149	Q104-S108 WeakPolarHBondContact O-CB 3.17Å; Q104-S108 PolarHBondContact O-N 3.42Å; Q104-S108 PolarHBondContact O-OG 2.76Å; S108-S110 WeakPolarHBondContact CB-O 3.39Å; S108-S110 PolarHBondContact O-N 3.5Å; S108-S110 VanDerWaalsContact O-N 3.11Å; S108-G114 WeakPolarHBondContact OG-CA 3.42Å; S108-R149 PolarHBondContact O-NH1 3.39Å; S108-R149 PolarHBondContact O-NH2 3.06Å; S108-R149 VanDerWaalsContact O-NH2 3.13Å
109	P	93.9	Very high	95.3	Very high	118 Å²	118	46.8 Å²	46.8	77%	0.766	24%	0.236	S	C	*	.	S	Bend	trans	-50.9	-43.1	-179.2	-27.9	34.1	0	0	0	113.2	R149	P109-R149 PolarHBondContact O-NH2 2.86Å
110	S	94.1	Very high	95.2	Very high	52 Å²	52	52.3 Å²	52.3	36%	0.364	26%	0.263	S	S	.	.	S	Bend	trans	-130.9	156.7	169.9	73.6	0	0	0	0	110.5	S108 L112 Q113 G114 R149	S108-S110 WeakPolarHBondContact CB-O 3.39Å; S108-S110 PolarHBondContact O-N 3.5Å; S108-S110 VanDerWaalsContact O-N 3.11Å; S110-L112 VanDerWaalsContact C-N 3.27Å; S110-L112 PolarHBondContact O-N 3.39Å; S110-Q113 PolarHBondContact O-N 3.46Å; S110-Q113 VanDerWaalsContact OG-CB 3.24Å; S110-Q113 WeakPolarHBondContact OG-CB 3.33Å; S110-Q113 PolarHBondContact OG-N 3.04Å; S110-G114 PolarHBondContact O-N 3.34Å; S110-G114 VanDerWaalsContact O-N 3.07Å; S110-R149 VanDerWaalsContact CA-NH2 3.33Å; S110-R149 PolarHBondContact O-NH1 2.85Å
111	L	92.3	Very high	95.2	Very high	35 Å²	35	52 Å²	52	18%	0.183	26%	0.261	C	S	.	.	H	α-helix	trans	-64.8	-36.8	176.7	-175.8	71.2	0	0	0	110.7	L105 Q113 G114 L115 A145 L146 R149	L105-L111 HydrophobicContact CB-CD1 4.18Å; L105-L111 HydrophobicContact CD2-CD1 3.98Å; L111-Q113 VanDerWaalsContact C-N 3.34Å; L111-Q113 PolarHBondContact O-N 2.78Å; L111-G114 PolarHBondContact O-N 3.37Å; L111-L115 HydrophobicContact CG-CD1 4.19Å; L111-L115 HydrophobicContact CG-CG 4.45Å; L111-L115 WeakPolarHBondContact O-CB 3.41Å; L111-L115 VanDerWaalsContact O-CG 3.31Å; L111-L115 WeakPolarHBondContact O-CG 3.23Å; L111-L115 PolarHBondContact O-N 2.86Å; L111-A145 HydrophobicContact CD1-CB 4.42Å; L111-L146 HydrophobicContact CD2-CB 4.16Å; L111-L146 HydrophobicContact CD2-CD1 3.41Å; L111-L146 VanDerWaalsContact CD2-CD1 3.41Å; L111-L146 HydrophobicContact CD2-CG 4.38Å; L111-R149 VanDerWaalsContact N-NH1 3.17Å
112	L	94.2	Very high	95.1	Very high	137 Å²	137	54.6 Å²	54.6	72%	0.717	28%	0.278	S	S	*	.	H	α-helix	trans	-62.9	-41.3	176.9	-177.8	63.5	0	0	0	111.8	S110 L115 R116	S110-L112 VanDerWaalsContact C-N 3.27Å; S110-L112 PolarHBondContact O-N 3.39Å; L112-L115 PolarHBondContact O-N 3.4Å; L112-R116 WeakPolarHBondContact O-CB 3.27Å; L112-R116 PolarHBondContact O-N 2.85Å
113	Q	96.2	Very high	95	Very high	73 Å²	73	55.9 Å²	55.9	34%	0.341	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-48.5	175.5	-179.8	60	25.4	0	0	110.8	S110 L111 L115 R116 E117	S110-Q113 PolarHBondContact O-N 3.46Å; S110-Q113 VanDerWaalsContact OG-CB 3.24Å; S110-Q113 WeakPolarHBondContact OG-CB 3.33Å; S110-Q113 PolarHBondContact OG-N 3.04Å; L111-Q113 VanDerWaalsContact C-N 3.34Å; L111-Q113 PolarHBondContact O-N 2.78Å; Q113-L115 VanDerWaalsContact C-N 3.32Å; Q113-L115 PolarHBondContact O-N 2.93Å; Q113-R116 WeakPolarHBondContact O-CB 3.17Å; Q113-R116 PolarHBondContact O-N 2.87Å; Q113-R116 VanDerWaalsContact O-N 3.12Å; Q113-E117 WeakPolarHBondContact CG-OE1 3.45Å; Q113-E117 PolarHBondContact NE2-OE1 2.9Å; Q113-E117 WeakPolarHBondContact O-CG 3.39Å; Q113-E117 PolarHBondContact O-N 3.44Å
114	G	95.8	Very high	94.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-39.3	176.8	0	0	0	0	0	112.9	S108 S110 L111 E117 L118	S108-G114 WeakPolarHBondContact OG-CA 3.42Å; S110-G114 PolarHBondContact O-N 3.34Å; S110-G114 VanDerWaalsContact O-N 3.07Å; L111-G114 PolarHBondContact O-N 3.37Å; G114-E117 PolarHBondContact O-N 3.09Å; G114-L118 WeakPolarHBondContact O-CG 3.46Å; G114-L118 PolarHBondContact O-N 3.02Å
115	L	95.3	Very high	94.8	Very high	37 Å²	37	52 Å²	52	19%	0.194	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-41.3	173.9	-76.1	172.2	0	0	0	112.1	L105 L111 L112 Q113 E117 L118 I119 L133 V142	L105-L115 HydrophobicContact CD2-CD2 3.95Å; L105-L115 HydrophobicContact CD2-CG 3.95Å; L111-L115 HydrophobicContact CG-CD1 4.19Å; L111-L115 HydrophobicContact CG-CG 4.45Å; L111-L115 WeakPolarHBondContact O-CB 3.41Å; L111-L115 VanDerWaalsContact O-CG 3.31Å; L111-L115 WeakPolarHBondContact O-CG 3.23Å; L111-L115 PolarHBondContact O-N 2.86Å; L112-L115 PolarHBondContact O-N 3.4Å; Q113-L115 VanDerWaalsContact C-N 3.32Å; Q113-L115 PolarHBondContact O-N 2.93Å; L115-E117 VanDerWaalsContact C-N 3.31Å; L115-E117 PolarHBondContact O-N 3.49Å; L115-L118 PolarHBondContact O-N 3.41Å; L115-I119 VanDerWaalsContact O-CG1 3.24Å; L115-I119 WeakPolarHBondContact O-CG1 3.45Å; L115-I119 PolarHBondContact O-N 3.11Å; L115-L133 HydrophobicContact CD2-CD1 4.46Å; L115-L133 HydrophobicContact CD2-CD2 4.39Å; L115-V142 HydrophobicContact CD2-CG1 3.87Å; L115-V142 HydrophobicContact CD2-CG2 3.96Å
116	R	96.3	Very high	94.5	Very high	175 Å²	175	53.4 Å²	53.4	66%	0.66	27%	0.274	S	S	*	.	H	α-helix	trans	-62.5	-41	176.8	-173.8	178.9	-177.4	173.2	1.3	111.4	L112 Q113 I119 M120	L112-R116 WeakPolarHBondContact O-CB 3.27Å; L112-R116 PolarHBondContact O-N 2.85Å; Q113-R116 WeakPolarHBondContact O-CB 3.17Å; Q113-R116 PolarHBondContact O-N 2.87Å; Q113-R116 VanDerWaalsContact O-N 3.12Å; R116-I119 PolarHBondContact O-N 3.02Å; R116-M120 PolarHBondContact O-N 2.93Å
117	E	95.4	Very high	94.2	Very high	67 Å²	67	54.4 Å²	54.4	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-38.9	175.9	-69.8	168.4	-166.6	0	0	111.9	Q104 Q113 G114 L115 M120 D121	Q104-E117 PolarHBondContact NE2-OE2 3.4Å; Q113-E117 WeakPolarHBondContact CG-OE1 3.45Å; Q113-E117 PolarHBondContact NE2-OE1 2.9Å; Q113-E117 WeakPolarHBondContact O-CG 3.39Å; Q113-E117 PolarHBondContact O-N 3.44Å; G114-E117 PolarHBondContact O-N 3.09Å; L115-E117 VanDerWaalsContact C-N 3.31Å; L115-E117 PolarHBondContact O-N 3.49Å; E117-M120 CarbonylContact O-C 3.54Å; E117-M120 PolarHBondContact O-N 3.36Å; E117-D121 VanDerWaalsContact O-CA 3.31Å; E117-D121 WeakPolarHBondContact O-CA 3.34Å; E117-D121 PolarHBondContact O-N 3.19Å; E117-D121 VanDerWaalsContact O-N 3.11Å
118	L	95.8	Very high	93.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-71	-29.8	174.5	-69.5	-175.8	0	0	0	113.6	Y101 L105 G114 L115 M120 V132 L133 I138	Y101-L118 HydrophobicContact CD1-CD2 3.57Å; Y101-L118 HydrophobicContact CE1-CD2 4.33Å; Y101-L118 HydrophobicContact CG-CD2 4.36Å; L105-L118 HydrophobicContact CD1-CD1 3.76Å; L105-L118 HydrophobicContact CD2-CD1 3.82Å; L105-L118 HydrophobicContact CG-CD1 3.66Å; G114-L118 WeakPolarHBondContact O-CG 3.46Å; G114-L118 PolarHBondContact O-N 3.02Å; L115-L118 PolarHBondContact O-N 3.41Å; L118-M120 VanDerWaalsContact C-N 3.29Å; L118-V132 HydrophobicContact CB-CB 4.26Å; L118-V132 HydrophobicContact CD2-CB 4.48Å; L118-V132 HydrophobicContact CD2-CG1 4.4Å; L118-V132 HydrophobicContact CD2-CG2 4.3Å; L118-V132 VanDerWaalsContact O-CB 3.25Å; L118-V132 WeakPolarHBondContact O-CB 3.49Å; L118-V132 VanDerWaalsContact O-CG2 3.26Å; L118-V132 WeakPolarHBondContact O-CG2 3.35Å; L118-V132 PolarHBondContact O-N 3.49Å; L118-L133 HydrophobicContact CB-CD1 4.08Å; L118-I138 HydrophobicContact CD1-CD1 3.73Å
119	I	95.4	Very high	93.8	Very high	50 Å²	50	56.9 Å²	56.9	26%	0.256	30%	0.298	S	S	.	.	H	α-helix	trans	-71.4	-29.6	173.7	-70.6	166.7	0	0	0	110.8	L115 R116 N131 L133 F310	L115-I119 VanDerWaalsContact O-CG1 3.24Å; L115-I119 WeakPolarHBondContact O-CG1 3.45Å; L115-I119 PolarHBondContact O-N 3.11Å; R116-I119 PolarHBondContact O-N 3.02Å; I119-N131 WeakPolarHBondContact O-CA 3.31Å; I119-N131 WeakPolarHBondContact O-CB 3.38Å; I119-L133 HydrophobicContact CG1-CD1 3.76Å; I119-F310 HydrophobicContact CD1-CE1 4.47Å; I119-F310 HydrophobicContact CD1-CZ 3.88Å; I119-F310 HydrophobicContact CG1-CZ 4.29Å
120	M	95.1	Very high	93.8	Very high	119 Å²	119	52.3 Å²	52.3	59%	0.586	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	59.6	179.8	-61.2	-60.9	-67	0	0	110.1	R116 E117 L118 P122 T129	R116-M120 PolarHBondContact O-N 2.93Å; E117-M120 CarbonylContact O-C 3.54Å; E117-M120 PolarHBondContact O-N 3.36Å; L118-M120 VanDerWaalsContact C-N 3.29Å; M120-P122 VanDerWaalsContact O-CD 3.22Å; M120-P122 WeakPolarHBondContact O-CD 3.12Å; M120-T129 VanDerWaalsContact CA-CG2 3.49Å; M120-T129 HydrophobicContact CB-CG2 3.99Å; M120-T129 HydrophobicContact CE-CG2 4.01Å; M120-T129 HydrophobicContact SD-CG2 4.49Å
121	D	95.1	Very high	93.7	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.011	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-89.5	113.5	-173.3	-177.2	73.2	0	0	0	112	E117 V123 T124 T129 I130 V132	E117-D121 VanDerWaalsContact O-CA 3.31Å; E117-D121 WeakPolarHBondContact O-CA 3.34Å; E117-D121 PolarHBondContact O-N 3.19Å; E117-D121 VanDerWaalsContact O-N 3.11Å; D121-V123 PolarHBondContact OD2-N 3.08Å; D121-T124 WeakPolarHBondContact OD2-CB 3.46Å; D121-T124 PolarHBondContact OD2-N 2.91Å; D121-T124 PolarHBondContact OD2-OG1 3.14Å; D121-T129 WeakPolarHBondContact O-CA 3.49Å; D121-I130 HydrophobicContact CB-CG1 4.44Å; D121-I130 PolarHBondContact N-O 3.31Å; D121-I130 PolarHBondContact O-N 3.07Å; D121-V132 HydrophobicContact CB-CG2 3.54Å
122	P	94	Very high	93.8	Very high	55 Å²	55	49.7 Å²	49.7	36%	0.357	25%	0.249	S	C	.	.	S	Bend	trans	-93.3	2.4	175.4	38.5	-36.9	0	0	0	113.5	M120 H126	M120-P122 VanDerWaalsContact O-CD 3.22Å; M120-P122 WeakPolarHBondContact O-CD 3.12Å; P122-H126 WeakPolarHBondContact O-CA 3.35Å; P122-H126 PolarHBondContact O-ND1 3.02Å
123	V	94.4	Very high	93.7	Very high	27 Å²	27	43.7 Å²	43.7	16%	0.164	22%	0.218	C	C	.	.	S	Bend	trans	-96.1	-43.3	-166.3	-178.8	0	0	0	0	111.6	D121 K596 H602 I603	D121-V123 PolarHBondContact OD2-N 3.08Å; V123-K596 HydrophobicContact CG1-CD 4.36Å; V123-H602 WeakPolarHBondContact O-CA 3.41Å; V123-I603 PolarHBondContact O-N 3.3Å
124	T	93.9	Very high	93.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-38.3	-171.2	-55.2	0	0	0	0	113.3	L97 Y101 D121 I130 F136 K596 I603 H606	L97-T124 HydrophobicContact CD1-CG2 4.32Å; Y101-T124 WeakPolarHBondContact OH-CG2 3.41Å; Y101-T124 PolarHBondContact OH-OG1 3.14Å; D121-T124 WeakPolarHBondContact OD2-CB 3.46Å; D121-T124 PolarHBondContact OD2-N 2.91Å; D121-T124 PolarHBondContact OD2-OG1 3.14Å; T124-I130 HydrophobicContact CG2-CD1 4.34Å; T124-F136 HydrophobicContact CG2-CE2 3.94Å; T124-F136 HydrophobicContact CG2-CZ 4.23Å; T124-K596 WeakPolarHBondContact OG1-CE 3.28Å; T124-K596 PolarHBondContact OG1-NZ 2.92Å; T124-I603 CarbonylContact C-O 3.57Å; T124-I603 WeakPolarHBondContact O-CG1 3.44Å; T124-H606 VanDerWaalsContact CG2-CD2 3.48Å; T124-H606 WeakPolarHBondContact CG2-CD2 3.47Å; T124-H606 PolarHBondContact O-CD2 3.4Å
125	E	92.5	Very high	92.9	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.028	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	56.5	177.2	-71.1	-173.1	-150.5	0	0	109.1	H128 I130 R135 H606 L614 R617	E125-H128 PolarHBondContact O-N 3.34Å; E125-I130 HydrophobicContact CB-CD1 4.19Å; E125-I130 HydrophobicContact CB-CG2 4.17Å; E125-I130 HydrophobicContact CG-CD1 3.82Å; E125-I130 HydrophobicContact CG-CG2 4.5Å; E125-R135 IonicContact OE1-CZ 2.71Å; E125-R135 IonicContact OE1-NE 3.73Å; E125-R135 PolarHBondContact OE1-NE 3.26Å; E125-R135 IonicContact OE1-NH2 2.64Å; E125-R135 PolarHBondContact OE1-NH2 3.39Å; E125-R135 IonicContact OE2-NH2 3.05Å; E125-R135 PolarHBondContact OE2-NH2 2.97Å; E125-R135 VanDerWaalsContact OE2-NH2 3.11Å; E125-H606 WeakPolarHBondContact CG-NE2 3.42Å; E125-H606 IonicContact OE1-NE2 3.65Å; E125-L614 HydrophobicContact CG-CD1 4.25Å; E125-R617 VanDerWaalsContact C-NH1 3.32Å; E125-R617 PolarHBondContact O-NH1 3.18Å
126	H	92.2	Very high	92.6	Very high	30 Å²	30	43 Å²	43	14%	0.139	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	150.7	-171.6	-169.3	58.5	0	0	0	113.6	P122 H128 S584 H602 I603 R617	P122-H126 WeakPolarHBondContact O-CA 3.35Å; P122-H126 PolarHBondContact O-ND1 3.02Å; H126-H128 VanDerWaalsContact C-N 3.29Å; H126-S584 WeakPolarHBondContact CD2-CB 3.27Å; H126-H602 HydrophobicContact CB-CB 3.98Å; H126-H602 AromaticContact CE1-CE1 3.98Å; H126-H602 AromaticContact CE1-ND1 3.18Å; H126-H602 PolarHBondContact CE1-ND1 2.95Å; H126-H602 AromaticContact CG-ND1 3.79Å; H126-H602 AromaticContact ND1-CE1 3.95Å; H126-H602 AromaticContact ND1-CG 3.77Å; H126-H602 AromaticContact ND1-ND1 3Å; H126-H602 PolarHBondContact ND1-ND1 3.43Å; H126-H602 AromaticContact NE2-ND1 3.98Å; H126-I603 WeakPolarHBondContact CB-O 3.4Å; H126-I603 PolarHBondContact N-O 3.39Å; H126-R617 PolarHBondContact O-NH1 3.43Å
127	S	88.3	Confident	92.2	Very high	35 Å²	35	34.8 Å²	34.8	25%	0.245	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-12.4	-157.1	70.2	0	0	0	0	115.3
128	H	88.1	Confident	92	Very high	98 Å²	98	31.6 Å²	31.6	45%	0.454	17%	0.166	S	C	.	.	S	Bend	trans	-139.3	155.1	173.2	-59.7	-92.4	0	0	0	111.6	E125 H126 R617	E125-H128 PolarHBondContact O-N 3.34Å; H126-H128 VanDerWaalsContact C-N 3.29Å; H128-R617 PolarHBondContact CD2-NH2 2.76Å
129	T	91.7	Very high	92	Very high	79 Å²	79	32.6 Å²	32.6	49%	0.485	17%	0.17	S	C	.	.			trans	-97	127.9	169.7	-54.1	0	0	0	0	109.4	M120 D121	M120-T129 VanDerWaalsContact CA-CG2 3.49Å; M120-T129 HydrophobicContact CB-CG2 3.99Å; M120-T129 HydrophobicContact CE-CG2 4.01Å; M120-T129 HydrophobicContact SD-CG2 4.49Å; D121-T129 WeakPolarHBondContact O-CA 3.49Å
130	I	93	Very high	92	Very high	21 Å²	21	30.3 Å²	30.3	11%	0.108	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-119.8	154.1	178.2	61.8	162.9	0	0	0	111.2	D121 T124 E125 R135 F136	D121-I130 HydrophobicContact CB-CG1 4.44Å; D121-I130 PolarHBondContact N-O 3.31Å; D121-I130 PolarHBondContact O-N 3.07Å; T124-I130 HydrophobicContact CG2-CD1 4.34Å; E125-I130 HydrophobicContact CB-CD1 4.19Å; E125-I130 HydrophobicContact CB-CG2 4.17Å; E125-I130 HydrophobicContact CG-CD1 3.82Å; E125-I130 HydrophobicContact CG-CG2 4.5Å; I130-R135 HydrophobicContact CD1-CG 4.31Å; I130-F136 HydrophobicContact CD1-CE2 3.69Å; I130-F136 HydrophobicContact CD1-CZ 3.95Å
131	N	93.7	Very high	92.1	Very high	32 Å²	32	24.7 Å²	24.7	17%	0.171	13%	0.13	C	C	.	.			trans	-90.7	105.2	166.9	178.5	-16	0	0	0	109.1	I119 L133 H134 R135 F310	I119-N131 WeakPolarHBondContact O-CA 3.31Å; I119-N131 WeakPolarHBondContact O-CB 3.38Å; N131-L133 VanDerWaalsContact C-N 3.29Å; N131-L133 PolarHBondContact O-N 3.25Å; N131-L133 PolarHBondContact OD1-N 3.07Å; N131-H134 HydrophobicContact CB-CB 3.92Å; N131-H134 PolarHBondContact O-N 2.96Å; N131-H134 PolarHBondContact OD1-N 2.64Å; N131-H134 VanDerWaalsContact OD1-N 3.15Å; N131-R135 VanDerWaalsContact O-CB 3.25Å; N131-R135 WeakPolarHBondContact O-CB 3.45Å; N131-R135 PolarHBondContact O-N 3.32Å; N131-F310 VanDerWaalsContact ND2-CD2 3.35Å; N131-F310 WeakPolarHBondContact ND2-CD2 3.23Å; N131-F310 WeakPolarHBondContact ND2-CG 3.27Å
132	V	93.5	Very high	92.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-36.2	-177.4	175.7	0	0	0	0	111.7	Y101 L118 D121 R135 F136 I138	Y101-V132 HydrophobicContact CD1-CG1 3.68Å; Y101-V132 HydrophobicContact CD2-CG1 4.06Å; Y101-V132 HydrophobicContact CE1-CB 4.38Å; Y101-V132 HydrophobicContact CE1-CG1 3.45Å; Y101-V132 VanDerWaalsContact CE1-CG1 3.45Å; Y101-V132 HydrophobicContact CE1-CG2 3.92Å; Y101-V132 HydrophobicContact CE2-CG1 3.89Å; Y101-V132 HydrophobicContact CG-CG1 3.98Å; L118-V132 HydrophobicContact CB-CB 4.26Å; L118-V132 HydrophobicContact CD2-CB 4.48Å; L118-V132 HydrophobicContact CD2-CG1 4.4Å; L118-V132 HydrophobicContact CD2-CG2 4.3Å; L118-V132 VanDerWaalsContact O-CB 3.25Å; L118-V132 WeakPolarHBondContact O-CB 3.49Å; L118-V132 VanDerWaalsContact O-CG2 3.26Å; L118-V132 WeakPolarHBondContact O-CG2 3.35Å; L118-V132 PolarHBondContact O-N 3.49Å; D121-V132 HydrophobicContact CB-CG2 3.54Å; V132-R135 PolarHBondContact O-N 2.95Å; V132-F136 HydrophobicContact CB-CD2 4.36Å; V132-F136 HydrophobicContact CG1-CD2 3.8Å; V132-F136 PolarHBondContact O-N 3.48Å; V132-I138 HydrophobicContact CB-CD1 4.39Å; V132-I138 HydrophobicContact CG1-CD1 3.42Å; V132-I138 VanDerWaalsContact CG1-CD1 3.42Å; V132-I138 HydrophobicContact CG1-CG1 3.93Å; V132-I138 HydrophobicContact CG1-CG2 4.35Å
133	L	91.9	Very high	92.2	Very high	12 Å²	12	26.3 Å²	26.3	6%	0.063	14%	0.136	C	C	.	.	H	α-helix	trans	-69.6	-37.9	178.6	-71.3	97.6	0	0	0	112.5	L115 L118 I119 N131 R135 I138 Y139 V142 F310	L115-L133 HydrophobicContact CD2-CD1 4.46Å; L115-L133 HydrophobicContact CD2-CD2 4.39Å; L118-L133 HydrophobicContact CB-CD1 4.08Å; I119-L133 HydrophobicContact CG1-CD1 3.76Å; N131-L133 VanDerWaalsContact C-N 3.29Å; N131-L133 PolarHBondContact O-N 3.25Å; N131-L133 PolarHBondContact OD1-N 3.07Å; L133-R135 VanDerWaalsContact C-N 3.32Å; L133-I138 HydrophobicContact CG-CD1 4.45Å; L133-I138 HydrophobicContact CG-CG1 4.29Å; L133-Y139 HydrophobicContact CD2-CD1 4.46Å; L133-Y139 HydrophobicContact CD2-CE1 3.91Å; L133-Y139 PolarHBondContact O-OH 2.88Å; L133-V142 HydrophobicContact CD2-CG2 4.19Å; L133-F310 HydrophobicContact CB-CE2 4.1Å
134	H	89.6	Confident	92.3	Very high	55 Å²	55	25.6 Å²	25.6	26%	0.255	13%	0.131	S	C	.	.	H	α-helix	trans	-70	-31.2	172	171.1	-75.6	0	0	0	111.4	N131 Q309 F310 Q312	N131-H134 HydrophobicContact CB-CB 3.92Å; N131-H134 PolarHBondContact O-N 2.96Å; N131-H134 PolarHBondContact OD1-N 2.64Å; N131-H134 VanDerWaalsContact OD1-N 3.15Å; H134-Q309 PolarHBondContact CD2-O 3.38Å; H134-F310 HydrophobicContact CB-CB 4.37Å; H134-Q312 VanDerWaalsContact NE2-CA 3.28Å; H134-Q312 WeakPolarHBondContact NE2-CA 3.37Å; H134-Q312 PolarHBondContact O-NE2 3.18Å; H134-Q312 PolarHBondContact O-OE1 3.03Å; H134-Q312 VanDerWaalsContact O-OE1 3.09Å
135	R	86.8	Confident	92.4	Very high	40 Å²	40	25.6 Å²	25.6	15%	0.151	13%	0.131	C	C	.	.	H	α-helix	trans	-85.4	-42.8	-172	-165.4	68.7	154.4	-175.8	-7.3	113.8	E125 I130 N131 V132 L133 D611	E125-R135 IonicContact OE1-CZ 2.71Å; E125-R135 IonicContact OE1-NE 3.73Å; E125-R135 PolarHBondContact OE1-NE 3.26Å; E125-R135 IonicContact OE1-NH2 2.64Å; E125-R135 PolarHBondContact OE1-NH2 3.39Å; E125-R135 IonicContact OE2-NH2 3.05Å; E125-R135 PolarHBondContact OE2-NH2 2.97Å; E125-R135 VanDerWaalsContact OE2-NH2 3.11Å; I130-R135 HydrophobicContact CD1-CG 4.31Å; N131-R135 VanDerWaalsContact O-CB 3.25Å; N131-R135 WeakPolarHBondContact O-CB 3.45Å; N131-R135 PolarHBondContact O-N 3.32Å; V132-R135 PolarHBondContact O-N 2.95Å; L133-R135 VanDerWaalsContact C-N 3.32Å; R135-D611 IonicContact CZ-OD1 3.72Å; R135-D611 IonicContact CZ-OD2 3.86Å; R135-D611 IonicContact NH1-OD1 3.31Å; R135-D611 PolarHBondContact NH1-OD1 3.42Å; R135-D611 IonicContact NH1-OD2 3.17Å; R135-D611 PolarHBondContact NH1-OD2 3.48Å; R135-D611 IonicContact NH2-OD1 2.87Å; R135-D611 IonicContact NH2-OD2 3.68Å; R135-D611 PolarHBondContact NH2-OD2 2.92Å
136	F	87.3	Confident	92.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-126	3.9	-160.9	-56.6	-49.5	0	0	0	115.4	Y101 T124 I130 V132 I138 R216 H606 H608	Y101-F136 HydrophobicContact CE2-CD2 4.16Å; Y101-F136 AromaticContact CZ-CD2 3.94Å; Y101-F136 WeakPolarHBondContact OH-CD2 3.32Å; Y101-F136 VanDerWaalsContact OH-CE2 3.23Å; Y101-F136 WeakPolarHBondContact OH-CE2 3.49Å; T124-F136 HydrophobicContact CG2-CE2 3.94Å; T124-F136 HydrophobicContact CG2-CZ 4.23Å; I130-F136 HydrophobicContact CD1-CE2 3.69Å; I130-F136 HydrophobicContact CD1-CZ 3.95Å; V132-F136 HydrophobicContact CB-CD2 4.36Å; V132-F136 HydrophobicContact CG1-CD2 3.8Å; V132-F136 PolarHBondContact O-N 3.48Å; F136-I138 VanDerWaalsContact C-N 3.3Å; F136-I138 HydrophobicContact CB-CG2 3.82Å; F136-I138 PolarHBondContact O-N 2.83Å; F136-R216 PolarHBondContact O-NH1 3.44Å; F136-H606 AromaticContact CE1-CE1 3.41Å; F136-H606 VanDerWaalsContact CE1-CE1 3.41Å; F136-H606 WeakPolarHBondContact CE1-CE1 3.27Å; F136-H606 AromaticContact CE1-NE2 3.95Å; F136-H606 AromaticContact CZ-CE1 3.28Å; F136-H606 WeakPolarHBondContact CZ-CE1 3.49Å; F136-H606 AromaticContact CZ-NE2 3.34Å; F136-H606 VanDerWaalsContact CZ-NE2 3.34Å; F136-H606 WeakPolarHBondContact CZ-NE2 3.42Å; F136-H608 HydrophobicContact CD1-CB 3.97Å; F136-H608 AromaticContact CD1-CD2 3.48Å; F136-H608 VanDerWaalsContact CD1-CD2 3.48Å; F136-H608 WeakPolarHBondContact CD1-CD2 3.43Å; F136-H608 AromaticContact CD1-CE1 3.52Å; F136-H608 AromaticContact CD1-CG 3.31Å; F136-H608 AromaticContact CD1-ND1 3.3Å; F136-H608 VanDerWaalsContact CD1-ND1 3.3Å; F136-H608 WeakPolarHBondContact CD1-ND1 3.28Å; F136-H608 AromaticContact CD1-NE2 3.62Å; F136-H608 HydrophobicContact CE1-CB 3.8Å; F136-H608 AromaticContact CE1-CG 3.56Å; F136-H608 AromaticContact CE1-ND1 3.47Å; F136-H608 WeakPolarHBondContact CE1-ND1 3.47Å
137	N	87.8	Confident	92.7	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.016	16%	0.16	C	C	.	.			trans	51.2	46.5	179.5	-59.5	39.5	0	0	0	112.7	Y139 Q140 Q309	N137-Y139 HydrophobicContact CB-CD2 4.4Å; N137-Y139 PolarHBondContact O-N 3.41Å; N137-Q140 PolarHBondContact O-NE2 3.25Å; N137-Q140 PolarHBondContact O-OE1 3.36Å; N137-Q309 PolarHBondContact ND2-NE2 2.96Å
138	I	93.1	Very high	93	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	31.5	-176.1	57.8	152	0	0	0	113.7	Y98 Y101 L118 V132 L133 F136 Q140 E141 V142	Y98-I138 HydrophobicContact CD1-CG2 4.36Å; Y101-I138 HydrophobicContact CD2-CB 4.48Å; Y101-I138 HydrophobicContact CD2-CD1 4.31Å; Y101-I138 HydrophobicContact CD2-CG2 3.62Å; Y101-I138 HydrophobicContact CE2-CG2 3.98Å; Y101-I138 HydrophobicContact CG-CD1 4.1Å; Y101-I138 HydrophobicContact CG-CG2 4.49Å; L118-I138 HydrophobicContact CD1-CD1 3.73Å; V132-I138 HydrophobicContact CB-CD1 4.39Å; V132-I138 HydrophobicContact CG1-CD1 3.42Å; V132-I138 VanDerWaalsContact CG1-CD1 3.42Å; V132-I138 HydrophobicContact CG1-CG1 3.93Å; V132-I138 HydrophobicContact CG1-CG2 4.35Å; L133-I138 HydrophobicContact CG-CD1 4.45Å; L133-I138 HydrophobicContact CG-CG1 4.29Å; F136-I138 VanDerWaalsContact C-N 3.3Å; F136-I138 HydrophobicContact CB-CG2 3.82Å; F136-I138 PolarHBondContact O-N 2.83Å; I138-Q140 VanDerWaalsContact C-N 3.35Å; I138-Q140 PolarHBondContact O-N 3.33Å; I138-E141 WeakPolarHBondContact CA-OE2 3.49Å; I138-E141 HydrophobicContact CB-CB 4.42Å; I138-E141 WeakPolarHBondContact CB-OE2 3.17Å; I138-E141 PolarHBondContact O-N 3.41Å; I138-E141 VanDerWaalsContact O-OE2 3.06Å; I138-V142 HydrophobicContact CD1-CG2 4.46Å; I138-V142 WeakPolarHBondContact O-CG2 3.44Å; I138-V142 PolarHBondContact O-N 3.36Å; I138-V142 VanDerWaalsContact O-N 3.09Å
139	Y	94.9	Very high	93.3	Very high	20 Å²	20	27.7 Å²	27.7	8%	0.078	14%	0.138	C	C	.	.	H	α-helix	trans	-70.4	-32.7	-170.1	-70.3	-86	0	0	0	112.3	L133 N137 E141 V142 M143 L261 I308 Q309	L133-Y139 HydrophobicContact CD2-CD1 4.46Å; L133-Y139 HydrophobicContact CD2-CE1 3.91Å; L133-Y139 PolarHBondContact O-OH 2.88Å; N137-Y139 HydrophobicContact CB-CD2 4.4Å; N137-Y139 PolarHBondContact O-N 3.41Å; Y139-E141 VanDerWaalsContact C-N 3.35Å; Y139-V142 PolarHBondContact O-N 2.85Å; Y139-M143 WeakPolarHBondContact O-CB 3.35Å; Y139-M143 VanDerWaalsContact O-CG 3.26Å; Y139-M143 WeakPolarHBondContact O-CG 3.29Å; Y139-M143 PolarHBondContact O-N 2.72Å; Y139-L261 HydrophobicContact CD1-CD1 3.87Å; Y139-L261 HydrophobicContact CD1-CD2 4.27Å; Y139-L261 HydrophobicContact CD1-CG 4.25Å; Y139-L261 HydrophobicContact CD2-CD1 3.54Å; Y139-L261 HydrophobicContact CD2-CG 3.84Å; Y139-L261 HydrophobicContact CE1-CD1 4.16Å; Y139-L261 HydrophobicContact CE2-CD1 3.89Å; Y139-L261 HydrophobicContact CG-CD1 3.57Å; Y139-L261 HydrophobicContact CG-CD2 3.98Å; Y139-L261 HydrophobicContact CG-CG 3.64Å; Y139-I308 HydrophobicContact CD1-CG2 4.39Å; Y139-I308 HydrophobicContact CE1-CG2 3.57Å; Y139-I308 PolarHBondContact OH-O 3.41Å; Y139-I308 VanDerWaalsContact OH-O 3.08Å; Y139-Q309 HydrophobicContact CE2-CG 3.85Å; Y139-Q309 WeakPolarHBondContact OH-CA 3.37Å
140	Q	95	Very high	93.3	Very high	3 Å²	3	30.5 Å²	30.5	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-64.2	-38.7	172.2	60.9	-72.1	-14.4	0	0	111.6	N137 I138 M143 L144 Y219 F262	N137-Q140 PolarHBondContact O-NE2 3.25Å; N137-Q140 PolarHBondContact O-OE1 3.36Å; I138-Q140 VanDerWaalsContact C-N 3.35Å; I138-Q140 PolarHBondContact O-N 3.33Å; Q140-M143 PolarHBondContact O-N 3.22Å; Q140-L144 WeakPolarHBondContact O-CB 3.34Å; Q140-L144 WeakPolarHBondContact O-CG 3.14Å; Q140-L144 PolarHBondContact O-N 3.13Å; Q140-Y219 HydrophobicContact CB-CD1 4.33Å; Q140-Y219 HydrophobicContact CB-CD2 4.48Å; Q140-Y219 HydrophobicContact CB-CG 4.2Å; Q140-Y219 HydrophobicContact CG-CD2 3.8Å; Q140-Y219 HydrophobicContact CG-CE2 4.07Å; Q140-Y219 HydrophobicContact CG-CG 4.01Å; Q140-F262 HydrophobicContact CB-CD1 3.86Å; Q140-F262 HydrophobicContact CB-CE1 3.94Å; Q140-F262 HydrophobicContact CB-CG 4.44Å; Q140-F262 PolarHBondContact OE1-O 3.46Å
141	E	96.7	Very high	93.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-41.6	174.3	-66	70.2	-152.4	0	0	110.6	I138 Y139 L144 A145 Y163	I138-E141 WeakPolarHBondContact CA-OE2 3.49Å; I138-E141 HydrophobicContact CB-CB 4.42Å; I138-E141 WeakPolarHBondContact CB-OE2 3.17Å; I138-E141 PolarHBondContact O-N 3.41Å; I138-E141 VanDerWaalsContact O-OE2 3.06Å; Y139-E141 VanDerWaalsContact C-N 3.35Å; E141-L144 PolarHBondContact O-N 2.67Å; E141-A145 VanDerWaalsContact O-CB 3.3Å; E141-A145 WeakPolarHBondContact O-CB 3.3Å; E141-A145 PolarHBondContact O-N 3.4Å; E141-Y163 HydrophobicContact CG-CE2 3.99Å; E141-Y163 PolarHBondContact OE1-OH 3Å
142	V	96.2	Very high	93.2	Very high	22 Å²	22	34.2 Å²	34.2	13%	0.133	18%	0.176	C	C	.	.	H	α-helix	trans	-60.7	-46.9	173.8	179.9	0	0	0	0	111.6	L105 L115 L133 I138 Y139 A145 L146	L105-V142 HydrophobicContact CD1-CB 4.34Å; L105-V142 HydrophobicContact CD1-CG2 3.86Å; L115-V142 HydrophobicContact CD2-CG1 3.87Å; L115-V142 HydrophobicContact CD2-CG2 3.96Å; L133-V142 HydrophobicContact CD2-CG2 4.19Å; I138-V142 HydrophobicContact CD1-CG2 4.46Å; I138-V142 WeakPolarHBondContact O-CG2 3.44Å; I138-V142 PolarHBondContact O-N 3.36Å; I138-V142 VanDerWaalsContact O-N 3.09Å; Y139-V142 PolarHBondContact O-N 2.85Å; V142-A145 PolarHBondContact O-N 3.27Å; V142-L146 WeakPolarHBondContact O-CB 3.29Å; V142-L146 PolarHBondContact O-N 2.89Å
143	M	95.7	Very high	93	Very high	70 Å²	70	36.3 Å²	36.3	35%	0.345	19%	0.187	S	C	.	.	H	α-helix	trans	-64.2	-42.7	179.4	-72.2	176.5	70.9	0	0	111.7	Y139 Q140 L146 I147 F258 F262	Y139-M143 WeakPolarHBondContact O-CB 3.35Å; Y139-M143 VanDerWaalsContact O-CG 3.26Å; Y139-M143 WeakPolarHBondContact O-CG 3.29Å; Y139-M143 PolarHBondContact O-N 2.72Å; Q140-M143 PolarHBondContact O-N 3.22Å; M143-L146 WeakPolarHBondContact O-CB 3.14Å; M143-L146 PolarHBondContact O-N 3.41Å; M143-I147 VanDerWaalsContact O-CG1 3.27Å; M143-I147 WeakPolarHBondContact O-CG1 3.28Å; M143-I147 PolarHBondContact O-N 3.01Å; M143-F258 HydrophobicContact CE-CE1 3.83Å; M143-F258 HydrophobicContact CE-CZ 4.33Å; M143-F258 HydrophobicContact SD-CD1 4.45Å; M143-F258 HydrophobicContact SD-CE1 3.94Å; M143-F262 HydrophobicContact CE-CZ 4.43Å; M143-F262 HydrophobicContact SD-CE1 3.69Å; M143-F262 HydrophobicContact SD-CZ 3.92Å
144	L	96.5	Very high	92.8	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.063	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-41.9	176.5	-70	174.3	0	0	0	111.4	Y102 Q140 E141 L146 I147 Y148 F162 Y163 A166 Y219	Y102-L144 HydrophobicContact CD2-CB 4.12Å; Y102-L144 HydrophobicContact CE2-CB 3.99Å; Q140-L144 WeakPolarHBondContact O-CB 3.34Å; Q140-L144 WeakPolarHBondContact O-CG 3.14Å; Q140-L144 PolarHBondContact O-N 3.13Å; E141-L144 PolarHBondContact O-N 2.67Å; L144-L146 VanDerWaalsContact C-N 3.34Å; L144-L146 PolarHBondContact O-N 3.05Å; L144-I147 PolarHBondContact O-N 2.92Å; L144-Y148 VanDerWaalsContact O-CB 3.3Å; L144-Y148 WeakPolarHBondContact O-CB 3.47Å; L144-Y148 PolarHBondContact O-N 2.98Å; L144-F162 HydrophobicContact CB-CE1 4.21Å; L144-F162 HydrophobicContact CD2-CE1 4.07Å; L144-F162 HydrophobicContact CD2-CZ 4.19Å; L144-Y163 HydrophobicContact CD1-CD2 3.69Å; L144-Y163 HydrophobicContact CD1-CE2 3.81Å; L144-A166 HydrophobicContact CD1-CB 4.09Å; L144-A166 HydrophobicContact CD2-CB 3.61Å; L144-Y219 HydrophobicContact CD1-CE1 3.96Å
145	A	96.6	Very high	92.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-41.1	175.4	0	0	0	0	0	111.5	Y102 L105 V106 L111 E141 V142 Y148 R149	Y102-A145 HydrophobicContact CD2-CB 3.91Å; Y102-A145 HydrophobicContact CE2-CB 4.11Å; L105-A145 HydrophobicContact CB-CB 3.6Å; L105-A145 HydrophobicContact CD1-CB 4.15Å; V106-A145 HydrophobicContact CG2-CB 4.1Å; L111-A145 HydrophobicContact CD1-CB 4.42Å; E141-A145 VanDerWaalsContact O-CB 3.3Å; E141-A145 WeakPolarHBondContact O-CB 3.3Å; E141-A145 PolarHBondContact O-N 3.4Å; V142-A145 PolarHBondContact O-N 3.27Å; A145-Y148 PolarHBondContact O-N 2.94Å; A145-R149 VanDerWaalsContact O-CB 3.29Å; A145-R149 WeakPolarHBondContact O-CB 3.34Å; A145-R149 WeakPolarHBondContact O-CG 3.33Å; A145-R149 PolarHBondContact O-N 3.26Å
146	L	95.3	Very high	93	Very high	74 Å²	74	53 Å²	53	39%	0.387	25%	0.254	S	S	.	.	H	α-helix	trans	-59.7	-50.3	174.1	-179.9	71.4	0	0	0	111.1	L111 V142 M143 L144 R149 L150	L111-L146 HydrophobicContact CD2-CB 4.16Å; L111-L146 HydrophobicContact CD2-CD1 3.41Å; L111-L146 VanDerWaalsContact CD2-CD1 3.41Å; L111-L146 HydrophobicContact CD2-CG 4.38Å; V142-L146 WeakPolarHBondContact O-CB 3.29Å; V142-L146 PolarHBondContact O-N 2.89Å; M143-L146 WeakPolarHBondContact O-CB 3.14Å; M143-L146 PolarHBondContact O-N 3.41Å; L144-L146 VanDerWaalsContact C-N 3.34Å; L144-L146 PolarHBondContact O-N 3.05Å; L146-R149 PolarHBondContact O-N 2.97Å; L146-L150 HydrophobicContact CD1-CD1 3.49Å; L146-L150 VanDerWaalsContact CD1-CD1 3.49Å; L146-L150 HydrophobicContact CD1-CG 4.02Å; L146-L150 HydrophobicContact CG-CD1 3.87Å; L146-L150 HydrophobicContact CG-CG 4.47Å; L146-L150 WeakPolarHBondContact O-CB 3.37Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 3.46Å
147	I	95	Very high	93.1	Very high	78 Å²	78	57.3 Å²	57.3	40%	0.4	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-50.2	178.4	-68.5	164.4	0	0	0	110.2	M143 L144 R149 L150 T151 L153 F162	M143-I147 VanDerWaalsContact O-CG1 3.27Å; M143-I147 WeakPolarHBondContact O-CG1 3.28Å; M143-I147 PolarHBondContact O-N 3.01Å; L144-I147 PolarHBondContact O-N 2.92Å; I147-R149 VanDerWaalsContact C-N 3.27Å; I147-R149 PolarHBondContact O-N 3.17Å; I147-L150 PolarHBondContact O-N 2.99Å; I147-T151 HydrophobicContact CG2-CG2 4.13Å; I147-T151 WeakPolarHBondContact O-CB 3.35Å; I147-T151 VanDerWaalsContact O-CG2 3.27Å; I147-T151 WeakPolarHBondContact O-CG2 3.48Å; I147-T151 PolarHBondContact O-N 3.29Å; I147-T151 PolarHBondContact O-OG1 2.92Å; I147-L153 HydrophobicContact CG2-CD1 4.32Å; I147-F162 HydrophobicContact CB-CZ 4.44Å; I147-F162 HydrophobicContact CG2-CZ 3.91Å
148	Y	95.5	Very high	93.3	Very high	10 Å²	10	61 Å²	61	4%	0.039	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-37.2	180	-173.3	-102.6	0	0	0	112	V106 L144 A145 L153 K154 F157 P159 F162	V106-Y148 HydrophobicContact CB-CD1 4.49Å; V106-Y148 HydrophobicContact CG1-CD1 3.73Å; V106-Y148 HydrophobicContact CG1-CE1 3.63Å; V106-Y148 HydrophobicContact CG2-CD1 3.87Å; L144-Y148 VanDerWaalsContact O-CB 3.3Å; L144-Y148 WeakPolarHBondContact O-CB 3.47Å; L144-Y148 PolarHBondContact O-N 2.98Å; A145-Y148 PolarHBondContact O-N 2.94Å; Y148-L153 HydrophobicContact CD2-CB 4.37Å; Y148-K154 HydrophobicContact CD1-CD 4.48Å; Y148-K154 HydrophobicContact CD1-CG 3.84Å; Y148-K154 HydrophobicContact CE1-CD 4.27Å; Y148-K154 HydrophobicContact CE1-CG 3.38Å; Y148-K154 HydrophobicContact CE2-CG 4.19Å; Y148-K154 HydrophobicContact CG-CG 4.4Å; Y148-K154 WeakPolarHBondContact O-CD 3.34Å; Y148-K154 WeakPolarHBondContact O-CG 3.36Å; Y148-F157 WeakPolarHBondContact CE2-O 3.45Å; Y148-F157 PolarHBondContact OH-O 2.89Å; Y148-P159 HydrophobicContact CE1-CB 3.99Å; Y148-P159 HydrophobicContact CE1-CG 3.76Å; Y148-P159 VanDerWaalsContact OH-CD 3.32Å; Y148-P159 WeakPolarHBondContact OH-CD 3.43Å; Y148-P159 WeakPolarHBondContact OH-CG 3.49Å; Y148-F162 HydrophobicContact CD2-CB 3.92Å; Y148-F162 AromaticContact CD2-CD1 3.65Å; Y148-F162 HydrophobicContact CD2-CD1 3.65Å; Y148-F162 HydrophobicContact CD2-CD2 4.44Å; Y148-F162 HydrophobicContact CD2-CE1 4.29Å; Y148-F162 AromaticContact CD2-CG 3.73Å; Y148-F162 HydrophobicContact CD2-CG 3.73Å; Y148-F162 HydrophobicContact CE2-CB 4.05Å; Y148-F162 HydrophobicContact CE2-CG 4.35Å; Y148-F162 HydrophobicContact CG-CD1 4.14Å
149	R	93.8	Very high	93.4	Very high	51 Å²	51	62.1 Å²	62.1	19%	0.192	30%	0.297	C	S	.	.	H	α-helix	trans	-75.6	-34.6	179.3	-70.8	-177.4	70.6	141.5	10.6	114.6	L105 S108 P109 S110 L111 A145 L146 I147	L105-R149 WeakPolarHBondContact O-CD 3.5Å; L105-R149 PolarHBondContact O-NH1 2.98Å; S108-R149 PolarHBondContact O-NH1 3.39Å; S108-R149 PolarHBondContact O-NH2 3.06Å; S108-R149 VanDerWaalsContact O-NH2 3.13Å; P109-R149 PolarHBondContact O-NH2 2.86Å; S110-R149 VanDerWaalsContact CA-NH2 3.33Å; S110-R149 PolarHBondContact O-NH1 2.85Å; L111-R149 VanDerWaalsContact N-NH1 3.17Å; A145-R149 VanDerWaalsContact O-CB 3.29Å; A145-R149 WeakPolarHBondContact O-CB 3.34Å; A145-R149 WeakPolarHBondContact O-CG 3.33Å; A145-R149 PolarHBondContact O-N 3.26Å; L146-R149 PolarHBondContact O-N 2.97Å; I147-R149 VanDerWaalsContact C-N 3.27Å; I147-R149 PolarHBondContact O-N 3.17Å
150	L	92.1	Very high	93.4	Very high	137 Å²	137	61.3 Å²	61.3	72%	0.717	29%	0.294	S	S	*	.	H	α-helix	trans	-91.4	-18.6	-175	-66.5	-176.2	0	0	0	114.1	L146 I147	L146-L150 HydrophobicContact CD1-CD1 3.49Å; L146-L150 VanDerWaalsContact CD1-CD1 3.49Å; L146-L150 HydrophobicContact CD1-CG 4.02Å; L146-L150 HydrophobicContact CG-CD1 3.87Å; L146-L150 HydrophobicContact CG-CG 4.47Å; L146-L150 WeakPolarHBondContact O-CB 3.37Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 3.46Å; I147-L150 PolarHBondContact O-N 2.99Å
151	T	92.3	Very high	93.3	Very high	48 Å²	48	62.9 Å²	62.9	29%	0.294	30%	0.302	S	S	.	.	S	Bend	trans	-97.5	160	179.4	60.8	0	0	0	0	111.4	I147 L153	I147-T151 HydrophobicContact CG2-CG2 4.13Å; I147-T151 WeakPolarHBondContact O-CB 3.35Å; I147-T151 VanDerWaalsContact O-CG2 3.27Å; I147-T151 WeakPolarHBondContact O-CG2 3.48Å; I147-T151 PolarHBondContact O-N 3.29Å; I147-T151 PolarHBondContact O-OG1 2.92Å; T151-L153 PolarHBondContact O-N 3.43Å; T151-L153 WeakPolarHBondContact OG1-CB 3.22Å; T151-L153 VanDerWaalsContact OG1-CD1 3.23Å; T151-L153 WeakPolarHBondContact OG1-CD1 3.37Å; T151-L153 WeakPolarHBondContact OG1-CG 3.37Å
152	P	91.7	Very high	93.2	Very high	84 Å²	84	64.3 Å²	64.3	55%	0.545	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-69.7	6.3	174.2	29.6	-36.1	0	0	0	113.9	K154 R155 F156	P152-K154 PolarHBondContact O-N 3.02Å; P152-R155 WeakPolarHBondContact O-CB 3.49Å; P152-R155 PolarHBondContact O-N 3.46Å; P152-F156 WeakPolarHBondContact O-CD2 3.35Å
153	L	89.5	Confident	93.2	Very high	44 Å²	44	63.3 Å²	63.3	23%	0.23	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-57.7	-30.7	-177.1	-68.2	177.1	0	0	0	113.2	I147 Y148 T151 R155 F156 F157 F162	I147-L153 HydrophobicContact CG2-CD1 4.32Å; Y148-L153 HydrophobicContact CD2-CB 4.37Å; T151-L153 PolarHBondContact O-N 3.43Å; T151-L153 WeakPolarHBondContact OG1-CB 3.22Å; T151-L153 VanDerWaalsContact OG1-CD1 3.23Å; T151-L153 WeakPolarHBondContact OG1-CD1 3.37Å; T151-L153 WeakPolarHBondContact OG1-CG 3.37Å; L153-R155 PolarHBondContact O-N 3.43Å; L153-F156 PolarHBondContact O-N 2.84Å; L153-F157 HydrophobicContact CD2-CD2 4.14Å; L153-F157 HydrophobicContact CD2-CE2 4.23Å; L153-F157 PolarHBondContact O-N 3.15Å; L153-F162 HydrophobicContact CD1-CD2 3.92Å; L153-F162 HydrophobicContact CD1-CE2 3.45Å; L153-F162 VanDerWaalsContact CD1-CE2 3.45Å; L153-F162 HydrophobicContact CD1-CZ 4.1Å
154	K	87.1	Confident	93.2	Very high	93 Å²	93	60 Å²	60	40%	0.404	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-51.9	-25.8	172.6	-80	169.1	164.7	-175.4	0	114.9	Y148 P152 F156	Y148-K154 HydrophobicContact CD1-CD 4.48Å; Y148-K154 HydrophobicContact CD1-CG 3.84Å; Y148-K154 HydrophobicContact CE1-CD 4.27Å; Y148-K154 HydrophobicContact CE1-CG 3.38Å; Y148-K154 HydrophobicContact CE2-CG 4.19Å; Y148-K154 HydrophobicContact CG-CG 4.4Å; Y148-K154 WeakPolarHBondContact O-CD 3.34Å; Y148-K154 WeakPolarHBondContact O-CG 3.36Å; P152-K154 PolarHBondContact O-N 3.02Å; K154-F156 VanDerWaalsContact C-N 3.33Å
155	R	89.8	Confident	93.1	Very high	212 Å²	212	61.6 Å²	61.6	80%	0.8	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-79.6	-18.4	178.9	-61.6	-178.4	-179.3	175.4	-0.1	112.9	P152 L153	P152-R155 WeakPolarHBondContact O-CB 3.49Å; P152-R155 PolarHBondContact O-N 3.46Å; L153-R155 PolarHBondContact O-N 3.43Å
156	F	90.1	Very high	93	Very high	152 Å²	152	62.2 Å²	62.2	67%	0.667	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-29.2	-170.1	-57.1	-72.1	0	0	0	113.2	P152 L153 K154	P152-F156 WeakPolarHBondContact O-CD2 3.35Å; L153-F156 PolarHBondContact O-N 2.84Å; K154-F156 VanDerWaalsContact C-N 3.33Å
157	F	89.7	Confident	93.1	Very high	90 Å²	90	58.7 Å²	58.7	40%	0.395	28%	0.281	S	S	.	.			trans	-129.1	135.7	-173.5	-63.3	-80.4	0	0	0	111.6	Y148 L153 F162	Y148-F157 WeakPolarHBondContact CE2-O 3.45Å; Y148-F157 PolarHBondContact OH-O 2.89Å; L153-F157 HydrophobicContact CD2-CD2 4.14Å; L153-F157 HydrophobicContact CD2-CE2 4.23Å; L153-F157 PolarHBondContact O-N 3.15Å; F157-F162 HydrophobicContact CB-CB 4.28Å
158	E	93.2	Very high	93.2	Very high	82 Å²	82	55 Å²	55	38%	0.383	26%	0.262	S	S	.	.			trans	-63.7	147.9	164.1	-64	-176.6	-119.3	0	0	110.3	R87 I160 L161 F162	R87-E158 IonicContact CZ-OE1 2.63Å; R87-E158 IonicContact CZ-OE2 3.09Å; R87-E158 IonicContact NH1-OE1 3.44Å; R87-E158 PolarHBondContact NH1-OE1 3.42Å; R87-E158 VanDerWaalsContact NH1-OE1 3.17Å; R87-E158 IonicContact NH1-OE2 2.94Å; R87-E158 PolarHBondContact NH1-OE2 3.29Å; R87-E158 IonicContact NH2-OE1 2.78Å; R87-E158 PolarHBondContact NH2-OE1 3.43Å; E158-I160 VanDerWaalsContact C-N 3.26Å; E158-I160 HydrophobicContact CB-CG2 4.5Å; E158-I160 PolarHBondContact O-N 3.28Å; E158-L161 HydrophobicContact CB-CD1 4.08Å; E158-L161 HydrophobicContact CB-CG 4.17Å; E158-L161 HydrophobicContact CG-CD1 4.35Å; E158-L161 PolarHBondContact O-N 3.34Å; E158-F162 PolarHBondContact O-N 2.94Å; E158-F162 VanDerWaalsContact O-N 3.11Å
159	P	94.2	Very high	93.2	Very high	23 Å²	23	56.9 Å²	56.9	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-57.3	-39.1	-175.6	-22.5	30.2	0	0	0	113.3	Y102 V106 Y148 Y163	Y102-P159 HydrophobicContact CE1-CB 3.86Å; Y102-P159 VanDerWaalsContact CE1-O 3.28Å; Y102-P159 WeakPolarHBondContact CE1-O 3.22Å; Y102-P159 PolarHBondContact OH-O 3.49Å; Y102-P159 VanDerWaalsContact OH-O 3.07Å; V106-P159 HydrophobicContact CG1-CB 4.12Å; V106-P159 HydrophobicContact CG1-CG 3.98Å; Y148-P159 HydrophobicContact CE1-CB 3.99Å; Y148-P159 HydrophobicContact CE1-CG 3.76Å; Y148-P159 VanDerWaalsContact OH-CD 3.32Å; Y148-P159 WeakPolarHBondContact OH-CD 3.43Å; Y148-P159 WeakPolarHBondContact OH-CG 3.49Å; P159-Y163 WeakPolarHBondContact O-CB 3.38Å; P159-Y163 PolarHBondContact O-N 3.17Å
160	I	94.7	Very high	93.4	Very high	2 Å²	2	57 Å²	57	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-67.6	-41.1	-178.8	-161.9	163.1	0	0	0	112.3	F79 R87 E88 M91 Y99 E158 Y163 T164	F79-I160 HydrophobicContact CZ-CD1 4.13Å; F79-I160 HydrophobicContact CZ-CG1 4.01Å; R87-I160 HydrophobicContact CB-CD1 3.61Å; E88-I160 HydrophobicContact CG-CD1 4.01Å; M91-I160 HydrophobicContact CE-CD1 3.84Å; M91-I160 HydrophobicContact CE-CG1 3.47Å; M91-I160 VanDerWaalsContact CE-CG1 3.47Å; M91-I160 HydrophobicContact SD-CD1 4.44Å; Y99-I160 HydrophobicContact CD1-CD1 4.4Å; Y99-I160 HydrophobicContact CD2-CG1 4.46Å; Y99-I160 HydrophobicContact CE1-CD1 3.77Å; Y99-I160 HydrophobicContact CE1-CG1 4.08Å; Y99-I160 HydrophobicContact CE2-CB 3.96Å; Y99-I160 HydrophobicContact CE2-CD1 4.39Å; Y99-I160 HydrophobicContact CE2-CG1 3.78Å; Y99-I160 VanDerWaalsContact OH-CB 3.3Å; Y99-I160 WeakPolarHBondContact OH-CB 3.39Å; E158-I160 VanDerWaalsContact C-N 3.26Å; E158-I160 HydrophobicContact CB-CG2 4.5Å; E158-I160 PolarHBondContact O-N 3.28Å; I160-Y163 PolarHBondContact O-N 3.49Å; I160-T164 PolarHBondContact O-N 2.92Å; I160-T164 PolarHBondContact O-OG1 3.34Å; I160-T164 VanDerWaalsContact O-OG1 3.1Å
161	L	94	Very high	93.6	Very high	37 Å²	37	50.7 Å²	50.7	19%	0.194	25%	0.25	C	S	.	.	H	α-helix	trans	-65.2	-47.3	178.2	-62.6	176.8	0	0	0	110.2	F79 E158 Y163 T164 D165	F79-L161 HydrophobicContact CD1-CD2 3.78Å; F79-L161 HydrophobicContact CE1-CD2 3.78Å; E158-L161 HydrophobicContact CB-CD1 4.08Å; E158-L161 HydrophobicContact CB-CG 4.17Å; E158-L161 HydrophobicContact CG-CD1 4.35Å; E158-L161 PolarHBondContact O-N 3.34Å; L161-Y163 VanDerWaalsContact C-N 3.29Å; L161-Y163 PolarHBondContact O-N 2.93Å; L161-T164 PolarHBondContact O-N 2.78Å; L161-D165 WeakPolarHBondContact O-CB 3.26Å; L161-D165 PolarHBondContact O-N 3.48Å
162	F	95	Very high	93.9	Very high	30 Å²	30	48.6 Å²	48.6	13%	0.132	24%	0.238	C	C	.	.	H	α-helix	trans	-57.5	-43.2	175.2	173	-101.1	0	0	0	112.1	Y102 L144 I147 Y148 L153 F157 E158 A166	Y102-F162 WeakPolarHBondContact OH-CD1 3.46Å; L144-F162 HydrophobicContact CB-CE1 4.21Å; L144-F162 HydrophobicContact CD2-CE1 4.07Å; L144-F162 HydrophobicContact CD2-CZ 4.19Å; I147-F162 HydrophobicContact CB-CZ 4.44Å; I147-F162 HydrophobicContact CG2-CZ 3.91Å; Y148-F162 HydrophobicContact CD2-CB 3.92Å; Y148-F162 AromaticContact CD2-CD1 3.65Å; Y148-F162 HydrophobicContact CD2-CD1 3.65Å; Y148-F162 HydrophobicContact CD2-CD2 4.44Å; Y148-F162 HydrophobicContact CD2-CE1 4.29Å; Y148-F162 AromaticContact CD2-CG 3.73Å; Y148-F162 HydrophobicContact CD2-CG 3.73Å; Y148-F162 HydrophobicContact CE2-CB 4.05Å; Y148-F162 HydrophobicContact CE2-CG 4.35Å; Y148-F162 HydrophobicContact CG-CD1 4.14Å; L153-F162 HydrophobicContact CD1-CD2 3.92Å; L153-F162 HydrophobicContact CD1-CE2 3.45Å; L153-F162 VanDerWaalsContact CD1-CE2 3.45Å; L153-F162 HydrophobicContact CD1-CZ 4.1Å; F157-F162 HydrophobicContact CB-CB 4.28Å; E158-F162 PolarHBondContact O-N 2.94Å; E158-F162 VanDerWaalsContact O-N 3.11Å; F162-A166 VanDerWaalsContact O-CB 3.24Å; F162-A166 WeakPolarHBondContact O-CB 3.44Å; F162-A166 PolarHBondContact O-N 3.38Å
163	Y	95.5	Very high	94.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-44.8	179.8	-178.3	-109.1	0	0	0	112.3	M91 Y99 Y102 E141 L144 P159 I160 L161 S167 N214	M91-Y163 HydrophobicContact CE-CD1 4.3Å; Y99-Y163 AromaticContact CD2-CD1 3.4Å; Y99-Y163 HydrophobicContact CD2-CD1 3.4Å; Y99-Y163 VanDerWaalsContact CD2-CD1 3.4Å; Y99-Y163 AromaticContact CD2-CE1 3.81Å; Y99-Y163 HydrophobicContact CD2-CE1 3.81Å; Y99-Y163 AromaticContact CD2-CG 3.93Å; Y99-Y163 HydrophobicContact CD2-CG 3.93Å; Y99-Y163 HydrophobicContact CE2-CD1 4.18Å; Y99-Y163 HydrophobicContact CE2-CG 4.39Å; Y99-Y163 HydrophobicContact CG-CD1 4.26Å; Y99-Y163 HydrophobicContact CG-CE1 4.31Å; Y102-Y163 HydrophobicContact CD1-CD2 4.05Å; Y102-Y163 HydrophobicContact CD1-CG 4.08Å; Y102-Y163 AromaticContact CD2-CD2 3.95Å; Y102-Y163 HydrophobicContact CD2-CD2 3.95Å; Y102-Y163 HydrophobicContact CD2-CE2 4.49Å; Y102-Y163 HydrophobicContact CE1-CD2 4.41Å; Y102-Y163 HydrophobicContact CE1-CG 4.28Å; Y102-Y163 HydrophobicContact CE2-CD2 4.32Å; Y102-Y163 AromaticContact CG-CD2 3.8Å; Y102-Y163 HydrophobicContact CG-CD2 3.8Å; Y102-Y163 HydrophobicContact CG-CE2 4.23Å; Y102-Y163 HydrophobicContact CG-CG 4.3Å; E141-Y163 HydrophobicContact CG-CE2 3.99Å; E141-Y163 PolarHBondContact OE1-OH 3Å; L144-Y163 HydrophobicContact CD1-CD2 3.69Å; L144-Y163 HydrophobicContact CD1-CE2 3.81Å; P159-Y163 WeakPolarHBondContact O-CB 3.38Å; P159-Y163 PolarHBondContact O-N 3.17Å; I160-Y163 PolarHBondContact O-N 3.49Å; L161-Y163 VanDerWaalsContact C-N 3.29Å; L161-Y163 PolarHBondContact O-N 2.93Å; Y163-S167 PolarHBondContact O-N 3.33Å; Y163-N214 HydrophobicContact CD1-CB 4.28Å; Y163-N214 WeakPolarHBondContact CD1-ND2 3.49Å; Y163-N214 HydrophobicContact CE1-CB 3.48Å; Y163-N214 VanDerWaalsContact CE1-CB 3.48Å; Y163-N214 VanDerWaalsContact CE1-CG 3.42Å; Y163-N214 WeakPolarHBondContact CE1-ND2 3.26Å; Y163-N214 PolarHBondContact O-ND2 3.18Å
164	T	94.6	Very high	94.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-49.4	176.2	-58.2	0	0	0	0	111.8	M91 I160 L161 A166 S167 F168	M91-T164 VanDerWaalsContact CE-OG1 3.29Å; M91-T164 WeakPolarHBondContact CE-OG1 3.3Å; I160-T164 PolarHBondContact O-N 2.92Å; I160-T164 PolarHBondContact O-OG1 3.34Å; I160-T164 VanDerWaalsContact O-OG1 3.1Å; L161-T164 PolarHBondContact O-N 2.78Å; T164-A166 VanDerWaalsContact C-N 3.3Å; T164-A166 PolarHBondContact O-N 2.88Å; T164-S167 WeakPolarHBondContact O-CB 3.29Å; T164-S167 PolarHBondContact O-N 2.92Å; T164-F168 HydrophobicContact CG2-CD2 4.44Å; T164-F168 HydrophobicContact CG2-CE1 4.29Å; T164-F168 HydrophobicContact CG2-CE2 3.6Å; T164-F168 HydrophobicContact CG2-CZ 3.49Å; T164-F168 VanDerWaalsContact CG2-CZ 3.49Å; T164-F168 PolarHBondContact O-N 2.85Å
165	D	94.5	Very high	95.1	Very high	46 Å²	46	41.7 Å²	41.7	25%	0.246	20%	0.198	C	C	.	.	H	α-helix	trans	-65.5	-32.1	-179.7	-73.8	-25.6	0	0	0	112.7	H70 L161 S167 F168 A169	H70-D165 IonicContact CE1-OD1 3.52Å; H70-D165 IonicContact CG-OD1 2.83Å; H70-D165 IonicContact ND1-OD1 3.88Å; H70-D165 PolarHBondContact ND1-OD1 3.31Å; L161-D165 WeakPolarHBondContact O-CB 3.26Å; L161-D165 PolarHBondContact O-N 3.48Å; D165-S167 VanDerWaalsContact C-N 3.3Å; D165-S167 PolarHBondContact O-N 3.14Å; D165-F168 PolarHBondContact O-N 3.31Å; D165-F168 VanDerWaalsContact O-N 3.15Å; D165-F168 WeakPolarHBondContact OD1-CD2 3.43Å; D165-A169 WeakPolarHBondContact O-CB 3.2Å; D165-A169 PolarHBondContact O-N 3.02Å
166	A	95.7	Very high	95.5	Very high	12 Å²	12	32 Å²	32	10%	0.099	16%	0.164	C	C	.	.	H	α-helix	trans	-60.3	-41	171.9	0	0	0	0	0	111.6	L144 F162 T164 F168 A169 F170	L144-A166 HydrophobicContact CD1-CB 4.09Å; L144-A166 HydrophobicContact CD2-CB 3.61Å; F162-A166 VanDerWaalsContact O-CB 3.24Å; F162-A166 WeakPolarHBondContact O-CB 3.44Å; F162-A166 PolarHBondContact O-N 3.38Å; T164-A166 VanDerWaalsContact C-N 3.3Å; T164-A166 PolarHBondContact O-N 2.88Å; A166-F168 VanDerWaalsContact C-N 3.32Å; A166-F168 PolarHBondContact O-N 2.92Å; A166-A169 PolarHBondContact O-N 3.38Å; A166-F170 WeakPolarHBondContact O-CD2 3.2Å; A166-F170 PolarHBondContact O-N 2.87Å
167	S	96	Very high	95.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.5	-39.5	174.2	-175.6	0	0	0	0	111.8	Y163 T164 D165 F170 G171 V209 N214	Y163-S167 PolarHBondContact O-N 3.33Å; T164-S167 WeakPolarHBondContact O-CB 3.29Å; T164-S167 PolarHBondContact O-N 2.92Å; D165-S167 VanDerWaalsContact C-N 3.3Å; D165-S167 PolarHBondContact O-N 3.14Å; S167-F170 PolarHBondContact O-N 3.47Å; S167-G171 PolarHBondContact O-N 3.05Å; S167-V209 VanDerWaalsContact O-CG2 3.23Å; S167-V209 WeakPolarHBondContact O-CG2 3.4Å; S167-N214 PolarHBondContact OG-N 3.49Å
168	F	97	Very high	96.3	Very high	1 Å²	1	21.9 Å²	21.9	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-64.8	-44.4	176	-58.1	-32	0	0	0	111.4	V66 A69 H70 H73 T164 D165 A166 F170 G171 G172 V209	V66-F168 HydrophobicContact CG1-CB 4.14Å; A69-F168 HydrophobicContact CB-CB 4.39Å; A69-F168 HydrophobicContact CB-CD1 3.71Å; A69-F168 HydrophobicContact CB-CE1 4.16Å; A69-F168 HydrophobicContact CB-CG 4.04Å; H70-F168 HydrophobicContact CB-CD2 3.95Å; H70-F168 HydrophobicContact CB-CE2 4.18Å; H73-F168 HydrophobicContact CB-CE2 4.16Å; H73-F168 HydrophobicContact CB-CZ 3.66Å; H73-F168 AromaticContact CG-CZ 3.74Å; T164-F168 HydrophobicContact CG2-CD2 4.44Å; T164-F168 HydrophobicContact CG2-CE1 4.29Å; T164-F168 HydrophobicContact CG2-CE2 3.6Å; T164-F168 HydrophobicContact CG2-CZ 3.49Å; T164-F168 VanDerWaalsContact CG2-CZ 3.49Å; T164-F168 PolarHBondContact O-N 2.85Å; D165-F168 PolarHBondContact O-N 3.31Å; D165-F168 VanDerWaalsContact O-N 3.15Å; D165-F168 WeakPolarHBondContact OD1-CD2 3.43Å; A166-F168 VanDerWaalsContact C-N 3.32Å; A166-F168 PolarHBondContact O-N 2.92Å; F168-F170 VanDerWaalsContact C-N 3.3Å; F168-F170 PolarHBondContact O-N 2.94Å; F168-G171 WeakPolarHBondContact O-CA 3.29Å; F168-G171 PolarHBondContact O-N 3.43Å; F168-G172 PolarHBondContact O-N 3.5Å; F168-V209 HydrophobicContact CD1-CG2 3.99Å; F168-V209 WeakPolarHBondContact CE1-O 3.5Å
169	A	97	Very high	96.5	Very high	50 Å²	50	18 Å²	18	41%	0.413	10%	0.102	S	C	.	.	H	α-helix	trans	-57.7	-40.7	176.6	0	0	0	0	0	112.4	D165 A166 G172 F173	D165-A169 WeakPolarHBondContact O-CB 3.2Å; D165-A169 PolarHBondContact O-N 3.02Å; A166-A169 PolarHBondContact O-N 3.38Å; A169-G172 PolarHBondContact O-N 2.92Å; A169-F173 WeakPolarHBondContact O-CB 3.48Å; A169-F173 PolarHBondContact O-N 2.99Å
170	F	97.2	Very high	96.7	Very high	53 Å²	53	18 Å²	18	23%	0.232	10%	0.102	C	C	.	.	H	α-helix	trans	-63.5	-39.8	172.9	-94.1	-99	0	0	0	112.5	A166 S167 F168 F173 G174 Y219 P222 V223 F262	A166-F170 WeakPolarHBondContact O-CD2 3.2Å; A166-F170 PolarHBondContact O-N 2.87Å; S167-F170 PolarHBondContact O-N 3.47Å; F168-F170 VanDerWaalsContact C-N 3.3Å; F168-F170 PolarHBondContact O-N 2.94Å; F170-F173 WeakPolarHBondContact O-CB 3.19Å; F170-F173 PolarHBondContact O-N 2.93Å; F170-G174 PolarHBondContact O-N 2.92Å; F170-Y219 HydrophobicContact CB-CD1 4.2Å; F170-Y219 AromaticContact CD1-CD1 3.95Å; F170-Y219 HydrophobicContact CD1-CD1 3.95Å; F170-Y219 AromaticContact CD2-CD1 3.63Å; F170-Y219 HydrophobicContact CD2-CD1 3.63Å; F170-Y219 AromaticContact CD2-CE1 3.95Å; F170-Y219 HydrophobicContact CD2-CE1 3.95Å; F170-Y219 HydrophobicContact CE1-CD1 4.18Å; F170-Y219 AromaticContact CE2-CD1 3.87Å; F170-Y219 HydrophobicContact CE2-CD1 3.87Å; F170-Y219 HydrophobicContact CE2-CE1 4.28Å; F170-Y219 AromaticContact CG-CD1 3.66Å; F170-Y219 HydrophobicContact CG-CD1 3.66Å; F170-Y219 HydrophobicContact CG-CE1 4.31Å; F170-Y219 HydrophobicContact CZ-CD1 4.14Å; F170-P222 HydrophobicContact CB-CG 4.39Å; F170-P222 HydrophobicContact CD1-CB 4.42Å; F170-P222 VanDerWaalsContact O-CB 3.29Å; F170-P222 WeakPolarHBondContact O-CB 3.33Å; F170-P222 WeakPolarHBondContact O-CG 3.25Å; F170-V223 HydrophobicContact CE1-CG2 4.27Å; F170-F262 HydrophobicContact CE1-CE2 4.01Å; F170-F262 HydrophobicContact CZ-CE2 4.3Å
171	G	97	Very high	96.8	Very high	5 Å²	5	18 Å²	18	5%	0.052	10%	0.102	C	C	.	.	H	α-helix	trans	-57.4	-49.2	172.2	0	0	0	0	0	112.4	L65 S167 F168 F173 G174 L175	L65-G171 WeakPolarHBondContact CD2-O 3.49Å; S167-G171 PolarHBondContact O-N 3.05Å; F168-G171 WeakPolarHBondContact O-CA 3.29Å; F168-G171 PolarHBondContact O-N 3.43Å; G171-F173 PolarHBondContact O-N 3.46Å; G171-G174 PolarHBondContact O-N 3.31Å; G171-G174 VanDerWaalsContact O-N 3.16Å; G171-L175 PolarHBondContact O-N 3.05Å; G171-L175 VanDerWaalsContact O-N 3.15Å
172	G	97.7	Very high	97	Very high	4 Å²	4	16.3 Å²	16.3	4%	0.041	9%	0.093	C	C	.	.	H	α-helix	trans	-60.5	-42.2	174.9	0	0	0	0	0	113.3	G62 F168 A169 G174 L175 A176	G62-G172 VanDerWaalsContact CA-O 3.25Å; G62-G172 WeakPolarHBondContact CA-O 3.29Å; G62-G172 WeakPolarHBondContact O-CA 3.47Å; F168-G172 PolarHBondContact O-N 3.5Å; A169-G172 PolarHBondContact O-N 2.92Å; G172-G174 VanDerWaalsContact C-N 3.3Å; G172-G174 PolarHBondContact O-N 3.41Å; G172-L175 PolarHBondContact O-N 2.92Å; G172-A176 PolarHBondContact O-N 3.45Å
173	F	98	Very high	97	Very high	73 Å²	73	16.2 Å²	16.2	32%	0.32	9%	0.092	S	C	.	.	H	α-helix	trans	-58.8	-41.8	173.3	173.2	-108.2	0	0	0	111.7	A169 F170 G171 L175 A176 M177 P222 M226	A169-F173 WeakPolarHBondContact O-CB 3.48Å; A169-F173 PolarHBondContact O-N 2.99Å; F170-F173 WeakPolarHBondContact O-CB 3.19Å; F170-F173 PolarHBondContact O-N 2.93Å; G171-F173 PolarHBondContact O-N 3.46Å; F173-L175 PolarHBondContact O-N 2.61Å; F173-A176 WeakPolarHBondContact O-CB 3.29Å; F173-A176 PolarHBondContact O-N 2.78Å; F173-M177 HydrophobicContact CD1-CG 4.42Å; F173-M177 HydrophobicContact CD2-CE 4.15Å; F173-M177 HydrophobicContact CD2-CG 4.3Å; F173-M177 HydrophobicContact CE1-CG 3.96Å; F173-M177 HydrophobicContact CE2-CE 3.62Å; F173-M177 HydrophobicContact CE2-CG 3.85Å; F173-M177 HydrophobicContact CE2-SD 3.87Å; F173-M177 HydrophobicContact CZ-CE 4.24Å; F173-M177 HydrophobicContact CZ-CG 3.65Å; F173-M177 HydrophobicContact CZ-SD 3.86Å; F173-M177 WeakPolarHBondContact O-CG 3.42Å; F173-M177 PolarHBondContact O-N 3.19Å; F173-P222 HydrophobicContact CD1-CB 3.77Å; F173-P222 HydrophobicContact CE1-CB 4.39Å; F173-M226 HydrophobicContact CE1-CB 4.47Å; F173-M226 HydrophobicContact CZ-CB 4.27Å; F173-M226 HydrophobicContact CZ-SD 3.78Å
174	G	97.8	Very high	96.9	Very high	2 Å²	2	17.4 Å²	17.4	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-59.2	-46.1	175.9	0	0	0	0	0	112.7	F170 G171 G172 M177 L178	F170-G174 PolarHBondContact O-N 2.92Å; G171-G174 PolarHBondContact O-N 3.31Å; G171-G174 VanDerWaalsContact O-N 3.16Å; G172-G174 VanDerWaalsContact C-N 3.3Å; G172-G174 PolarHBondContact O-N 3.41Å; G174-M177 PolarHBondContact O-N 3.07Å; G174-L178 WeakPolarHBondContact O-CG 3.27Å; G174-L178 PolarHBondContact O-N 3.12Å
175	L	98.2	Very high	96.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.7	-40.8	175.9	-179	55.5	0	0	0	112.3	S61 L65 G171 G172 F173 M177 L178 C179 F199 L200	S61-L175 WeakPolarHBondContact O-CD2 3.48Å; L65-L175 HydrophobicContact CB-CD2 3.92Å; L65-L175 HydrophobicContact CD2-CB 3.91Å; L65-L175 HydrophobicContact CD2-CD2 4.01Å; G171-L175 PolarHBondContact O-N 3.05Å; G171-L175 VanDerWaalsContact O-N 3.15Å; G172-L175 PolarHBondContact O-N 2.92Å; F173-L175 PolarHBondContact O-N 2.61Å; L175-M177 VanDerWaalsContact C-N 3.31Å; L175-M177 PolarHBondContact O-N 3.38Å; L175-L178 PolarHBondContact O-N 3.28Å; L175-C179 PolarHBondContact O-N 3.04Å; L175-C179 PolarHBondContact O-SG 3.48Å; L175-F199 HydrophobicContact CD1-CB 3.83Å; L175-F199 HydrophobicContact CD1-CD1 3.91Å; L175-F199 HydrophobicContact CD1-CD2 4.08Å; L175-F199 HydrophobicContact CD1-CG 3.68Å; L175-F199 HydrophobicContact CD2-CD1 4.22Å; L175-L200 HydrophobicContact CD2-CD2 4.49Å
176	A	98.3	Very high	96.8	Very high	9 Å²	9	16 Å²	16	7%	0.074	9%	0.094	C	C	.	.	H	α-helix	trans	-60.6	-40.9	175.1	0	0	0	0	0	111.8	S58 G172 F173 C179 C180	S58-A176 WeakPolarHBondContact CB-O 3.49Å; S58-A176 WeakPolarHBondContact O-CA 3.3Å; S58-A176 VanDerWaalsContact O-CB 3.28Å; S58-A176 WeakPolarHBondContact O-CB 3.46Å; S58-A176 PolarHBondContact OG-O 3.32Å; G172-A176 PolarHBondContact O-N 3.45Å; F173-A176 WeakPolarHBondContact O-CB 3.29Å; F173-A176 PolarHBondContact O-N 2.78Å; A176-C179 PolarHBondContact O-N 2.91Å; A176-C180 PolarHBondContact O-N 3.03Å; A176-C180 PolarHBondContact O-SG 3.38Å; A176-C180 VanDerWaalsContact O-SG 3.34Å
177	M	98	Very high	96.6	Very high	29 Å²	29	18 Å²	18	14%	0.143	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-38.9	176.4	-67.8	-58.8	101.7	0	0	112.5	F173 G174 L175 C180 L181 W225 M226 L229	F173-M177 HydrophobicContact CD1-CG 4.42Å; F173-M177 HydrophobicContact CD2-CE 4.15Å; F173-M177 HydrophobicContact CD2-CG 4.3Å; F173-M177 HydrophobicContact CE1-CG 3.96Å; F173-M177 HydrophobicContact CE2-CE 3.62Å; F173-M177 HydrophobicContact CE2-CG 3.85Å; F173-M177 HydrophobicContact CE2-SD 3.87Å; F173-M177 HydrophobicContact CZ-CE 4.24Å; F173-M177 HydrophobicContact CZ-CG 3.65Å; F173-M177 HydrophobicContact CZ-SD 3.86Å; F173-M177 WeakPolarHBondContact O-CG 3.42Å; F173-M177 PolarHBondContact O-N 3.19Å; G174-M177 PolarHBondContact O-N 3.07Å; L175-M177 VanDerWaalsContact C-N 3.31Å; L175-M177 PolarHBondContact O-N 3.38Å; M177-C180 PolarHBondContact O-N 2.97Å; M177-L181 WeakPolarHBondContact O-CB 3.23Å; M177-L181 PolarHBondContact O-N 3.04Å; M177-W225 HydrophobicContact CB-CB 4.04Å; M177-M226 HydrophobicContact CG-CB 3.91Å; M177-M226 HydrophobicContact SD-CB 3.92Å; M177-M226 HydrophobicContact SD-CG 4.04Å; M177-L229 HydrophobicContact SD-CD2 4.48Å
178	L	98.4	Very high	96.5	Very high	1 Å²	1	19 Å²	19	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-65.1	-39.3	174.7	-69	164.5	0	0	0	112.3	G174 L175 L181 T182 F199 W225 P499 V503	G174-L178 WeakPolarHBondContact O-CG 3.27Å; G174-L178 PolarHBondContact O-N 3.12Å; L175-L178 PolarHBondContact O-N 3.28Å; L178-L181 PolarHBondContact O-N 3.09Å; L178-T182 WeakPolarHBondContact O-CB 3.23Å; L178-T182 PolarHBondContact O-N 2.99Å; L178-T182 PolarHBondContact O-OG1 3.11Å; L178-F199 HydrophobicContact CD1-CD2 3.85Å; L178-F199 HydrophobicContact CD1-CE2 3.71Å; L178-W225 HydrophobicContact CD1-CG 4.39Å; L178-W225 HydrophobicContact CD2-CB 4.12Å; L178-W225 HydrophobicContact CD2-CD2 3.77Å; L178-W225 HydrophobicContact CD2-CE3 4.02Å; L178-W225 HydrophobicContact CD2-CG 3.78Å; L178-W225 HydrophobicContact CG-CB 4.18Å; L178-W225 HydrophobicContact CG-CD2 4.39Å; L178-W225 HydrophobicContact CG-CG 3.93Å; L178-P499 HydrophobicContact CD1-CB 3.77Å; L178-P499 HydrophobicContact CD2-CB 3.92Å; L178-V503 HydrophobicContact CB-CG2 4.35Å; L178-V503 HydrophobicContact CD2-CG2 3.8Å
179	C	98.3	Very high	96.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.4	-46.5	173.4	-67.6	0	0	0	0	111	S58 L175 A176 L181 T182 Y183 S192	S58-C179 WeakPolarHBondContact OG-CB 3.32Å; L175-C179 PolarHBondContact O-N 3.04Å; L175-C179 PolarHBondContact O-SG 3.48Å; A176-C179 PolarHBondContact O-N 2.91Å; C179-L181 VanDerWaalsContact C-N 3.33Å; C179-L181 PolarHBondContact O-N 3.2Å; C179-T182 PolarHBondContact O-N 2.85Å; C179-Y183 PolarHBondContact O-N 3.1Å; C179-S192 PolarHBondContact O-OG 3.47Å
180	C	97.2	Very high	96.4	Very high	22 Å²	22	21 Å²	21	15%	0.149	13%	0.126	C	C	.	.	H	α-helix	trans	-60.8	-39	174.4	-72.8	0	0	0	0	112.7	S58 A176 M177 S184 L229	S58-C180 PolarHBondContact OG-N 3.16Å; S58-C180 PolarHBondContact OG-SG 3.49Å; A176-C180 PolarHBondContact O-N 3.03Å; A176-C180 PolarHBondContact O-SG 3.38Å; A176-C180 VanDerWaalsContact O-SG 3.34Å; M177-C180 PolarHBondContact O-N 2.97Å; C180-S184 VanDerWaalsContact O-CB 3.31Å; C180-S184 WeakPolarHBondContact O-CB 3.29Å; C180-S184 PolarHBondContact O-N 3.13Å; C180-L229 HydrophobicContact CB-CD2 3.97Å
181	L	97.2	Very high	96.4	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-62.8	-46.5	174	177.8	60.8	0	0	0	111.4	M177 L178 C179 S184 L185 N228 L229 C232 L476 V503	M177-L181 WeakPolarHBondContact O-CB 3.23Å; M177-L181 PolarHBondContact O-N 3.04Å; L178-L181 PolarHBondContact O-N 3.09Å; C179-L181 VanDerWaalsContact C-N 3.33Å; C179-L181 PolarHBondContact O-N 3.2Å; L181-S184 WeakPolarHBondContact O-CB 3.47Å; L181-S184 PolarHBondContact O-N 3.47Å; L181-L185 HydrophobicContact CD1-CD1 4.11Å; L181-L185 HydrophobicContact CD1-CG 4.39Å; L181-L185 HydrophobicContact CG-CD1 4.07Å; L181-L185 VanDerWaalsContact O-CG 3.31Å; L181-L185 WeakPolarHBondContact O-CG 3.43Å; L181-L185 PolarHBondContact O-N 3.48Å; L181-N228 HydrophobicContact CD2-CB 4.32Å; L181-L229 HydrophobicContact CB-CB 4.49Å; L181-L229 HydrophobicContact CB-CD1 4.5Å; L181-L229 HydrophobicContact CD1-CB 4.36Å; L181-L229 HydrophobicContact CD1-CD1 4.36Å; L181-C232 HydrophobicContact CD1-CB 4.19Å; L181-L476 HydrophobicContact CD1-CD1 4.17Å; L181-L476 HydrophobicContact CD2-CD1 4.4Å; L181-L476 HydrophobicContact CD2-CD2 4.46Å; L181-L476 HydrophobicContact CG-CD1 4.45Å; L181-V503 HydrophobicContact CD2-CG1 4.26Å; L181-V503 HydrophobicContact CD2-CG2 4.26Å; L181-V503 HydrophobicContact CG-CG1 4.14Å
182	T	97.5	Very high	96.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-44.6	178	-57	0	0	0	0	111.7	L178 C179 S184 L185 S186 A191 C195	L178-T182 WeakPolarHBondContact O-CB 3.23Å; L178-T182 PolarHBondContact O-N 2.99Å; L178-T182 PolarHBondContact O-OG1 3.11Å; C179-T182 PolarHBondContact O-N 2.85Å; T182-S184 VanDerWaalsContact C-N 3.35Å; T182-L185 PolarHBondContact O-N 2.87Å; T182-S186 WeakPolarHBondContact O-CB 3.4Å; T182-S186 PolarHBondContact O-N 3.14Å; T182-S186 PolarHBondContact O-OG 3.41Å; T182-A191 HydrophobicContact CG2-CB 4.01Å; T182-A191 WeakPolarHBondContact CG2-O 3.35Å; T182-C195 HydrophobicContact CG2-CB 4.11Å; T182-C195 PolarHBondContact OG1-SG 3.49Å
183	Y	96.1	Very high	96.4	Very high	28 Å²	28	21 Å²	21	11%	0.11	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-44	173.7	176.5	-105.4	0	0	0	111.4	I50 Y51 C54 C179 L185 G187 L189 S192	I50-Y183 HydrophobicContact CG2-CE2 3.79Å; I50-Y183 WeakPolarHBondContact CG2-OH 3.39Å; Y51-Y183 AromaticContact CD1-CE1 3.68Å; Y51-Y183 HydrophobicContact CD1-CE1 3.68Å; Y51-Y183 AromaticContact CE1-CE1 3.67Å; Y51-Y183 HydrophobicContact CE1-CE1 3.67Å; C54-Y183 HydrophobicContact CB-CD1 3.94Å; C54-Y183 HydrophobicContact CB-CD2 4.35Å; C54-Y183 HydrophobicContact CB-CE1 4.19Å; C54-Y183 HydrophobicContact CB-CG 4.02Å; C54-Y183 WeakPolarHBondContact SG-CB 3.38Å; C54-Y183 WeakPolarHBondContact SG-CD1 3.24Å; C179-Y183 PolarHBondContact O-N 3.1Å; Y183-L185 VanDerWaalsContact C-N 3.26Å; Y183-L185 PolarHBondContact O-N 2.91Å; Y183-G187 VanDerWaalsContact O-CA 3.29Å; Y183-G187 WeakPolarHBondContact O-CA 3.42Å; Y183-G187 PolarHBondContact O-N 2.99Å; Y183-L189 HydrophobicContact CD2-CD2 3.83Å; Y183-L189 HydrophobicContact CD2-CG 4.46Å; Y183-L189 HydrophobicContact CE2-CD2 3.91Å; Y183-L189 HydrophobicContact CE2-CG 4.35Å; Y183-S192 WeakPolarHBondContact CA-OG 3.48Å; Y183-S192 VanDerWaalsContact CB-OG 3.31Å; Y183-S192 WeakPolarHBondContact CB-OG 3.42Å; Y183-S192 PolarHBondContact N-OG 3.46Å
184	S	93.1	Very high	96.4	Very high	25 Å²	25	17.5 Å²	17.5	18%	0.175	11%	0.111	C	C	.	.	H	α-helix	trans	-56.3	-43.7	178	-177	0	0	0	0	110.7	C180 L181 T182 R236	C180-S184 VanDerWaalsContact O-CB 3.31Å; C180-S184 WeakPolarHBondContact O-CB 3.29Å; C180-S184 PolarHBondContact O-N 3.13Å; L181-S184 WeakPolarHBondContact O-CB 3.47Å; L181-S184 PolarHBondContact O-N 3.47Å; T182-S184 VanDerWaalsContact C-N 3.35Å; S184-R236 VanDerWaalsContact C-NH2 3.28Å; S184-R236 PolarHBondContact O-NH1 2.97Å; S184-R236 PolarHBondContact O-NH2 3.37Å
185	L	93.3	Very high	96.4	Very high	8 Å²	8	17.4 Å²	17.4	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-74.5	-48.1	-179.3	-64.8	161.6	0	0	0	113.9	L181 T182 Y183 R470 D472 L476 V503	L181-L185 HydrophobicContact CD1-CD1 4.11Å; L181-L185 HydrophobicContact CD1-CG 4.39Å; L181-L185 HydrophobicContact CG-CD1 4.07Å; L181-L185 VanDerWaalsContact O-CG 3.31Å; L181-L185 WeakPolarHBondContact O-CG 3.43Å; L181-L185 PolarHBondContact O-N 3.48Å; T182-L185 PolarHBondContact O-N 2.87Å; Y183-L185 VanDerWaalsContact C-N 3.26Å; Y183-L185 PolarHBondContact O-N 2.91Å; L185-R470 PolarHBondContact O-NH2 3.34Å; L185-D472 HydrophobicContact CD2-CB 4.13Å; L185-L476 HydrophobicContact CD1-CD1 3.21Å; L185-L476 HydrophobicContact CD2-CD1 3.8Å; L185-L476 HydrophobicContact CG-CD1 4.07Å; L185-V503 HydrophobicContact CD1-CG1 3.51Å
186	S	93.5	Very high	96.4	Very high	9 Å²	9	17.7 Å²	17.7	6%	0.063	11%	0.112	C	C	.	.	H	α-helix	trans	-90.9	-25.5	-170.8	65.1	0	0	0	0	114.1	T182 S188 A191	T182-S186 WeakPolarHBondContact O-CB 3.4Å; T182-S186 PolarHBondContact O-N 3.14Å; T182-S186 PolarHBondContact O-OG 3.41Å; S186-S188 PolarHBondContact O-N 3.33Å; S186-S188 PolarHBondContact OG-N 3.22Å; S186-S188 VanDerWaalsContact OG-N 3.16Å; S186-A191 WeakPolarHBondContact OG-CB 3.08Å
187	G	91	Very high	96.4	Very high	54 Å²	54	17.5 Å²	17.5	56%	0.557	11%	0.11	S	C	*	.			trans	68.8	12.4	-168.5	0	0	0	0	0	114.3	Y183	Y183-G187 VanDerWaalsContact O-CA 3.29Å; Y183-G187 WeakPolarHBondContact O-CA 3.42Å; Y183-G187 PolarHBondContact O-N 2.99Å
188	S	93.8	Very high	96.4	Very high	23 Å²	23	16.1 Å²	16.1	16%	0.161	10%	0.103	C	C	.	.			trans	-116.1	124.3	-175	177.6	0	0	0	0	112	S186 L190 A191 S192	S186-S188 PolarHBondContact O-N 3.33Å; S186-S188 PolarHBondContact OG-N 3.22Å; S186-S188 VanDerWaalsContact OG-N 3.16Å; S188-L190 VanDerWaalsContact C-N 3.34Å; S188-L190 PolarHBondContact OG-N 2.99Å; S188-A191 PolarHBondContact O-N 3.49Å; S188-A191 PolarHBondContact OG-N 3.38Å; S188-S192 PolarHBondContact O-N 3.02Å; S188-S192 PolarHBondContact O-OG 2.95Å
189	L	95.2	Very high	96.3	Very high	47 Å²	47	16.3 Å²	16.3	25%	0.246	10%	0.104	C	C	.	.	H	α-helix	trans	-65.5	-39.1	172.5	-64.5	177.7	0	0	0	111.2	I50 C53 C54 I57 Y183 A191 S192 L193	I50-L189 HydrophobicContact CG2-CD1 4.26Å; I50-L189 HydrophobicContact CG2-CD2 4.27Å; I50-L189 HydrophobicContact CG2-CG 4.29Å; C53-L189 HydrophobicContact CB-CD1 3.99Å; C54-L189 VanDerWaalsContact CA-CD2 3.5Å; C54-L189 HydrophobicContact CB-CD2 3.59Å; I57-L189 HydrophobicContact CD1-CB 4.12Å; I57-L189 HydrophobicContact CD1-CD1 4.23Å; I57-L189 HydrophobicContact CD1-CD2 4.3Å; I57-L189 HydrophobicContact CD1-CG 4.46Å; Y183-L189 HydrophobicContact CD2-CD2 3.83Å; Y183-L189 HydrophobicContact CD2-CG 4.46Å; Y183-L189 HydrophobicContact CE2-CD2 3.91Å; Y183-L189 HydrophobicContact CE2-CG 4.35Å; L189-A191 VanDerWaalsContact C-N 3.31Å; L189-A191 PolarHBondContact O-N 2.88Å; L189-S192 WeakPolarHBondContact O-CB 3.38Å; L189-S192 PolarHBondContact O-N 3.43Å; L189-L193 PolarHBondContact O-N 2.95Å; L189-L193 VanDerWaalsContact O-N 3.08Å
190	L	96.8	Very high	96.2	Very high	44 Å²	44	16.9 Å²	16.9	23%	0.23	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-36	176.9	-68.7	176.3	0	0	0	111.8	S188 S192 L193 L194 A535 L538 L539 I542	S188-L190 VanDerWaalsContact C-N 3.34Å; S188-L190 PolarHBondContact OG-N 2.99Å; L190-S192 VanDerWaalsContact C-N 3.25Å; L190-S192 PolarHBondContact O-N 3.42Å; L190-L193 HydrophobicContact CD2-CD1 4.38Å; L190-L193 PolarHBondContact O-N 3.2Å; L190-L194 WeakPolarHBondContact O-CB 3.35Å; L190-L194 PolarHBondContact O-N 3.49Å; L190-A535 HydrophobicContact CD1-CB 4.02Å; L190-L538 HydrophobicContact CB-CB 3.89Å; L190-L538 HydrophobicContact CB-CD1 3.7Å; L190-L538 HydrophobicContact CB-CG 4.35Å; L190-L538 HydrophobicContact CD1-CB 4.33Å; L190-L538 HydrophobicContact CD1-CD1 4.49Å; L190-L539 HydrophobicContact CD1-CG 4.23Å; L190-L539 HydrophobicContact CD2-CD2 3.79Å; L190-L539 HydrophobicContact CD2-CG 4.35Å; L190-I542 HydrophobicContact CB-CD1 4.45Å; L190-I542 HydrophobicContact CD2-CD1 4.26Å; L190-I542 WeakPolarHBondContact O-CD1 3.38Å
191	A	97.3	Very high	96.1	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.1	-32.7	174	0	0	0	0	0	112	T182 S186 S188 L189 L194 C195 S506 L538	T182-A191 HydrophobicContact CG2-CB 4.01Å; T182-A191 WeakPolarHBondContact CG2-O 3.35Å; S186-A191 WeakPolarHBondContact OG-CB 3.08Å; S188-A191 PolarHBondContact O-N 3.49Å; S188-A191 PolarHBondContact OG-N 3.38Å; L189-A191 VanDerWaalsContact C-N 3.31Å; L189-A191 PolarHBondContact O-N 2.88Å; A191-L194 PolarHBondContact O-N 2.85Å; A191-C195 PolarHBondContact O-N 3.35Å; A191-S506 VanDerWaalsContact O-CB 3.3Å; A191-S506 WeakPolarHBondContact O-CB 3.47Å; A191-L538 HydrophobicContact CB-CD2 4.27Å
192	S	97.4	Very high	96	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.007	11%	0.106	C	C	.	.	H	α-helix	trans	-69.5	-40.3	176.1	-50.5	0	0	0	0	111.5	C179 Y183 S188 L189 L190 C195 S196	C179-S192 PolarHBondContact O-OG 3.47Å; Y183-S192 WeakPolarHBondContact CA-OG 3.48Å; Y183-S192 VanDerWaalsContact CB-OG 3.31Å; Y183-S192 WeakPolarHBondContact CB-OG 3.42Å; Y183-S192 PolarHBondContact N-OG 3.46Å; S188-S192 PolarHBondContact O-N 3.02Å; S188-S192 PolarHBondContact O-OG 2.95Å; L189-S192 WeakPolarHBondContact O-CB 3.38Å; L189-S192 PolarHBondContact O-N 3.43Å; L190-S192 VanDerWaalsContact C-N 3.25Å; L190-S192 PolarHBondContact O-N 3.42Å; S192-C195 WeakPolarHBondContact O-CB 3.3Å; S192-C195 PolarHBondContact O-N 3.37Å; S192-S196 PolarHBondContact O-N 2.89Å
193	L	97.7	Very high	95.8	Very high	61 Å²	61	17.9 Å²	17.9	32%	0.319	11%	0.11	S	C	.	.	H	α-helix	trans	-63.3	-40.2	171.3	-73.5	171.7	0	0	0	112.2	I57 L189 L190 C195 S196 S197 I542	I57-L193 HydrophobicContact CG2-CD2 3.49Å; I57-L193 VanDerWaalsContact CG2-CD2 3.49Å; I57-L193 HydrophobicContact CG2-CG 3.79Å; L189-L193 PolarHBondContact O-N 2.95Å; L189-L193 VanDerWaalsContact O-N 3.08Å; L190-L193 HydrophobicContact CD2-CD1 4.38Å; L190-L193 PolarHBondContact O-N 3.2Å; L193-C195 VanDerWaalsContact C-N 3.34Å; L193-S196 CarbonylContact O-C 3.58Å; L193-S196 WeakPolarHBondContact O-CA 3.41Å; L193-S196 WeakPolarHBondContact O-CB 3.32Å; L193-S196 PolarHBondContact O-N 3.29Å; L193-S196 VanDerWaalsContact O-N 3.14Å; L193-S197 PolarHBondContact O-N 2.9Å; L193-I542 HydrophobicContact CB-CD1 3.89Å
194	L	98.2	Very high	95.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-40.1	174.8	-179.1	60.5	0	0	0	111.8	L190 A191 S196 S197 F198 L509 L538 A541 I542	L190-L194 WeakPolarHBondContact O-CB 3.35Å; L190-L194 PolarHBondContact O-N 3.49Å; A191-L194 PolarHBondContact O-N 2.85Å; L194-S196 VanDerWaalsContact C-N 3.25Å; L194-S196 PolarHBondContact O-N 3.48Å; L194-S197 WeakPolarHBondContact CA-OG 3.41Å; L194-S197 PolarHBondContact O-N 3.36Å; L194-S197 PolarHBondContact O-OG 3.34Å; L194-F198 HydrophobicContact CD1-CD1 4.48Å; L194-F198 HydrophobicContact CD1-CD2 4.08Å; L194-F198 HydrophobicContact CD1-CE1 4.1Å; L194-F198 HydrophobicContact CD1-CE2 3.67Å; L194-F198 HydrophobicContact CD1-CG 4.46Å; L194-F198 HydrophobicContact CD1-CZ 3.66Å; L194-F198 HydrophobicContact CD2-CE2 3.76Å; L194-F198 HydrophobicContact CD2-CZ 4.15Å; L194-F198 HydrophobicContact CG-CD2 3.84Å; L194-F198 HydrophobicContact CG-CE2 3.45Å; L194-F198 VanDerWaalsContact CG-CE2 3.45Å; L194-F198 HydrophobicContact CG-CZ 3.96Å; L194-F198 WeakPolarHBondContact O-CD2 3.25Å; L194-F198 WeakPolarHBondContact O-CG 3.41Å; L194-F198 PolarHBondContact O-N 2.86Å; L194-L509 HydrophobicContact CD2-CD1 3.83Å; L194-L538 HydrophobicContact CB-CD2 4.33Å; L194-L538 HydrophobicContact CD2-CD2 3.6Å; L194-A541 HydrophobicContact CD1-CB 3.73Å; L194-A541 HydrophobicContact CD2-CB 4.11Å; L194-I542 HydrophobicContact CB-CD1 4.37Å; L194-I542 HydrophobicContact CB-CG1 3.82Å; L194-I542 HydrophobicContact CD1-CG1 4.06Å
195	C	98.3	Very high	95.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.6	-41.3	172.8	-179.8	0	0	0	0	110.6	T182 A191 S192 L193 F199 S506	T182-C195 HydrophobicContact CG2-CB 4.11Å; T182-C195 PolarHBondContact OG1-SG 3.49Å; A191-C195 PolarHBondContact O-N 3.35Å; S192-C195 WeakPolarHBondContact O-CB 3.3Å; S192-C195 PolarHBondContact O-N 3.37Å; L193-C195 VanDerWaalsContact C-N 3.34Å; C195-F199 WeakPolarHBondContact O-CB 3.3Å; C195-F199 PolarHBondContact O-N 2.94Å; C195-S506 WeakPolarHBondContact CA-OG 3.43Å; C195-S506 PolarHBondContact N-OG 3.49Å
196	S	98	Very high	95.6	Very high	7 Å²	7	22.5 Å²	22.5	5%	0.049	13%	0.131	C	C	.	.	H	α-helix	trans	-64.1	-44.8	175.1	-171	0	0	0	0	112.4	S61 S192 L193 L194 F199 L200	S61-S196 VanDerWaalsContact CB-OG 3.28Å; S61-S196 WeakPolarHBondContact CB-OG 3.4Å; S61-S196 WeakPolarHBondContact OG-CB 3.49Å; S61-S196 PolarHBondContact OG-OG 3.03Å; S192-S196 PolarHBondContact O-N 2.89Å; L193-S196 CarbonylContact O-C 3.58Å; L193-S196 WeakPolarHBondContact O-CA 3.41Å; L193-S196 WeakPolarHBondContact O-CB 3.32Å; L193-S196 PolarHBondContact O-N 3.29Å; L193-S196 VanDerWaalsContact O-N 3.14Å; L194-S196 VanDerWaalsContact C-N 3.25Å; L194-S196 PolarHBondContact O-N 3.48Å; S196-F199 PolarHBondContact O-N 3.36Å; S196-L200 VanDerWaalsContact O-CG 3.28Å; S196-L200 WeakPolarHBondContact O-CG 3.46Å; S196-L200 PolarHBondContact O-N 3.09Å
197	S	97.5	Very high	95.7	Very high	4 Å²	4	23.1 Å²	23.1	3%	0.028	13%	0.134	C	C	.	.	H	α-helix	trans	-66.5	-39.8	179.1	62	0	0	0	0	111.9	L193 L194 F199 L200 N201	L193-S197 PolarHBondContact O-N 2.9Å; L194-S197 WeakPolarHBondContact CA-OG 3.41Å; L194-S197 PolarHBondContact O-N 3.36Å; L194-S197 PolarHBondContact O-OG 3.34Å; S197-F199 VanDerWaalsContact C-N 3.34Å; S197-F199 PolarHBondContact O-N 3.3Å; S197-L200 PolarHBondContact O-N 2.87Å; S197-N201 VanDerWaalsContact O-CB 3.27Å; S197-N201 WeakPolarHBondContact O-CB 3.48Å; S197-N201 PolarHBondContact O-N 3.22Å
198	F	98	Very high	95.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-41.4	173.1	-74.6	-40.2	0	0	0	112.3	L194 H202 S421 L423 L426 C502 A505 N545	L194-F198 HydrophobicContact CD1-CD1 4.48Å; L194-F198 HydrophobicContact CD1-CD2 4.08Å; L194-F198 HydrophobicContact CD1-CE1 4.1Å; L194-F198 HydrophobicContact CD1-CE2 3.67Å; L194-F198 HydrophobicContact CD1-CG 4.46Å; L194-F198 HydrophobicContact CD1-CZ 3.66Å; L194-F198 HydrophobicContact CD2-CE2 3.76Å; L194-F198 HydrophobicContact CD2-CZ 4.15Å; L194-F198 HydrophobicContact CG-CD2 3.84Å; L194-F198 HydrophobicContact CG-CE2 3.45Å; L194-F198 VanDerWaalsContact CG-CE2 3.45Å; L194-F198 HydrophobicContact CG-CZ 3.96Å; L194-F198 WeakPolarHBondContact O-CD2 3.25Å; L194-F198 WeakPolarHBondContact O-CG 3.41Å; L194-F198 PolarHBondContact O-N 2.86Å; F198-H202 PolarHBondContact O-CD2 3.13Å; F198-H202 PolarHBondContact O-N 3.33Å; F198-S421 WeakPolarHBondContact CE1-O 3.35Å; F198-L423 HydrophobicContact CB-CD1 4.05Å; F198-L423 HydrophobicContact CD1-CB 4.01Å; F198-L423 HydrophobicContact CD1-CD1 4.07Å; F198-L423 HydrophobicContact CD2-CD1 3.67Å; F198-L423 HydrophobicContact CE1-CB 4.08Å; F198-L423 HydrophobicContact CE1-CD1 4.42Å; F198-L423 HydrophobicContact CE2-CD1 4.04Å; F198-L423 HydrophobicContact CG-CB 4.49Å; F198-L423 HydrophobicContact CG-CD1 3.7Å; F198-L423 HydrophobicContact CZ-CD1 4.42Å; F198-L426 HydrophobicContact CE2-CD1 4.47Å; F198-L426 HydrophobicContact CZ-CD1 3.87Å; F198-C502 HydrophobicContact CB-CB 4.14Å; F198-A505 HydrophobicContact CD2-CB 4.47Å; F198-A505 HydrophobicContact CE2-CB 4.02Å; F198-N545 VanDerWaalsContact CD1-OD1 3.27Å; F198-N545 WeakPolarHBondContact CD1-OD1 3.4Å; F198-N545 VanDerWaalsContact CE1-ND2 3.31Å; F198-N545 WeakPolarHBondContact CE1-ND2 3.46Å; F198-N545 WeakPolarHBondContact CE1-OD1 3.28Å
199	F	97.4	Very high	95.5	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.026	11%	0.107	C	C	.	.	H	α-helix	trans	-63.5	-46.3	177.9	-172.9	-78.6	0	0	0	111.7	L65 L175 L178 C195 S196 S197 H202 L203 A206 T207 P499	L65-F199 HydrophobicContact CD2-CE1 3.71Å; L65-F199 HydrophobicContact CD2-CZ 4.36Å; L175-F199 HydrophobicContact CD1-CB 3.83Å; L175-F199 HydrophobicContact CD1-CD1 3.91Å; L175-F199 HydrophobicContact CD1-CD2 4.08Å; L175-F199 HydrophobicContact CD1-CG 3.68Å; L175-F199 HydrophobicContact CD2-CD1 4.22Å; L178-F199 HydrophobicContact CD1-CD2 3.85Å; L178-F199 HydrophobicContact CD1-CE2 3.71Å; C195-F199 WeakPolarHBondContact O-CB 3.3Å; C195-F199 PolarHBondContact O-N 2.94Å; S196-F199 PolarHBondContact O-N 3.36Å; S197-F199 VanDerWaalsContact C-N 3.34Å; S197-F199 PolarHBondContact O-N 3.3Å; F199-H202 CarbonylContact O-C 3.58Å; F199-H202 PolarHBondContact O-N 2.9Å; F199-L203 HydrophobicContact CD1-CD1 4.13Å; F199-L203 HydrophobicContact CE1-CD1 3.71Å; F199-L203 PolarHBondContact O-N 2.84Å; F199-A206 HydrophobicContact CD1-CB 4.23Å; F199-A206 HydrophobicContact CD2-CB 3.7Å; F199-A206 HydrophobicContact CE1-CB 4.13Å; F199-A206 HydrophobicContact CE2-CB 3.6Å; F199-A206 HydrophobicContact CG-CB 4.02Å; F199-A206 HydrophobicContact CZ-CB 3.83Å; F199-T207 HydrophobicContact CE1-CG2 3.8Å; F199-T207 HydrophobicContact CZ-CG2 3.73Å; F199-P499 HydrophobicContact CE2-CG 4.21Å
200	L	95.5	Very high	94.8	Very high	11 Å²	11	19.8 Å²	19.8	6%	0.058	10%	0.102	C	C	.	.	H	α-helix	trans	-67.1	-43.1	-179.5	-68.3	169	0	0	0	112	F64 L65 L175 S196 S197 H202 L203 F549	F64-L200 HydrophobicContact CD1-CD1 3.65Å; F64-L200 HydrophobicContact CD1-CD2 3.91Å; F64-L200 HydrophobicContact CD1-CG 4.45Å; F64-L200 HydrophobicContact CE1-CD1 3.73Å; F64-L200 HydrophobicContact CE1-CD2 4Å; F64-L200 HydrophobicContact CE1-CG 4.46Å; L65-L200 HydrophobicContact CB-CD2 4.46Å; L65-L200 HydrophobicContact CD1-CD2 4.32Å; L175-L200 HydrophobicContact CD2-CD2 4.49Å; S196-L200 VanDerWaalsContact O-CG 3.28Å; S196-L200 WeakPolarHBondContact O-CG 3.46Å; S196-L200 PolarHBondContact O-N 3.09Å; S197-L200 PolarHBondContact O-N 2.87Å; L200-H202 PolarHBondContact O-N 2.86Å; L200-H202 VanDerWaalsContact O-N 3.1Å; L200-L203 PolarHBondContact O-N 3.14Å; L200-F549 HydrophobicContact CB-CD2 4.39Å; L200-F549 HydrophobicContact CB-CE1 4.4Å; L200-F549 HydrophobicContact CB-CE2 4.24Å; L200-F549 HydrophobicContact CB-CZ 4.24Å; L200-F549 WeakPolarHBondContact O-CD2 3.49Å; L200-F549 WeakPolarHBondContact O-CE2 3.28Å
201	N	94.9	Very high	94	Very high	24 Å²	24	20 Å²	20	13%	0.128	12%	0.115	C	C	.	.	H	α-helix	trans	-62.2	-18.3	177.9	-169.5	77.4	0	0	0	113.6	S197 N545 L548 F549	S197-N201 VanDerWaalsContact O-CB 3.27Å; S197-N201 WeakPolarHBondContact O-CB 3.48Å; S197-N201 PolarHBondContact O-N 3.22Å; N201-N545 PolarHBondContact OD1-O 3.37Å; N201-L548 VanDerWaalsContact OD1-CB 3.31Å; N201-L548 WeakPolarHBondContact OD1-CB 3.43Å; N201-F549 HydrophobicContact CB-CB 4.27Å; N201-F549 PolarHBondContact OD1-N 3.32Å
202	H	95.2	Very high	93.3	Very high	8 Å²	8	25 Å²	25	4%	0.037	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.1	37.4	-178	-66.4	-69.6	0	0	0	111.9	F198 F199 L200 M204 Y205 A206 D417 S421 M498	F198-H202 PolarHBondContact O-CD2 3.13Å; F198-H202 PolarHBondContact O-N 3.33Å; F199-H202 CarbonylContact O-C 3.58Å; F199-H202 PolarHBondContact O-N 2.9Å; L200-H202 PolarHBondContact O-N 2.86Å; L200-H202 VanDerWaalsContact O-N 3.1Å; H202-M204 PolarHBondContact O-N 3.47Å; H202-M204 VanDerWaalsContact O-N 3.16Å; H202-Y205 HydrophobicContact CB-CD2 4.25Å; H202-Y205 PolarHBondContact O-N 2.87Å; H202-A206 WeakPolarHBondContact O-CB 3.5Å; H202-A206 PolarHBondContact O-N 3.09Å; H202-D417 PolarHBondContact CE1-O 2.81Å; H202-S421 WeakPolarHBondContact NE2-CB 3.21Å; H202-S421 PolarHBondContact NE2-OG 2.66Å; H202-M498 HydrophobicContact CB-CE 3.14Å
203	L	93.7	Very high	92.6	Very high	16 Å²	16	25.1 Å²	25.1	8%	0.084	14%	0.137	C	C	.	.	H	α-helix	trans	-54.7	-40.1	-171.8	-167.8	71	0	0	0	112.5	L65 Y68 F199 L200 Y205 A206 T207 A210	L65-L203 HydrophobicContact CD1-CD1 3.48Å; L65-L203 VanDerWaalsContact CD1-CD1 3.48Å; L65-L203 HydrophobicContact CD1-CD2 4.35Å; Y68-L203 HydrophobicContact CD1-CD2 3.59Å; Y68-L203 HydrophobicContact CE1-CD2 3.23Å; F199-L203 HydrophobicContact CD1-CD1 4.13Å; F199-L203 HydrophobicContact CE1-CD1 3.71Å; F199-L203 PolarHBondContact O-N 2.84Å; L200-L203 PolarHBondContact O-N 3.14Å; L203-Y205 PolarHBondContact O-N 2.96Å; L203-Y205 VanDerWaalsContact O-N 3.16Å; L203-A206 PolarHBondContact O-N 3.46Å; L203-A206 VanDerWaalsContact O-N 3.12Å; L203-T207 HydrophobicContact CD1-CG2 3.46Å; L203-T207 VanDerWaalsContact CD1-CG2 3.46Å; L203-T207 HydrophobicContact CG-CG2 4.09Å; L203-T207 PolarHBondContact O-N 3.04Å; L203-A210 HydrophobicContact CD2-CB 3.88Å
204	M	90.4	Very high	92.3	Very high	124 Å²	124	22.2 Å²	22.2	61%	0.611	12%	0.122	S	C	*	.	H	α-helix	trans	-57.2	-26.3	177.7	66.1	-172.5	-75.7	0	0	114.5	H202 Y495	H202-M204 PolarHBondContact O-N 3.47Å; H202-M204 VanDerWaalsContact O-N 3.16Å; M204-Y495 VanDerWaalsContact O-CE1 3.29Å; M204-Y495 WeakPolarHBondContact O-CE1 3.36Å
205	Y	93.9	Very high	92	Very high	30 Å²	30	22.4 Å²	22.4	12%	0.118	12%	0.123	C	C	.	.	H	α-helix	trans	-101.8	-23.8	178.1	-57.4	-54.3	0	0	0	112.4	H202 L203 F414 D417 V494 Y495 M498	H202-Y205 HydrophobicContact CB-CD2 4.25Å; H202-Y205 PolarHBondContact O-N 2.87Å; L203-Y205 PolarHBondContact O-N 2.96Å; L203-Y205 VanDerWaalsContact O-N 3.16Å; Y205-F414 AromaticContact CD1-CD2 3.88Å; Y205-F414 HydrophobicContact CD1-CD2 3.88Å; Y205-F414 HydrophobicContact CD1-CE2 4.37Å; Y205-F414 HydrophobicContact CD2-CD2 4.05Å; Y205-F414 HydrophobicContact CD2-CE2 4.28Å; Y205-F414 HydrophobicContact CE1-CD2 4.04Å; Y205-F414 HydrophobicContact CE2-CD2 4.22Å; Y205-F414 AromaticContact CG-CD2 3.89Å; Y205-F414 HydrophobicContact CG-CD2 3.89Å; Y205-F414 HydrophobicContact CG-CE2 4.03Å; Y205-D417 HydrophobicContact CE2-CB 4.44Å; Y205-D417 PolarHBondContact OH-OD2 3.26Å; Y205-V494 HydrophobicContact CD1-CG2 4.29Å; Y205-V494 HydrophobicContact CG-CG2 4.42Å; Y205-V494 CarbonylContact O-C 3.54Å; Y205-Y495 WeakPolarHBondContact O-CA 3.48Å; Y205-Y495 VanDerWaalsContact O-CD1 3.28Å; Y205-Y495 WeakPolarHBondContact O-CD1 3.35Å; Y205-M498 WeakPolarHBondContact O-CB 3.29Å
206	A	94.4	Very high	91.7	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.033	12%	0.124	C	C	.	.	H	α-helix	trans	-88.5	-32.5	-173.6	0	0	0	0	0	113.4	F199 H202 L203 M498	F199-A206 HydrophobicContact CD1-CB 4.23Å; F199-A206 HydrophobicContact CD2-CB 3.7Å; F199-A206 HydrophobicContact CE1-CB 4.13Å; F199-A206 HydrophobicContact CE2-CB 3.6Å; F199-A206 HydrophobicContact CG-CB 4.02Å; F199-A206 HydrophobicContact CZ-CB 3.83Å; H202-A206 WeakPolarHBondContact O-CB 3.5Å; H202-A206 PolarHBondContact O-N 3.09Å; L203-A206 PolarHBondContact O-N 3.46Å; L203-A206 VanDerWaalsContact O-N 3.12Å; A206-M498 HydrophobicContact CB-CG 4.12Å
207	T	94.4	Very high	91.4	Very high	21 Å²	21	22.7 Å²	22.7	13%	0.129	12%	0.124	C	C	.	.			trans	-156.9	155.2	178.6	-178.8	0	0	0	0	111.9	F199 L203 V209	F199-T207 HydrophobicContact CE1-CG2 3.8Å; F199-T207 HydrophobicContact CZ-CG2 3.73Å; L203-T207 HydrophobicContact CD1-CG2 3.46Å; L203-T207 VanDerWaalsContact CD1-CG2 3.46Å; L203-T207 HydrophobicContact CG-CG2 4.09Å; L203-T207 PolarHBondContact O-N 3.04Å; T207-V209 HydrophobicContact CG2-CB 4.46Å; T207-V209 HydrophobicContact CG2-CG1 3.84Å; T207-V209 PolarHBondContact OG1-N 3.32Å
208	R	91.3	Very high	91.3	Very high	38 Å²	38	22.8 Å²	22.8	14%	0.143	12%	0.124	C	C	.	.	S	Bend	trans	-95.2	-0.1	174.3	-62.6	-173.9	71.9	-171.5	2.3	113.2	A210 G211 F212 E217 R492 Y495	R208-A210 VanDerWaalsContact C-N 3.26Å; R208-A210 PolarHBondContact O-N 2.91Å; R208-G211 PolarHBondContact O-N 3.42Å; R208-F212 HydrophobicContact CB-CB 4.39Å; R208-F212 CarbonylContact O-C 3.55Å; R208-F212 VanDerWaalsContact O-C 3.32Å; R208-F212 WeakPolarHBondContact O-CA 3.19Å; R208-F212 PolarHBondContact O-N 3.16Å; R208-E217 IonicContact CZ-OE1 3.83Å; R208-E217 IonicContact NH1-OE1 2.76Å; R208-E217 PolarHBondContact NH1-OE1 3.45Å; R208-R492 VanDerWaalsContact NH1-NH2 3.12Å; R208-Y495 VanDerWaalsContact CD-CE2 3.5Å; R208-Y495 HydrophobicContact CG-CD1 3.95Å; R208-Y495 HydrophobicContact CG-CD2 3.99Å; R208-Y495 HydrophobicContact CG-CE1 3.48Å; R208-Y495 VanDerWaalsContact CG-CE1 3.48Å; R208-Y495 HydrophobicContact CG-CE2 3.55Å; R208-Y495 HydrophobicContact CG-CG 4.19Å
209	V	91.1	Very high	91.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-35.2	-168.2	83.3	0	0	0	0	113.2	A69 S167 F168 T207 G213	A69-V209 HydrophobicContact CB-CG1 4.24Å; S167-V209 VanDerWaalsContact O-CG2 3.23Å; S167-V209 WeakPolarHBondContact O-CG2 3.4Å; F168-V209 HydrophobicContact CD1-CG2 3.99Å; F168-V209 WeakPolarHBondContact CE1-O 3.5Å; T207-V209 HydrophobicContact CG2-CB 4.46Å; T207-V209 HydrophobicContact CG2-CG1 3.84Å; T207-V209 PolarHBondContact OG1-N 3.32Å; V209-G213 PolarHBondContact O-N 3.31Å
210	A	80.4	Confident	91.1	Very high	17 Å²	17	22.5 Å²	22.5	14%	0.14	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-43.4	-178.7	0	0	0	0	0	113.3	L203 R208	L203-A210 HydrophobicContact CD2-CB 3.88Å; R208-A210 VanDerWaalsContact C-N 3.26Å; R208-A210 PolarHBondContact O-N 2.91Å
211	G	79.9	Confident	91.2	Very high	48 Å²	48	22.7 Å²	22.7	50%	0.495	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-31.4	-177.4	0	0	0	0	0	114.8	R208	R208-G211 PolarHBondContact O-N 3.42Å
212	F	82.8	Confident	91.3	Very high	106 Å²	106	22 Å²	22	47%	0.465	12%	0.12	S	C	.	.	S	Bend	trans	-136.7	62.5	-174.8	-57.5	-88.4	0	0	0	110.2	R208 L215 N218	R208-F212 HydrophobicContact CB-CB 4.39Å; R208-F212 CarbonylContact O-C 3.55Å; R208-F212 VanDerWaalsContact O-C 3.32Å; R208-F212 WeakPolarHBondContact O-CA 3.19Å; R208-F212 PolarHBondContact O-N 3.16Å; F212-L215 HydrophobicContact CB-CD1 3.63Å; F212-L215 HydrophobicContact CB-CG 4.32Å; F212-N218 PolarHBondContact O-ND2 2.87Å
213	G	81.9	Confident	91.4	Very high	2 Å²	2	21.9 Å²	21.9	2%	0.021	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	161.3	171.5	0	0	0	0	0	112.6	R95 V209 L215	R95-G213 WeakPolarHBondContact CD-O 3.48Å; R95-G213 WeakPolarHBondContact CG-O 3.46Å; R95-G213 PolarHBondContact NE-O 3.04Å; V209-G213 PolarHBondContact O-N 3.31Å; G213-L215 PolarHBondContact O-N 3.26Å; G213-L215 VanDerWaalsContact O-N 3.14Å
214	N	90.5	Very high	91.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	8.1	175.5	-43.5	98	0	0	0	116.8	Y163 S167	Y163-N214 HydrophobicContact CD1-CB 4.28Å; Y163-N214 WeakPolarHBondContact CD1-ND2 3.49Å; Y163-N214 HydrophobicContact CE1-CB 3.48Å; Y163-N214 VanDerWaalsContact CE1-CB 3.48Å; Y163-N214 VanDerWaalsContact CE1-CG 3.42Å; Y163-N214 WeakPolarHBondContact CE1-ND2 3.26Å; Y163-N214 PolarHBondContact O-ND2 3.18Å; S167-N214 PolarHBondContact OG-N 3.49Å
215	L	92.2	Very high	91.9	Very high	5 Å²	5	15.9 Å²	15.9	3%	0.026	9%	0.09	C	C	.	.			trans	-73.9	147.3	164.7	-67.2	176.1	0	0	0	110.8	E94 R95 Y98 F212 G213 E217 N218 Y219	E94-L215 HydrophobicContact CB-CD2 4.18Å; R95-L215 HydrophobicContact CG-CD2 3.74Å; R95-L215 HydrophobicContact CG-CG 4.04Å; Y98-L215 HydrophobicContact CE2-CD2 4.49Å; F212-L215 HydrophobicContact CB-CD1 3.63Å; F212-L215 HydrophobicContact CB-CG 4.32Å; G213-L215 PolarHBondContact O-N 3.26Å; G213-L215 VanDerWaalsContact O-N 3.14Å; L215-E217 VanDerWaalsContact C-N 3.3Å; L215-E217 HydrophobicContact CB-CG 4.28Å; L215-E217 PolarHBondContact O-N 3.35Å; L215-N218 WeakPolarHBondContact O-CB 3.41Å; L215-N218 PolarHBondContact O-N 3.17Å; L215-Y219 WeakPolarHBondContact O-CD2 3.32Å
216	R	92.8	Very high	92.1	Very high	3 Å²	3	16.3 Å²	16.3	1%	0.011	9%	0.093	C	C	.	.	H	α-helix	trans	-59.2	-37.7	-176.4	-69.4	-170.1	-73.1	166.4	2.5	113.2	Y98 F136 N218 Y219 A220 F262 Q264 H608	Y98-R216 HydrophobicContact CD2-CG 4.27Å; Y98-R216 HydrophobicContact CE1-CG 4.48Å; Y98-R216 HydrophobicContact CE2-CG 3.85Å; Y98-R216 VanDerWaalsContact CZ-NE 3.32Å; Y98-R216 VanDerWaalsContact OH-CZ 3.3Å; Y98-R216 PolarHBondContact OH-NE 2.92Å; Y98-R216 PolarHBondContact OH-NH2 3.15Å; F136-R216 PolarHBondContact O-NH1 3.44Å; R216-N218 PolarHBondContact O-N 2.66Å; R216-Y219 PolarHBondContact O-N 3.35Å; R216-A220 PolarHBondContact O-N 2.97Å; R216-F262 WeakPolarHBondContact CB-O 3.41Å; R216-Q264 VanDerWaalsContact NH2-CD 3.31Å; R216-H608 VanDerWaalsContact CZ-NE2 3.29Å; R216-H608 PolarHBondContact NH1-NE2 3.09Å; R216-H608 VanDerWaalsContact NH1-NE2 3.11Å; R216-H608 PolarHBondContact NH2-CD2 2.87Å; R216-H608 PolarHBondContact NH2-NE2 2.98Å
217	E	91.5	Very high	92.2	Very high	10 Å²	10	16.1 Å²	16.1	5%	0.047	9%	0.092	C	C	.	.	H	α-helix	trans	-59.5	-29.3	175.5	59	-98.1	-138.8	0	0	113.2	R208 L215 Y219 A220 L221 W263 R492	R208-E217 IonicContact CZ-OE1 3.83Å; R208-E217 IonicContact NH1-OE1 2.76Å; R208-E217 PolarHBondContact NH1-OE1 3.45Å; L215-E217 VanDerWaalsContact C-N 3.3Å; L215-E217 HydrophobicContact CB-CG 4.28Å; L215-E217 PolarHBondContact O-N 3.35Å; E217-Y219 VanDerWaalsContact C-N 3.25Å; E217-Y219 PolarHBondContact O-N 3.35Å; E217-A220 PolarHBondContact O-N 3.01Å; E217-L221 HydrophobicContact CB-CD1 4.25Å; E217-L221 HydrophobicContact CB-CG 4.41Å; E217-L221 WeakPolarHBondContact O-CB 3.46Å; E217-L221 WeakPolarHBondContact O-CG 3.31Å; E217-L221 PolarHBondContact O-N 3.27Å; E217-W263 HydrophobicContact CB-CZ2 4.11Å; E217-R492 IonicContact OE1-NH2 3.2Å; E217-R492 PolarHBondContact OE1-NH2 3.33Å
218	N	94.5	Very high	92.4	Very high	6 Å²	6	15.2 Å²	15.2	3%	0.032	9%	0.086	C	C	.	.	H	α-helix	trans	-72.4	-19.3	178.9	-63.5	-27.2	0	0	0	112.6	F212 L215 R216 P222	F212-N218 PolarHBondContact O-ND2 2.87Å; L215-N218 WeakPolarHBondContact O-CB 3.41Å; L215-N218 PolarHBondContact O-N 3.17Å; R216-N218 PolarHBondContact O-N 2.66Å; N218-P222 VanDerWaalsContact O-CD 3.25Å; N218-P222 WeakPolarHBondContact O-CD 3.2Å; N218-P222 WeakPolarHBondContact O-CG 3.28Å
219	Y	96.1	Very high	92.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-91	-40	170.8	-61.5	-83.5	0	0	0	111.4	Q140 L144 F170 L215 R216 E217 V223	Q140-Y219 HydrophobicContact CB-CD1 4.33Å; Q140-Y219 HydrophobicContact CB-CD2 4.48Å; Q140-Y219 HydrophobicContact CB-CG 4.2Å; Q140-Y219 HydrophobicContact CG-CD2 3.8Å; Q140-Y219 HydrophobicContact CG-CE2 4.07Å; Q140-Y219 HydrophobicContact CG-CG 4.01Å; L144-Y219 HydrophobicContact CD1-CE1 3.96Å; F170-Y219 HydrophobicContact CB-CD1 4.2Å; F170-Y219 AromaticContact CD1-CD1 3.95Å; F170-Y219 HydrophobicContact CD1-CD1 3.95Å; F170-Y219 AromaticContact CD2-CD1 3.63Å; F170-Y219 HydrophobicContact CD2-CD1 3.63Å; F170-Y219 AromaticContact CD2-CE1 3.95Å; F170-Y219 HydrophobicContact CD2-CE1 3.95Å; F170-Y219 HydrophobicContact CE1-CD1 4.18Å; F170-Y219 AromaticContact CE2-CD1 3.87Å; F170-Y219 HydrophobicContact CE2-CD1 3.87Å; F170-Y219 HydrophobicContact CE2-CE1 4.28Å; F170-Y219 AromaticContact CG-CD1 3.66Å; F170-Y219 HydrophobicContact CG-CD1 3.66Å; F170-Y219 HydrophobicContact CG-CE1 4.31Å; F170-Y219 HydrophobicContact CZ-CD1 4.14Å; L215-Y219 WeakPolarHBondContact O-CD2 3.32Å; R216-Y219 PolarHBondContact O-N 3.35Å; E217-Y219 VanDerWaalsContact C-N 3.25Å; E217-Y219 PolarHBondContact O-N 3.35Å; Y219-V223 WeakPolarHBondContact O-CG2 3.31Å
220	A	96.4	Very high	92.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-76	-45.2	-174.5	0	0	0	0	0	113.9	R216 E217 V223 F224 F259 F262 W263	R216-A220 PolarHBondContact O-N 2.97Å; E217-A220 PolarHBondContact O-N 3.01Å; A220-V223 CarbonylContact O-C 3.54Å; A220-V223 WeakPolarHBondContact O-CB 3.42Å; A220-V223 PolarHBondContact O-N 3.17Å; A220-V223 VanDerWaalsContact O-N 3.09Å; A220-F224 PolarHBondContact O-N 3.49Å; A220-F259 HydrophobicContact CB-CD2 3.99Å; A220-F259 HydrophobicContact CB-CE2 4.24Å; A220-F259 WeakPolarHBondContact O-CD2 3.41Å; A220-F262 HydrophobicContact CB-CB 3.93Å; A220-W263 HydrophobicContact CB-CB 3.44Å; A220-W263 VanDerWaalsContact CB-CB 3.44Å; A220-W263 HydrophobicContact CB-CG 4.22Å
221	L	96.1	Very high	93.6	Very high	15 Å²	15	15.8 Å²	15.8	8%	0.079	9%	0.087	C	C	.	.	H	α-helix	trans	-61.6	-40.1	-177.4	-67.3	176.6	0	0	0	113.1	E217 V223 F224 W225 L269 I496	E217-L221 HydrophobicContact CB-CD1 4.25Å; E217-L221 HydrophobicContact CB-CG 4.41Å; E217-L221 WeakPolarHBondContact O-CB 3.46Å; E217-L221 WeakPolarHBondContact O-CG 3.31Å; E217-L221 PolarHBondContact O-N 3.27Å; L221-V223 VanDerWaalsContact C-N 3.3Å; L221-V223 PolarHBondContact O-N 3.43Å; L221-F224 CarbonylContact O-C 3.57Å; L221-F224 WeakPolarHBondContact O-CA 3.42Å; L221-F224 VanDerWaalsContact O-CB 3.3Å; L221-F224 WeakPolarHBondContact O-CB 3.36Å; L221-F224 PolarHBondContact O-N 3.39Å; L221-F224 VanDerWaalsContact O-N 3.09Å; L221-W225 VanDerWaalsContact O-CG 3.25Å; L221-W225 PolarHBondContact O-N 3.19Å; L221-W225 PolarHBondContact O-NE1 3.15Å; L221-L269 HydrophobicContact CD2-CD1 3.99Å; L221-I496 HydrophobicContact CD2-CG1 4.14Å
222	P	97.2	Very high	94.3	Very high	8 Å²	8	13.5 Å²	13.5	5%	0.052	6%	0.064	C	C	.	.	H	α-helix	trans	-55.1	-42.5	170.3	-31	39	0	0	0	114.2	F170 F173 N218 F224 W225 M226	F170-P222 HydrophobicContact CB-CG 4.39Å; F170-P222 HydrophobicContact CD1-CB 4.42Å; F170-P222 VanDerWaalsContact O-CB 3.29Å; F170-P222 WeakPolarHBondContact O-CB 3.33Å; F170-P222 WeakPolarHBondContact O-CG 3.25Å; F173-P222 HydrophobicContact CD1-CB 3.77Å; F173-P222 HydrophobicContact CE1-CB 4.39Å; N218-P222 VanDerWaalsContact O-CD 3.25Å; N218-P222 WeakPolarHBondContact O-CD 3.2Å; N218-P222 WeakPolarHBondContact O-CG 3.28Å; P222-F224 VanDerWaalsContact C-N 3.34Å; P222-W225 PolarHBondContact O-N 3.26Å; P222-M226 PolarHBondContact O-N 3.19Å; P222-M226 VanDerWaalsContact O-N 3.13Å
223	V	97.6	Very high	94.7	Very high	7 Å²	7	11.2 Å²	11.2	4%	0.042	6%	0.058	C	C	.	.	H	α-helix	trans	-69.1	-34.5	175.9	-176.6	0	0	0	0	110.9	F170 Y219 A220 L221 M226 Q227 S255 F258 F259 F262	F170-V223 HydrophobicContact CE1-CG2 4.27Å; Y219-V223 WeakPolarHBondContact O-CG2 3.31Å; A220-V223 CarbonylContact O-C 3.54Å; A220-V223 WeakPolarHBondContact O-CB 3.42Å; A220-V223 PolarHBondContact O-N 3.17Å; A220-V223 VanDerWaalsContact O-N 3.09Å; L221-V223 VanDerWaalsContact C-N 3.3Å; L221-V223 PolarHBondContact O-N 3.43Å; V223-M226 HydrophobicContact CG1-CE 3.94Å; V223-M226 WeakPolarHBondContact O-CB 3.26Å; V223-M226 PolarHBondContact O-N 3.43Å; V223-Q227 WeakPolarHBondContact O-CB 3.38Å; V223-Q227 PolarHBondContact O-N 2.82Å; V223-S255 VanDerWaalsContact CG1-O 3.26Å; V223-S255 WeakPolarHBondContact CG1-O 3.49Å; V223-F258 HydrophobicContact CG1-CB 3.94Å; V223-F259 HydrophobicContact CB-CB 4.32Å; V223-F259 HydrophobicContact CG1-CB 3.95Å; V223-F262 HydrophobicContact CG2-CD2 4.1Å; V223-F262 HydrophobicContact CG2-CE2 3.98Å
224	F	97.5	Very high	95.2	Very high	3 Å²	3	11.5 Å²	11.5	1%	0.013	6%	0.059	C	C	.	.	H	α-helix	trans	-62.8	-38.8	171.7	-178	-114.2	0	0	0	112.4	A220 L221 P222 Q227 N228 F259	A220-F224 PolarHBondContact O-N 3.49Å; L221-F224 CarbonylContact O-C 3.57Å; L221-F224 WeakPolarHBondContact O-CA 3.42Å; L221-F224 VanDerWaalsContact O-CB 3.3Å; L221-F224 WeakPolarHBondContact O-CB 3.36Å; L221-F224 PolarHBondContact O-N 3.39Å; L221-F224 VanDerWaalsContact O-N 3.09Å; P222-F224 VanDerWaalsContact C-N 3.34Å; F224-Q227 WeakPolarHBondContact O-CB 3.27Å; F224-Q227 PolarHBondContact O-N 3.33Å; F224-N228 VanDerWaalsContact CD1-ND2 3.34Å; F224-N228 WeakPolarHBondContact CD1-ND2 3.46Å; F224-N228 WeakPolarHBondContact CE1-ND2 3.33Å; F224-N228 WeakPolarHBondContact CZ-ND2 3.33Å; F224-N228 PolarHBondContact O-N 3.19Å; F224-N228 PolarHBondContact O-ND2 2.67Å; F224-F259 HydrophobicContact CB-CD2 3.64Å; F224-F259 HydrophobicContact CB-CE2 3.75Å; F224-F259 HydrophobicContact CB-CG 4.14Å; F224-F259 HydrophobicContact CB-CZ 4.31Å; F224-F259 HydrophobicContact CD2-CD1 4.04Å; F224-F259 HydrophobicContact CD2-CD2 4.35Å; F224-F259 AromaticContact CD2-CE1 3.74Å; F224-F259 HydrophobicContact CD2-CE1 3.74Å; F224-F259 HydrophobicContact CD2-CE2 4.09Å; F224-F259 HydrophobicContact CD2-CG 4.33Å; F224-F259 AromaticContact CD2-CZ 3.78Å; F224-F259 HydrophobicContact CD2-CZ 3.78Å; F224-F259 HydrophobicContact CE2-CE1 4.3Å; F224-F259 HydrophobicContact CE2-CZ 4.42Å; F224-F259 HydrophobicContact CG-CD2 4.37Å; F224-F259 HydrophobicContact CG-CE2 4.11Å; F224-F259 HydrophobicContact CG-CZ 4.2Å
225	W	97.7	Very high	95.2	Very high	11 Å²	11	11.7 Å²	11.7	4%	0.042	6%	0.06	C	C	.	.	H	α-helix	trans	-66.9	-39.1	175.1	-54.4	136.2	0	0	0	112	M177 L178 L221 P222 Q227 N228 L229 I496 P499 Q500	M177-W225 HydrophobicContact CB-CB 4.04Å; L178-W225 HydrophobicContact CD1-CG 4.39Å; L178-W225 HydrophobicContact CD2-CB 4.12Å; L178-W225 HydrophobicContact CD2-CD2 3.77Å; L178-W225 HydrophobicContact CD2-CE3 4.02Å; L178-W225 HydrophobicContact CD2-CG 3.78Å; L178-W225 HydrophobicContact CG-CB 4.18Å; L178-W225 HydrophobicContact CG-CD2 4.39Å; L178-W225 HydrophobicContact CG-CG 3.93Å; L221-W225 VanDerWaalsContact O-CG 3.25Å; L221-W225 PolarHBondContact O-N 3.19Å; L221-W225 PolarHBondContact O-NE1 3.15Å; P222-W225 PolarHBondContact O-N 3.26Å; W225-Q227 VanDerWaalsContact C-N 3.33Å; W225-N228 PolarHBondContact O-N 3.37Å; W225-L229 PolarHBondContact O-N 2.9Å; W225-I496 WeakPolarHBondContact CH2-O 3.46Å; W225-P499 HydrophobicContact CH2-CB 3.99Å; W225-P499 HydrophobicContact CH2-CG 4.28Å; W225-P499 HydrophobicContact CZ2-CB 3.63Å; W225-P499 HydrophobicContact CZ2-CG 3.63Å; W225-Q500 HydrophobicContact CH2-CG 4.2Å; W225-Q500 HydrophobicContact CZ3-CG 3.86Å
226	M	97.7	Very high	94.9	Very high	39 Å²	39	15.3 Å²	15.3	19%	0.192	7%	0.074	C	C	.	.	H	α-helix	trans	-59.9	-43.7	169.3	179.4	175.3	64.8	0	0	111.6	F173 M177 P222 V223 N228 L229 F230	F173-M226 HydrophobicContact CE1-CB 4.47Å; F173-M226 HydrophobicContact CZ-CB 4.27Å; F173-M226 HydrophobicContact CZ-SD 3.78Å; M177-M226 HydrophobicContact CG-CB 3.91Å; M177-M226 HydrophobicContact SD-CB 3.92Å; M177-M226 HydrophobicContact SD-CG 4.04Å; P222-M226 PolarHBondContact O-N 3.19Å; P222-M226 VanDerWaalsContact O-N 3.13Å; V223-M226 HydrophobicContact CG1-CE 3.94Å; V223-M226 WeakPolarHBondContact O-CB 3.26Å; V223-M226 PolarHBondContact O-N 3.43Å; M226-N228 PolarHBondContact O-N 2.83Å; M226-L229 WeakPolarHBondContact O-CB 3.35Å; M226-L229 PolarHBondContact O-N 3.32Å; M226-F230 HydrophobicContact CE-CE2 4.45Å; M226-F230 HydrophobicContact CG-CD2 4.02Å; M226-F230 HydrophobicContact CG-CE2 3.34Å; M226-F230 HydrophobicContact CG-CZ 3.69Å; M226-F230 WeakPolarHBondContact O-CD2 3.5Å; M226-F230 PolarHBondContact O-N 3.44Å; M226-F230 VanDerWaalsContact O-N 3.09Å; M226-F230 HydrophobicContact SD-CE2 3.79Å; M226-F230 HydrophobicContact SD-CZ 4.05Å
227	Q	97.6	Very high	93.8	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.5	-44.3	177.4	-172.8	-85.4	-7	0	0	111.4	V223 F224 W225 L229 F230 V231 L252 T256	V223-Q227 WeakPolarHBondContact O-CB 3.38Å; V223-Q227 PolarHBondContact O-N 2.82Å; F224-Q227 WeakPolarHBondContact O-CB 3.27Å; F224-Q227 PolarHBondContact O-N 3.33Å; W225-Q227 VanDerWaalsContact C-N 3.33Å; Q227-L229 VanDerWaalsContact C-N 3.31Å; Q227-L229 PolarHBondContact O-N 2.91Å; Q227-F230 PolarHBondContact O-N 3.13Å; Q227-F230 VanDerWaalsContact O-N 3.11Å; Q227-V231 VanDerWaalsContact NE2-CG2 3.26Å; Q227-V231 WeakPolarHBondContact O-CG2 3.37Å; Q227-V231 PolarHBondContact O-N 3.3Å; Q227-L252 HydrophobicContact CG-CD1 4.1Å; Q227-T256 WeakPolarHBondContact CG-OG1 3.46Å; Q227-T256 PolarHBondContact NE2-OG1 2.93Å
228	N	97.4	Very high	92.1	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-60.2	-39.2	175.7	-82	-73.1	0	0	0	112.5	L181 F224 W225 M226 V231 C232 Q273 Q479	L181-N228 HydrophobicContact CD2-CB 4.32Å; F224-N228 VanDerWaalsContact CD1-ND2 3.34Å; F224-N228 WeakPolarHBondContact CD1-ND2 3.46Å; F224-N228 WeakPolarHBondContact CE1-ND2 3.33Å; F224-N228 WeakPolarHBondContact CZ-ND2 3.33Å; F224-N228 PolarHBondContact O-N 3.19Å; F224-N228 PolarHBondContact O-ND2 2.67Å; W225-N228 PolarHBondContact O-N 3.37Å; M226-N228 PolarHBondContact O-N 2.83Å; N228-V231 PolarHBondContact O-N 3.39Å; N228-C232 WeakPolarHBondContact O-CB 3.48Å; N228-C232 PolarHBondContact O-N 2.98Å; N228-C232 PolarHBondContact O-SG 2.93Å; N228-Q273 PolarHBondContact OD1-NE2 3.33Å; N228-Q479 PolarHBondContact OD1-NE2 3Å; N228-Q479 PolarHBondContact OD1-OE1 2.91Å; N228-Q479 VanDerWaalsContact OD1-OE1 3.09Å
229	L	96.3	Very high	90.3	Very high	22 Å²	22	34.3 Å²	34.3	12%	0.115	16%	0.163	C	C	.	.	H	α-helix	trans	-58.3	-48.7	172.1	171.4	63.8	0	0	0	111.5	M177 C180 L181 W225 M226 Q227 C232 V233	M177-L229 HydrophobicContact SD-CD2 4.48Å; C180-L229 HydrophobicContact CB-CD2 3.97Å; L181-L229 HydrophobicContact CB-CB 4.49Å; L181-L229 HydrophobicContact CB-CD1 4.5Å; L181-L229 HydrophobicContact CD1-CB 4.36Å; L181-L229 HydrophobicContact CD1-CD1 4.36Å; W225-L229 PolarHBondContact O-N 2.9Å; M226-L229 WeakPolarHBondContact O-CB 3.35Å; M226-L229 PolarHBondContact O-N 3.32Å; Q227-L229 VanDerWaalsContact C-N 3.31Å; Q227-L229 PolarHBondContact O-N 2.91Å; L229-C232 PolarHBondContact O-N 3.05Å; L229-V233 HydrophobicContact CD1-CG2 4.16Å; L229-V233 VanDerWaalsContact O-CG2 3.3Å; L229-V233 WeakPolarHBondContact O-CG2 3.37Å; L229-V233 PolarHBondContact O-N 2.87Å
230	F	95.6	Very high	88.5	Confident	45 Å²	45	37.2 Å²	37.2	20%	0.197	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-38.7	179	-61.3	-34.5	0	0	0	113	M226 Q227 V233 F234 L248 A251 L252	M226-F230 HydrophobicContact CE-CE2 4.45Å; M226-F230 HydrophobicContact CG-CD2 4.02Å; M226-F230 HydrophobicContact CG-CE2 3.34Å; M226-F230 HydrophobicContact CG-CZ 3.69Å; M226-F230 WeakPolarHBondContact O-CD2 3.5Å; M226-F230 PolarHBondContact O-N 3.44Å; M226-F230 VanDerWaalsContact O-N 3.09Å; M226-F230 HydrophobicContact SD-CE2 3.79Å; M226-F230 HydrophobicContact SD-CZ 4.05Å; Q227-F230 PolarHBondContact O-N 3.13Å; Q227-F230 VanDerWaalsContact O-N 3.11Å; F230-V233 PolarHBondContact O-N 3.24Å; F230-F234 VanDerWaalsContact O-CB 3.27Å; F230-F234 WeakPolarHBondContact O-CB 3.32Å; F230-F234 PolarHBondContact O-N 2.96Å; F230-L248 HydrophobicContact CB-CD1 4.01Å; F230-L248 HydrophobicContact CD1-CD1 4.03Å; F230-L248 HydrophobicContact CG-CD1 4.28Å; F230-A251 HydrophobicContact CD1-CB 4.49Å; F230-A251 HydrophobicContact CD2-CB 3.9Å; F230-A251 WeakPolarHBondContact CD2-O 3.32Å; F230-A251 HydrophobicContact CE1-CB 4.36Å; F230-A251 HydrophobicContact CE2-CB 3.73Å; F230-A251 HydrophobicContact CG-CB 4.29Å; F230-A251 HydrophobicContact CZ-CB 3.98Å; F230-L252 HydrophobicContact CB-CD1 4.31Å
231	V	95.4	Very high	86.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-49.7	172.8	173.4	0	0	0	0	110.5	Q227 N228 V233 F234 L235 L252 I294 F475	Q227-V231 VanDerWaalsContact NE2-CG2 3.26Å; Q227-V231 WeakPolarHBondContact O-CG2 3.37Å; Q227-V231 PolarHBondContact O-N 3.3Å; N228-V231 PolarHBondContact O-N 3.39Å; V231-V233 PolarHBondContact O-N 3.4Å; V231-F234 PolarHBondContact O-N 2.95Å; V231-L235 HydrophobicContact CG1-CD1 3.75Å; V231-L235 HydrophobicContact CG1-CG 4.07Å; V231-L235 WeakPolarHBondContact O-CB 3.5Å; V231-L235 VanDerWaalsContact O-CG 3.27Å; V231-L235 WeakPolarHBondContact O-CG 3.33Å; V231-L235 PolarHBondContact O-N 3.01Å; V231-L252 HydrophobicContact CG2-CD1 3.49Å; V231-L252 VanDerWaalsContact CG2-CD1 3.49Å; V231-I294 HydrophobicContact CG1-CD1 4.18Å; V231-F475 HydrophobicContact CB-CE1 4.25Å; V231-F475 HydrophobicContact CB-CZ 4.39Å; V231-F475 HydrophobicContact CG1-CD1 4.1Å; V231-F475 HydrophobicContact CG1-CD2 4.46Å; V231-F475 HydrophobicContact CG1-CE1 3.65Å; V231-F475 HydrophobicContact CG1-CE2 4.06Å; V231-F475 HydrophobicContact CG1-CG 4.48Å; V231-F475 HydrophobicContact CG1-CZ 3.62Å
232	C	94.8	Very high	84.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.9	-44.7	179.9	-70.6	0	0	0	0	112.1	L181 N228 L229 F234 L235 R236 D472	L181-C232 HydrophobicContact CD1-CB 4.19Å; N228-C232 WeakPolarHBondContact O-CB 3.48Å; N228-C232 PolarHBondContact O-N 2.98Å; N228-C232 PolarHBondContact O-SG 2.93Å; L229-C232 PolarHBondContact O-N 3.05Å; C232-F234 VanDerWaalsContact C-N 3.35Å; C232-F234 PolarHBondContact O-N 2.82Å; C232-L235 PolarHBondContact O-N 3.25Å; C232-R236 WeakPolarHBondContact O-CB 3.39Å; C232-R236 PolarHBondContact O-N 2.89Å; C232-D472 HydrophobicContact CB-CB 4.06Å
233	V	91.6	Very high	83	Confident	58 Å²	58	52 Å²	52	35%	0.352	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-42.2	177.1	173.8	0	0	0	0	111.1	L229 F230 V231 R236 G237 L248	L229-V233 HydrophobicContact CD1-CG2 4.16Å; L229-V233 VanDerWaalsContact O-CG2 3.3Å; L229-V233 WeakPolarHBondContact O-CG2 3.37Å; L229-V233 PolarHBondContact O-N 2.87Å; F230-V233 PolarHBondContact O-N 3.24Å; V231-V233 PolarHBondContact O-N 3.4Å; V233-R236 PolarHBondContact O-N 3.48Å; V233-G237 PolarHBondContact O-N 2.85Å; V233-L248 HydrophobicContact CB-CD1 4.49Å; V233-L248 HydrophobicContact CB-CD2 4.44Å; V233-L248 HydrophobicContact CG1-CD1 4.29Å; V233-L248 HydrophobicContact CG1-CD2 3.85Å
234	F	92	Very high	81.4	Confident	9 Å²	9	58 Å²	58	4%	0.039	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-43.4	178.2	-178.3	-103.4	0	0	0	111.8	F230 V231 C232 M240 L248 K290 F293 I294	F230-F234 VanDerWaalsContact O-CB 3.27Å; F230-F234 WeakPolarHBondContact O-CB 3.32Å; F230-F234 PolarHBondContact O-N 2.96Å; V231-F234 PolarHBondContact O-N 2.95Å; C232-F234 VanDerWaalsContact C-N 3.35Å; C232-F234 PolarHBondContact O-N 2.82Å; F234-M240 HydrophobicContact CD2-SD 3.84Å; F234-M240 HydrophobicContact CE2-SD 3.93Å; F234-L248 HydrophobicContact CB-CD2 3.78Å; F234-L248 HydrophobicContact CB-CG 4.34Å; F234-L248 HydrophobicContact CD2-CD2 4.04Å; F234-L248 HydrophobicContact CD2-CG 4.47Å; F234-L248 HydrophobicContact CG-CD2 4.43Å; F234-K290 HydrophobicContact CD1-CB 4.41Å; F234-K290 HydrophobicContact CE1-CB 3.75Å; F234-K290 HydrophobicContact CE1-CD 4.44Å; F234-K290 HydrophobicContact CE1-CG 4.06Å; F234-K290 HydrophobicContact CZ-CB 4.48Å; F234-K290 HydrophobicContact CZ-CG 4.45Å; F234-K290 PolarHBondContact O-NZ 3.36Å; F234-F293 HydrophobicContact CE1-CB 4.27Å; F234-F293 HydrophobicContact CZ-CB 3.91Å; F234-F293 HydrophobicContact CZ-CD2 4.2Å; F234-F293 HydrophobicContact CZ-CG 4.38Å; F234-I294 HydrophobicContact CD1-CD1 4.13Å; F234-I294 HydrophobicContact CD1-CG1 4.1Å; F234-I294 HydrophobicContact CE1-CD1 4.39Å; F234-I294 HydrophobicContact CE1-CG1 4.08Å
235	L	90.9	Very high	80.3	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-66.8	-36	178.9	-69.7	-176.1	0	0	0	112.9	V231 C232 L277 V286 K290 I294 V471 F475	V231-L235 HydrophobicContact CG1-CD1 3.75Å; V231-L235 HydrophobicContact CG1-CG 4.07Å; V231-L235 WeakPolarHBondContact O-CB 3.5Å; V231-L235 VanDerWaalsContact O-CG 3.27Å; V231-L235 WeakPolarHBondContact O-CG 3.33Å; V231-L235 PolarHBondContact O-N 3.01Å; C232-L235 PolarHBondContact O-N 3.25Å; L235-L277 HydrophobicContact CD1-CD2 4.13Å; L235-V286 HydrophobicContact CD2-CG2 3.66Å; L235-K290 VanDerWaalsContact C-NZ 3.32Å; L235-K290 HydrophobicContact CD2-CB 4.1Å; L235-K290 HydrophobicContact CD2-CD 4.24Å; L235-K290 PolarHBondContact O-NZ 3.32Å; L235-I294 HydrophobicContact CD2-CD1 3.9Å; L235-I294 HydrophobicContact CG-CD1 4.4Å; L235-V471 HydrophobicContact CB-CG1 4.36Å; L235-V471 HydrophobicContact CD1-CG1 4.49Å; L235-F475 HydrophobicContact CD1-CB 3.83Å; L235-F475 HydrophobicContact CD1-CD1 4.38Å; L235-F475 HydrophobicContact CD1-CD2 4.08Å; L235-F475 HydrophobicContact CD1-CG 3.82Å
236	R	85.4	Confident	79.7	Confident	82 Å²	82	63.3 Å²	63.3	31%	0.309	33%	0.33	S	S	.	.	H	α-helix	trans	-69.5	-34.5	-179.4	-167.2	-174.5	-64.6	161.9	0.5	114.5	S184 C232 V233 L238 D472	S184-R236 VanDerWaalsContact C-NH2 3.28Å; S184-R236 PolarHBondContact O-NH1 2.97Å; S184-R236 PolarHBondContact O-NH2 3.37Å; C232-R236 WeakPolarHBondContact O-CB 3.39Å; C232-R236 PolarHBondContact O-N 2.89Å; V233-R236 PolarHBondContact O-N 3.48Å; R236-L238 PolarHBondContact O-N 3.43Å; R236-D472 IonicContact CZ-OD2 2.68Å; R236-D472 IonicContact NE-OD2 3.16Å; R236-D472 PolarHBondContact NE-OD2 2.95Å; R236-D472 IonicContact NH2-OD2 3.67Å; R236-D472 PolarHBondContact NH2-OD2 2.99Å
237	G	70.4	Confident	79.2	Confident	27 Å²	27	69.4 Å²	69.4	28%	0.278	36%	0.356	S	S	.	.			trans	-67.3	101	-171.6	0	0	0	0	0	114.3	V233 R239 K290	V233-G237 PolarHBondContact O-N 2.85Å; G237-R239 VanDerWaalsContact C-N 3.25Å; G237-R239 PolarHBondContact O-N 3.5Å; G237-K290 WeakPolarHBondContact O-CE 3.3Å; G237-K290 PolarHBondContact O-NZ 2.87Å
238	L	56.7	Low	78.9	Confident	148 Å²	148	70.3 Å²	70.3	78%	0.775	36%	0.36	S	S	*	.	S	Bend	trans	-62.8	-28.4	177.9	-84.4	147.4	0	0	0	113.5	R236	R236-L238 PolarHBondContact O-N 3.43Å
239	R	55.2	Low	78.5	Confident	243 Å²	243	72.8 Å²	72.8	92%	0.917	37%	0.373	S	S	*	.	S	Bend	trans	-146.9	110	170.4	-70.9	-177.2	-177.3	167.5	0.2	108.2	G237	G237-R239 VanDerWaalsContact C-N 3.25Å; G237-R239 PolarHBondContact O-N 3.5Å
240	M	58.1	Low	78.4	Confident	60 Å²	60	73.4 Å²	73.4	30%	0.296	39%	0.386	S	S	.	.			trans	-75.4	135.4	170.6	-64.2	-170.7	75.8	0	0	109	F234 S245 L248	F234-M240 HydrophobicContact CD2-SD 3.84Å; F234-M240 HydrophobicContact CE2-SD 3.93Å; M240-S245 VanDerWaalsContact CE-CA 3.47Å; M240-L248 HydrophobicContact CE-CB 3.96Å; M240-L248 HydrophobicContact CE-CD2 3.53Å; M240-L248 HydrophobicContact CE-CG 4.35Å; M240-L248 HydrophobicContact SD-CD2 4.47Å
241	S	55.6	Low	78.3	Confident	71 Å²	71	72.1 Å²	72.1	50%	0.497	38%	0.383	S	S	.	.			trans	-59.6	140.4	166.1	178.1	0	0	0	0	108.8	G243 Q244 S245	S241-G243 PolarHBondContact O-N 3.23Å; S241-Q244 PolarHBondContact O-N 3.45Å; S241-S245 PolarHBondContact O-N 2.89Å
242	K	59	Low	78.3	Confident	205 Å²	205	72.1 Å²	72.1	89%	0.891	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-34	-178.3	-73.6	-174	176.8	-177.8	0	112.6	P246	K242-P246 WeakPolarHBondContact O-CD 3.3Å
243	G	60.5	Low	78.4	Confident	57 Å²	57	74.9 Å²	74.9	59%	0.588	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-21.9	179.1	0	0	0	0	0	116.2	S241 P246	S241-G243 PolarHBondContact O-N 3.23Å; G243-P246 WeakPolarHBondContact O-CD 3.44Å
244	Q	64.8	Low	78.7	Confident	133 Å²	133	76.6 Å²	76.6	62%	0.621	40%	0.404	S	S	*	.	H	α-helix	trans	-86.9	-23.1	-178.1	-71.1	180	-29.2	0	0	113	S241 L248	S241-Q244 PolarHBondContact O-N 3.45Å; Q244-L248 PolarHBondContact O-N 2.99Å
245	S	74.4	Confident	79	Confident	44 Å²	44	76.2 Å²	76.2	31%	0.308	40%	0.403	S	S	.	.	H	α-helix	trans	-59.3	-49.5	179.1	-161.7	0	0	0	0	114.7	M240 S241 L249	M240-S245 VanDerWaalsContact CE-CA 3.47Å; S241-S245 PolarHBondContact O-N 2.89Å; S245-L249 WeakPolarHBondContact O-CB 3.18Å; S245-L249 PolarHBondContact O-N 3.36Å
246	P	84.1	Confident	79.3	Confident	82 Å²	82	76.1 Å²	76.1	53%	0.532	40%	0.402	S	S	.	.	H	α-helix	trans	-68.1	-38.2	-175.3	25.7	-34.6	0	0	0	112.6	K242 G243 L249 G250	K242-P246 WeakPolarHBondContact O-CD 3.3Å; G243-P246 WeakPolarHBondContact O-CD 3.44Å; P246-L249 PolarHBondContact O-N 3.4Å; P246-G250 PolarHBondContact O-N 2.94Å
247	F	88	Confident	79.9	Confident	167 Å²	167	73.8 Å²	73.8	73%	0.732	39%	0.394	S	S	*	.	H	α-helix	trans	-63.9	-47.5	178.9	179.4	-95.4	0	0	0	111.9	L249 G250 A251	F247-L249 VanDerWaalsContact C-N 3.34Å; F247-L249 PolarHBondContact O-N 2.89Å; F247-G250 PolarHBondContact O-N 3.23Å; F247-A251 WeakPolarHBondContact O-CB 3.32Å; F247-A251 PolarHBondContact O-N 3.49Å
248	L	90.2	Very high	81.1	Confident	19 Å²	19	75 Å²	75	10%	0.099	39%	0.392	C	S	.	.	H	α-helix	trans	-65.9	-38.3	178.8	-177.2	60	0	0	0	111.9	F230 V233 F234 M240 Q244 A251 L252	F230-L248 HydrophobicContact CB-CD1 4.01Å; F230-L248 HydrophobicContact CD1-CD1 4.03Å; F230-L248 HydrophobicContact CG-CD1 4.28Å; V233-L248 HydrophobicContact CB-CD1 4.49Å; V233-L248 HydrophobicContact CB-CD2 4.44Å; V233-L248 HydrophobicContact CG1-CD1 4.29Å; V233-L248 HydrophobicContact CG1-CD2 3.85Å; F234-L248 HydrophobicContact CB-CD2 3.78Å; F234-L248 HydrophobicContact CB-CG 4.34Å; F234-L248 HydrophobicContact CD2-CD2 4.04Å; F234-L248 HydrophobicContact CD2-CG 4.47Å; F234-L248 HydrophobicContact CG-CD2 4.43Å; M240-L248 HydrophobicContact CE-CB 3.96Å; M240-L248 HydrophobicContact CE-CD2 3.53Å; M240-L248 HydrophobicContact CE-CG 4.35Å; M240-L248 HydrophobicContact SD-CD2 4.47Å; Q244-L248 PolarHBondContact O-N 2.99Å; L248-A251 PolarHBondContact O-N 3.24Å; L248-L252 WeakPolarHBondContact O-CB 3.41Å; L248-L252 PolarHBondContact O-N 3.4Å
249	L	89.2	Confident	83	Confident	53 Å²	53	67.9 Å²	67.9	28%	0.277	36%	0.355	S	S	.	.	H	α-helix	trans	-66.9	-39.5	176	-172.9	63.4	0	0	0	111.6	S245 P246 F247 L252 L253 V297	S245-L249 WeakPolarHBondContact O-CB 3.18Å; S245-L249 PolarHBondContact O-N 3.36Å; P246-L249 PolarHBondContact O-N 3.4Å; F247-L249 VanDerWaalsContact C-N 3.34Å; F247-L249 PolarHBondContact O-N 2.89Å; L249-L252 PolarHBondContact O-N 3.25Å; L249-L253 WeakPolarHBondContact O-CB 3.47Å; L249-L253 PolarHBondContact O-N 3.31Å; L249-V297 HydrophobicContact CD1-CG2 3.67Å
250	G	93.8	Very high	85	Confident	36 Å²	36	56.3 Å²	56.3	37%	0.371	31%	0.311	S	S	.	.	H	α-helix	trans	-63.3	-42.4	172.7	0	0	0	0	0	112.5	P246 F247 L252 L253 L254	P246-G250 PolarHBondContact O-N 2.94Å; F247-G250 PolarHBondContact O-N 3.23Å; G250-L252 VanDerWaalsContact C-N 3.35Å; G250-L253 PolarHBondContact O-N 3.35Å; G250-L254 VanDerWaalsContact O-CB 3.3Å; G250-L254 WeakPolarHBondContact O-CB 3.31Å; G250-L254 PolarHBondContact O-N 3.41Å
251	A	94.8	Very high	86.7	Confident	17 Å²	17	53.9 Å²	53.9	14%	0.14	30%	0.299	C	S	.	.	H	α-helix	trans	-65	-38.5	175.2	0	0	0	0	0	112	F230 F247 L248 S255	F230-A251 HydrophobicContact CD1-CB 4.49Å; F230-A251 HydrophobicContact CD2-CB 3.9Å; F230-A251 WeakPolarHBondContact CD2-O 3.32Å; F230-A251 HydrophobicContact CE1-CB 4.36Å; F230-A251 HydrophobicContact CE2-CB 3.73Å; F230-A251 HydrophobicContact CG-CB 4.29Å; F230-A251 HydrophobicContact CZ-CB 3.98Å; F247-A251 WeakPolarHBondContact O-CB 3.32Å; F247-A251 PolarHBondContact O-N 3.49Å; L248-A251 PolarHBondContact O-N 3.24Å; A251-S255 WeakPolarHBondContact O-CB 3.47Å; A251-S255 PolarHBondContact O-N 3.21Å; A251-S255 PolarHBondContact O-OG 2.97Å
252	L	95.6	Very high	88.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-46.8	173.6	-177.9	63.6	0	0	0	111	Q227 F230 V231 L248 L249 G250 L254 S255 T256 I294 V297	Q227-L252 HydrophobicContact CG-CD1 4.1Å; F230-L252 HydrophobicContact CB-CD1 4.31Å; V231-L252 HydrophobicContact CG2-CD1 3.49Å; V231-L252 VanDerWaalsContact CG2-CD1 3.49Å; L248-L252 WeakPolarHBondContact O-CB 3.41Å; L248-L252 PolarHBondContact O-N 3.4Å; L249-L252 PolarHBondContact O-N 3.25Å; G250-L252 VanDerWaalsContact C-N 3.35Å; L252-L254 PolarHBondContact O-N 3.44Å; L252-S255 WeakPolarHBondContact CA-OG 3.37Å; L252-S255 PolarHBondContact O-N 2.96Å; L252-S255 PolarHBondContact O-OG 2.97Å; L252-T256 WeakPolarHBondContact O-CB 3.24Å; L252-T256 PolarHBondContact O-N 3.17Å; L252-T256 PolarHBondContact O-OG1 3.3Å; L252-T256 VanDerWaalsContact O-OG1 3.1Å; L252-I294 HydrophobicContact CD2-CG1 4.09Å; L252-V297 HydrophobicContact CD2-CG2 4.33Å; L252-V297 HydrophobicContact CG-CG1 4.36Å
253	L	97	Very high	90.1	Very high	58 Å²	58	42.1 Å²	42.1	30%	0.304	24%	0.239	S	C	.	.	H	α-helix	trans	-60	-47.7	177	178	62.7	0	0	0	111.7	L249 G250 T256 F257 V297 I300	L249-L253 WeakPolarHBondContact O-CB 3.47Å; L249-L253 PolarHBondContact O-N 3.31Å; G250-L253 PolarHBondContact O-N 3.35Å; L253-T256 PolarHBondContact O-N 3.48Å; L253-F257 VanDerWaalsContact O-CB 3.22Å; L253-F257 WeakPolarHBondContact O-CB 3.48Å; L253-F257 PolarHBondContact O-N 3.38Å; L253-V297 HydrophobicContact CB-CG1 4.3Å; L253-V297 HydrophobicContact CD1-CG1 3.97Å; L253-I300 HydrophobicContact CD1-CB 4.19Å; L253-I300 HydrophobicContact CD1-CG2 3.81Å; L253-I300 HydrophobicContact CD2-CG2 4.44Å
254	L	97.2	Very high	91.3	Very high	95 Å²	95	40.4 Å²	40.4	50%	0.497	22%	0.215	S	C	.	.	H	α-helix	trans	-66.8	-42	-178.4	-168.1	63.2	0	0	0	112	G250 L252 F257 F258	G250-L254 VanDerWaalsContact O-CB 3.3Å; G250-L254 WeakPolarHBondContact O-CB 3.31Å; G250-L254 PolarHBondContact O-N 3.41Å; L252-L254 PolarHBondContact O-N 3.44Å; L254-F257 PolarHBondContact O-N 3.32Å; L254-F258 HydrophobicContact CD1-CD2 3.76Å; L254-F258 HydrophobicContact CD1-CE2 3.3Å; L254-F258 HydrophobicContact CD1-CZ 4.21Å; L254-F258 HydrophobicContact CD2-CE2 4.18Å; L254-F258 HydrophobicContact CG-CD2 3.74Å; L254-F258 HydrophobicContact CG-CE2 3.6Å; L254-F258 VanDerWaalsContact O-CD2 3.29Å; L254-F258 WeakPolarHBondContact O-CD2 3.25Å; L254-F258 PolarHBondContact O-N 2.83Å
255	S	97.5	Very high	92.2	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-67.3	-42.7	177.4	61.2	0	0	0	0	111.9	V223 A251 L252 F259	V223-S255 VanDerWaalsContact CG1-O 3.26Å; V223-S255 WeakPolarHBondContact CG1-O 3.49Å; A251-S255 WeakPolarHBondContact O-CB 3.47Å; A251-S255 PolarHBondContact O-N 3.21Å; A251-S255 PolarHBondContact O-OG 2.97Å; L252-S255 WeakPolarHBondContact CA-OG 3.37Å; L252-S255 PolarHBondContact O-N 2.96Å; L252-S255 PolarHBondContact O-OG 2.97Å; S255-F259 WeakPolarHBondContact O-CB 3.28Å; S255-F259 PolarHBondContact O-N 2.98Å
256	T	97.7	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-41.4	173.2	-64.4	0	0	0	0	111.8	Q227 L252 L253 A260 L270 V297 Y298 T301	Q227-T256 WeakPolarHBondContact CG-OG1 3.46Å; Q227-T256 PolarHBondContact NE2-OG1 2.93Å; L252-T256 WeakPolarHBondContact O-CB 3.24Å; L252-T256 PolarHBondContact O-N 3.17Å; L252-T256 PolarHBondContact O-OG1 3.3Å; L252-T256 VanDerWaalsContact O-OG1 3.1Å; L253-T256 PolarHBondContact O-N 3.48Å; T256-A260 VanDerWaalsContact O-CB 3.3Å; T256-A260 WeakPolarHBondContact O-CB 3.24Å; T256-A260 PolarHBondContact O-N 3.49Å; T256-L270 HydrophobicContact CG2-CD1 4.46Å; T256-L270 HydrophobicContact CG2-CD2 4.17Å; T256-V297 HydrophobicContact CG2-CG1 4.26Å; T256-Y298 HydrophobicContact CG2-CD1 3.93Å; T256-Y298 HydrophobicContact CG2-CE1 4.19Å; T256-T301 HydrophobicContact CG2-CG2 4.1Å
257	F	97.3	Very high	93.3	Very high	33 Å²	33	33.7 Å²	33.7	15%	0.145	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-53.3	177	175	-99.3	0	0	0	112.5	L253 L254 F259 A260 L261 T301 A304 L305 I308	L253-F257 VanDerWaalsContact O-CB 3.22Å; L253-F257 WeakPolarHBondContact O-CB 3.48Å; L253-F257 PolarHBondContact O-N 3.38Å; L254-F257 PolarHBondContact O-N 3.32Å; F257-F259 PolarHBondContact O-N 2.96Å; F257-A260 PolarHBondContact O-N 3.49Å; F257-L261 HydrophobicContact CE1-CD2 3.95Å; F257-L261 HydrophobicContact CZ-CD1 4.17Å; F257-L261 HydrophobicContact CZ-CD2 4.13Å; F257-L261 VanDerWaalsContact O-CB 3.29Å; F257-L261 WeakPolarHBondContact O-CB 3.3Å; F257-L261 PolarHBondContact O-N 2.88Å; F257-T301 HydrophobicContact CB-CG2 4.32Å; F257-T301 HydrophobicContact CD2-CG2 4.41Å; F257-A304 HydrophobicContact CD2-CB 4.11Å; F257-A304 HydrophobicContact CE2-CB 4.01Å; F257-L305 HydrophobicContact CD2-CD2 4.25Å; F257-L305 HydrophobicContact CD2-CG 4.39Å; F257-L305 HydrophobicContact CE2-CD2 3.84Å; F257-L305 HydrophobicContact CE2-CG 4.24Å; F257-I308 HydrophobicContact CE2-CD1 3.74Å; F257-I308 HydrophobicContact CZ-CD1 3.4Å; F257-I308 VanDerWaalsContact CZ-CD1 3.4Å
258	F	97	Very high	93.4	Very high	52 Å²	52	29 Å²	29	23%	0.228	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-37.4	-179.8	-79.5	-62.6	0	0	0	113.1	M143 V223 L254 A260 L261 F262	M143-F258 HydrophobicContact CE-CE1 3.83Å; M143-F258 HydrophobicContact CE-CZ 4.33Å; M143-F258 HydrophobicContact SD-CD1 4.45Å; M143-F258 HydrophobicContact SD-CE1 3.94Å; V223-F258 HydrophobicContact CG1-CB 3.94Å; L254-F258 HydrophobicContact CD1-CD2 3.76Å; L254-F258 HydrophobicContact CD1-CE2 3.3Å; L254-F258 HydrophobicContact CD1-CZ 4.21Å; L254-F258 HydrophobicContact CD2-CE2 4.18Å; L254-F258 HydrophobicContact CG-CD2 3.74Å; L254-F258 HydrophobicContact CG-CE2 3.6Å; L254-F258 VanDerWaalsContact O-CD2 3.29Å; L254-F258 WeakPolarHBondContact O-CD2 3.25Å; L254-F258 PolarHBondContact O-N 2.83Å; F258-A260 VanDerWaalsContact C-N 3.27Å; F258-A260 PolarHBondContact O-N 3.11Å; F258-L261 HydrophobicContact CD1-CD2 4.09Å; F258-L261 HydrophobicContact CE1-CD2 4.34Å; F258-L261 PolarHBondContact O-N 3.18Å; F258-F262 HydrophobicContact CB-CE2 4.24Å; F258-F262 HydrophobicContact CB-CZ 4.44Å; F258-F262 HydrophobicContact CD1-CE1 4.14Å; F258-F262 HydrophobicContact CD1-CE2 4.47Å; F258-F262 AromaticContact CD1-CZ 3.85Å; F258-F262 HydrophobicContact CD1-CZ 3.85Å; F258-F262 HydrophobicContact CG-CZ 4.47Å; F258-F262 WeakPolarHBondContact O-CB 3.47Å; F258-F262 WeakPolarHBondContact O-CD2 3.33Å; F258-F262 VanDerWaalsContact O-CG 3.27Å; F258-F262 WeakPolarHBondContact O-CG 3.29Å; F258-F262 PolarHBondContact O-N 3.26Å
259	F	97	Very high	93.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-56.3	-46.9	173.1	164.2	-121	0	0	0	110.8	A220 V223 F224 S255 F257 W263 N266 L269 L270	A220-F259 HydrophobicContact CB-CD2 3.99Å; A220-F259 HydrophobicContact CB-CE2 4.24Å; A220-F259 WeakPolarHBondContact O-CD2 3.41Å; V223-F259 HydrophobicContact CB-CB 4.32Å; V223-F259 HydrophobicContact CG1-CB 3.95Å; F224-F259 HydrophobicContact CB-CD2 3.64Å; F224-F259 HydrophobicContact CB-CE2 3.75Å; F224-F259 HydrophobicContact CB-CG 4.14Å; F224-F259 HydrophobicContact CB-CZ 4.31Å; F224-F259 HydrophobicContact CD2-CD1 4.04Å; F224-F259 HydrophobicContact CD2-CD2 4.35Å; F224-F259 AromaticContact CD2-CE1 3.74Å; F224-F259 HydrophobicContact CD2-CE1 3.74Å; F224-F259 HydrophobicContact CD2-CE2 4.09Å; F224-F259 HydrophobicContact CD2-CG 4.33Å; F224-F259 AromaticContact CD2-CZ 3.78Å; F224-F259 HydrophobicContact CD2-CZ 3.78Å; F224-F259 HydrophobicContact CE2-CE1 4.3Å; F224-F259 HydrophobicContact CE2-CZ 4.42Å; F224-F259 HydrophobicContact CG-CD2 4.37Å; F224-F259 HydrophobicContact CG-CE2 4.11Å; F224-F259 HydrophobicContact CG-CZ 4.2Å; S255-F259 WeakPolarHBondContact O-CB 3.28Å; S255-F259 PolarHBondContact O-N 2.98Å; F257-F259 PolarHBondContact O-N 2.96Å; F259-W263 HydrophobicContact CE2-CE3 4.41Å; F259-N266 HydrophobicContact CD1-CB 4.37Å; F259-N266 HydrophobicContact CE1-CB 3.86Å; F259-N266 HydrophobicContact CE2-CB 4.31Å; F259-N266 HydrophobicContact CZ-CB 3.82Å; F259-L269 HydrophobicContact CE1-CB 4.3Å; F259-L269 HydrophobicContact CE2-CD1 4.16Å; F259-L269 HydrophobicContact CZ-CB 3.82Å; F259-L269 HydrophobicContact CZ-CD1 3.73Å; F259-L269 HydrophobicContact CZ-CG 4.36Å; F259-L270 HydrophobicContact CD1-CD2 4.05Å; F259-L270 HydrophobicContact CD1-CG 4.4Å; F259-L270 HydrophobicContact CE1-CD2 3.84Å; F259-L270 HydrophobicContact CE1-CG 3.93Å
260	A	95.5	Very high	93.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-74.4	-29.3	-179.2	0	0	0	0	0	113.4	T256 F257 F258 N266 L270 T301 L305	T256-A260 VanDerWaalsContact O-CB 3.3Å; T256-A260 WeakPolarHBondContact O-CB 3.24Å; T256-A260 PolarHBondContact O-N 3.49Å; F257-A260 PolarHBondContact O-N 3.49Å; F258-A260 VanDerWaalsContact C-N 3.27Å; F258-A260 PolarHBondContact O-N 3.11Å; A260-N266 HydrophobicContact CB-CB 4.12Å; A260-N266 VanDerWaalsContact CB-CG 3.48Å; A260-N266 WeakPolarHBondContact CB-OD1 3.31Å; A260-N266 PolarHBondContact O-ND2 3.2Å; A260-L270 HydrophobicContact CB-CD1 4.34Å; A260-T301 HydrophobicContact CB-CG2 4Å; A260-L305 HydrophobicContact CB-CD1 3.46Å; A260-L305 VanDerWaalsContact CB-CD1 3.46Å
261	L	94.8	Very high	94	Very high	8 Å²	8	25.4 Å²	25.4	4%	0.042	12%	0.123	C	C	.	.	H	α-helix	trans	-67.3	-43	175.3	-170	70.7	0	0	0	112.1	Y139 F257 F258 W263 L305 I308	Y139-L261 HydrophobicContact CD1-CD1 3.87Å; Y139-L261 HydrophobicContact CD1-CD2 4.27Å; Y139-L261 HydrophobicContact CD1-CG 4.25Å; Y139-L261 HydrophobicContact CD2-CD1 3.54Å; Y139-L261 HydrophobicContact CD2-CG 3.84Å; Y139-L261 HydrophobicContact CE1-CD1 4.16Å; Y139-L261 HydrophobicContact CE2-CD1 3.89Å; Y139-L261 HydrophobicContact CG-CD1 3.57Å; Y139-L261 HydrophobicContact CG-CD2 3.98Å; Y139-L261 HydrophobicContact CG-CG 3.64Å; F257-L261 HydrophobicContact CE1-CD2 3.95Å; F257-L261 HydrophobicContact CZ-CD1 4.17Å; F257-L261 HydrophobicContact CZ-CD2 4.13Å; F257-L261 VanDerWaalsContact O-CB 3.29Å; F257-L261 WeakPolarHBondContact O-CB 3.3Å; F257-L261 PolarHBondContact O-N 2.88Å; F258-L261 HydrophobicContact CD1-CD2 4.09Å; F258-L261 HydrophobicContact CE1-CD2 4.34Å; F258-L261 PolarHBondContact O-N 3.18Å; L261-W263 PolarHBondContact O-N 2.98Å; L261-L305 HydrophobicContact CB-CD2 4.02Å; L261-L305 HydrophobicContact CD1-CD2 3.61Å; L261-L305 HydrophobicContact CG-CD2 4.45Å; L261-I308 HydrophobicContact CD1-CG2 4.13Å
262	F	94.5	Very high	94	Very high	7 Å²	7	25.8 Å²	25.8	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-76.8	-16.4	-173.2	-66.7	-21.5	0	0	0	114.9	Q140 M143 F170 R216 A220 V223 F258	Q140-F262 HydrophobicContact CB-CD1 3.86Å; Q140-F262 HydrophobicContact CB-CE1 3.94Å; Q140-F262 HydrophobicContact CB-CG 4.44Å; Q140-F262 PolarHBondContact OE1-O 3.46Å; M143-F262 HydrophobicContact CE-CZ 4.43Å; M143-F262 HydrophobicContact SD-CE1 3.69Å; M143-F262 HydrophobicContact SD-CZ 3.92Å; F170-F262 HydrophobicContact CE1-CE2 4.01Å; F170-F262 HydrophobicContact CZ-CE2 4.3Å; R216-F262 WeakPolarHBondContact CB-O 3.41Å; A220-F262 HydrophobicContact CB-CB 3.93Å; V223-F262 HydrophobicContact CG2-CD2 4.1Å; V223-F262 HydrophobicContact CG2-CE2 3.98Å; F258-F262 HydrophobicContact CB-CE2 4.24Å; F258-F262 HydrophobicContact CB-CZ 4.44Å; F258-F262 HydrophobicContact CD1-CE1 4.14Å; F258-F262 HydrophobicContact CD1-CE2 4.47Å; F258-F262 AromaticContact CD1-CZ 3.85Å; F258-F262 HydrophobicContact CD1-CZ 3.85Å; F258-F262 HydrophobicContact CG-CZ 4.47Å; F258-F262 WeakPolarHBondContact O-CB 3.47Å; F258-F262 WeakPolarHBondContact O-CD2 3.33Å; F258-F262 VanDerWaalsContact O-CG 3.27Å; F258-F262 WeakPolarHBondContact O-CG 3.29Å; F258-F262 PolarHBondContact O-N 3.26Å
263	W	91.5	Very high	94.1	Very high	23 Å²	23	25.8 Å²	25.8	9%	0.087	12%	0.123	C	C	.	.			trans	-144.4	123.7	-175.2	-164.9	45.3	0	0	0	113.1	E217 A220 F259 L261 F265 N266 L269	E217-W263 HydrophobicContact CB-CZ2 4.11Å; A220-W263 HydrophobicContact CB-CB 3.44Å; A220-W263 VanDerWaalsContact CB-CB 3.44Å; A220-W263 HydrophobicContact CB-CG 4.22Å; F259-W263 HydrophobicContact CE2-CE3 4.41Å; L261-W263 PolarHBondContact O-N 2.98Å; W263-F265 HydrophobicContact CD2-CB 3.97Å; W263-F265 AromaticContact CE2-CD2 3.92Å; W263-F265 HydrophobicContact CE3-CB 4.12Å; W263-F265 HydrophobicContact CH2-CB 4Å; W263-F265 HydrophobicContact CZ2-CB 3.85Å; W263-F265 AromaticContact CZ2-CD2 3.97Å; W263-F265 HydrophobicContact CZ2-CD2 3.97Å; W263-F265 HydrophobicContact CZ2-CG 4.41Å; W263-F265 HydrophobicContact CZ3-CB 4.12Å; W263-F265 AromaticContact NE1-CD2 3.84Å; W263-F265 PolarHBondContact O-N 2.89Å; W263-N266 VanDerWaalsContact O-CB 3.25Å; W263-N266 WeakPolarHBondContact O-CB 3.3Å; W263-N266 PolarHBondContact O-N 3.24Å; W263-N266 VanDerWaalsContact O-N 3.14Å; W263-N266 PolarHBondContact O-ND2 3.09Å; W263-L269 HydrophobicContact CE3-CD1 4.4Å; W263-L269 HydrophobicContact CZ3-CD1 3.67Å; W263-L269 HydrophobicContact CZ3-CG 4.24Å
264	Q	85.2	Confident	94.1	Very high	20 Å²	20	23 Å²	23	9%	0.093	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.5	-179.8	64.5	177	-10	0	0	114.3	R216 N266 H608 E610	R216-Q264 VanDerWaalsContact NH2-CD 3.31Å; Q264-N266 VanDerWaalsContact C-N 3.27Å; Q264-N266 PolarHBondContact O-N 3.22Å; Q264-H608 PolarHBondContact NE2-NE2 3.1Å; Q264-H608 PolarHBondContact OE1-CE1 2.87Å; Q264-H608 PolarHBondContact OE1-NE2 3.36Å; Q264-H608 VanDerWaalsContact OE1-NE2 3.16Å; Q264-E610 PolarHBondContact NE2-OE1 2.89Å
265	F	84.2	Confident	94.1	Very high	66 Å²	66	21.1 Å²	21.1	29%	0.289	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	4.7	-178	-61.7	-52.3	0	0	0	113.3	W263 Q267 F268 E610	W263-F265 HydrophobicContact CD2-CB 3.97Å; W263-F265 AromaticContact CE2-CD2 3.92Å; W263-F265 HydrophobicContact CE3-CB 4.12Å; W263-F265 HydrophobicContact CH2-CB 4Å; W263-F265 HydrophobicContact CZ2-CB 3.85Å; W263-F265 AromaticContact CZ2-CD2 3.97Å; W263-F265 HydrophobicContact CZ2-CD2 3.97Å; W263-F265 HydrophobicContact CZ2-CG 4.41Å; W263-F265 HydrophobicContact CZ3-CB 4.12Å; W263-F265 AromaticContact NE1-CD2 3.84Å; W263-F265 PolarHBondContact O-N 2.89Å; F265-Q267 PolarHBondContact O-N 3.39Å; F265-Q267 VanDerWaalsContact O-N 3.09Å; F265-F268 HydrophobicContact CB-CD2 4.16Å; F265-F268 HydrophobicContact CD1-CD2 4.14Å; F265-F268 AromaticContact CD1-CE2 3.79Å; F265-F268 HydrophobicContact CD1-CE2 3.79Å; F265-F268 PolarHBondContact O-N 2.86Å; F265-F268 VanDerWaalsContact O-N 3.13Å; F265-E610 HydrophobicContact CE1-CG 4.45Å; F265-E610 HydrophobicContact CZ-CG 4.2Å
266	N	91.3	Very high	94.1	Very high	18 Å²	18	21.1 Å²	21.1	10%	0.096	10%	0.098	C	C	.	.	H	α-helix	trans	-51.5	-34.4	176.2	76.3	85.8	0	0	0	112.9	F259 A260 W263 Q264 F268 L269 L270	F259-N266 HydrophobicContact CD1-CB 4.37Å; F259-N266 HydrophobicContact CE1-CB 3.86Å; F259-N266 HydrophobicContact CE2-CB 4.31Å; F259-N266 HydrophobicContact CZ-CB 3.82Å; A260-N266 HydrophobicContact CB-CB 4.12Å; A260-N266 VanDerWaalsContact CB-CG 3.48Å; A260-N266 WeakPolarHBondContact CB-OD1 3.31Å; A260-N266 PolarHBondContact O-ND2 3.2Å; W263-N266 VanDerWaalsContact O-CB 3.25Å; W263-N266 WeakPolarHBondContact O-CB 3.3Å; W263-N266 PolarHBondContact O-N 3.24Å; W263-N266 VanDerWaalsContact O-N 3.14Å; W263-N266 PolarHBondContact O-ND2 3.09Å; Q264-N266 VanDerWaalsContact C-N 3.27Å; Q264-N266 PolarHBondContact O-N 3.22Å; N266-F268 PolarHBondContact O-N 2.98Å; N266-F268 VanDerWaalsContact O-N 3.15Å; N266-L269 PolarHBondContact O-N 3.16Å; N266-L270 PolarHBondContact O-N 2.66Å
267	Q	90.7	Very high	94.1	Very high	35 Å²	35	21.1 Å²	21.1	16%	0.164	10%	0.098	C	C	.	.	H	α-helix	trans	-56.1	-33.4	-178.1	54.6	172.9	-36.6	0	0	112.9	F265 L271 V320	F265-Q267 PolarHBondContact O-N 3.39Å; F265-Q267 VanDerWaalsContact O-N 3.09Å; Q267-L271 VanDerWaalsContact O-CB 3.25Å; Q267-L271 WeakPolarHBondContact O-CB 3.22Å; Q267-L271 PolarHBondContact O-N 3.44Å; Q267-V320 HydrophobicContact CB-CG1 3.97Å
268	F	89.8	Confident	94	Very high	68 Å²	68	20 Å²	20	30%	0.298	9%	0.093	S	C	.	.	H	α-helix	trans	-75	-38.5	178.6	-61	-61.4	0	0	0	112	F265 N266 L271 L272 I380	F265-F268 HydrophobicContact CB-CD2 4.16Å; F265-F268 HydrophobicContact CD1-CD2 4.14Å; F265-F268 AromaticContact CD1-CE2 3.79Å; F265-F268 HydrophobicContact CD1-CE2 3.79Å; F265-F268 PolarHBondContact O-N 2.86Å; F265-F268 VanDerWaalsContact O-N 3.13Å; N266-F268 PolarHBondContact O-N 2.98Å; N266-F268 VanDerWaalsContact O-N 3.15Å; F268-L271 PolarHBondContact O-N 3.09Å; F268-L272 WeakPolarHBondContact O-CB 3.29Å; F268-L272 PolarHBondContact O-N 3.07Å; F268-I380 HydrophobicContact CZ-CD1 3.77Å
269	L	93.5	Very high	93.9	Very high	7 Å²	7	19.3 Å²	19.3	4%	0.037	9%	0.094	C	C	.	.	H	α-helix	trans	-70.9	-39.8	175.1	-72.5	-174.3	0	0	0	112	L221 F259 W263 N266 L271 L272 Q273 I496	L221-L269 HydrophobicContact CD2-CD1 3.99Å; F259-L269 HydrophobicContact CE1-CB 4.3Å; F259-L269 HydrophobicContact CE2-CD1 4.16Å; F259-L269 HydrophobicContact CZ-CB 3.82Å; F259-L269 HydrophobicContact CZ-CD1 3.73Å; F259-L269 HydrophobicContact CZ-CG 4.36Å; W263-L269 HydrophobicContact CE3-CD1 4.4Å; W263-L269 HydrophobicContact CZ3-CD1 3.67Å; W263-L269 HydrophobicContact CZ3-CG 4.24Å; N266-L269 PolarHBondContact O-N 3.16Å; L269-L271 VanDerWaalsContact C-N 3.33Å; L269-L272 WeakPolarHBondContact O-CB 3.4Å; L269-L272 PolarHBondContact O-N 3.42Å; L269-Q273 WeakPolarHBondContact O-CB 3.33Å; L269-Q273 PolarHBondContact O-N 2.95Å; L269-I496 HydrophobicContact CD1-CD1 4.23Å; L269-I496 HydrophobicContact CD1-CG1 4.11Å; L269-I496 HydrophobicContact CD2-CB 4.47Å; L269-I496 HydrophobicContact CD2-CD1 3.74Å; L269-I496 HydrophobicContact CD2-CG1 4.02Å; L269-I496 HydrophobicContact CD2-CG2 3.65Å; L269-I496 HydrophobicContact CG-CD1 4.36Å
270	L	96.3	Very high	93.7	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-64.4	-38.8	172.4	-68	-177.8	0	0	0	111.4	T256 F259 A260 N266 Q273 A274 Y298 V320	T256-L270 HydrophobicContact CG2-CD1 4.46Å; T256-L270 HydrophobicContact CG2-CD2 4.17Å; F259-L270 HydrophobicContact CD1-CD2 4.05Å; F259-L270 HydrophobicContact CD1-CG 4.4Å; F259-L270 HydrophobicContact CE1-CD2 3.84Å; F259-L270 HydrophobicContact CE1-CG 3.93Å; A260-L270 HydrophobicContact CB-CD1 4.34Å; N266-L270 PolarHBondContact O-N 2.66Å; L270-Q273 PolarHBondContact O-N 3.24Å; L270-A274 WeakPolarHBondContact O-CB 3.32Å; L270-A274 PolarHBondContact O-N 3.5Å; L270-Y298 HydrophobicContact CD2-CE1 4.15Å; L270-V320 HydrophobicContact CB-CG2 4.04Å
271	L	95.7	Very high	93.6	Very high	24 Å²	24	19.9 Å²	19.9	13%	0.126	10%	0.099	C	C	.	.	H	α-helix	trans	-60.7	-47.4	171.8	178.2	64.9	0	0	0	111.3	Q267 F268 L269 Q273 A274 L275 I319 V320 F323	Q267-L271 VanDerWaalsContact O-CB 3.25Å; Q267-L271 WeakPolarHBondContact O-CB 3.22Å; Q267-L271 PolarHBondContact O-N 3.44Å; F268-L271 PolarHBondContact O-N 3.09Å; L269-L271 VanDerWaalsContact C-N 3.33Å; L271-Q273 VanDerWaalsContact C-N 3.35Å; L271-Q273 PolarHBondContact O-N 3.37Å; L271-A274 WeakPolarHBondContact O-CB 3.29Å; L271-A274 PolarHBondContact O-N 2.91Å; L271-L275 HydrophobicContact CD1-CD1 4.31Å; L271-L275 HydrophobicContact CD1-CG 4.27Å; L271-L275 HydrophobicContact CG-CD1 4.02Å; L271-L275 HydrophobicContact CG-CG 4.42Å; L271-L275 WeakPolarHBondContact O-CB 3.48Å; L271-L275 VanDerWaalsContact O-CG 3.31Å; L271-L275 WeakPolarHBondContact O-CG 3.26Å; L271-L275 PolarHBondContact O-N 3.49Å; L271-I319 HydrophobicContact CD1-CG2 3.86Å; L271-I319 HydrophobicContact CD2-CB 3.91Å; L271-I319 HydrophobicContact CD2-CD1 4.48Å; L271-I319 HydrophobicContact CD2-CG2 3.65Å; L271-I319 HydrophobicContact CG-CG2 4.41Å; L271-V320 HydrophobicContact CB-CB 4.14Å; L271-F323 HydrophobicContact CD1-CB 3.92Å; L271-F323 HydrophobicContact CD1-CD1 4Å; L271-F323 HydrophobicContact CD1-CG 3.95Å
272	L	95.1	Very high	93.5	Very high	26 Å²	26	19.7 Å²	19.7	14%	0.136	10%	0.099	C	C	.	.	H	α-helix	trans	-57.9	-48.7	178.2	-161.8	75.2	0	0	0	111	F268 L269 A274 L275 V276 F482 S483	F268-L272 WeakPolarHBondContact O-CB 3.29Å; F268-L272 PolarHBondContact O-N 3.07Å; L269-L272 WeakPolarHBondContact O-CB 3.4Å; L269-L272 PolarHBondContact O-N 3.42Å; L272-A274 VanDerWaalsContact C-N 3.32Å; L272-A274 PolarHBondContact O-N 3.43Å; L272-L275 PolarHBondContact O-N 3.04Å; L272-V276 VanDerWaalsContact O-CG2 3.27Å; L272-V276 WeakPolarHBondContact O-CG2 3.28Å; L272-V276 PolarHBondContact O-N 2.71Å; L272-F482 HydrophobicContact CD1-CB 3.7Å; L272-F482 HydrophobicContact CD1-CD2 3.98Å; L272-F482 HydrophobicContact CD1-CG 4.34Å; L272-F482 HydrophobicContact CD2-CB 4.16Å; L272-F482 HydrophobicContact CG-CB 3.88Å; L272-F482 HydrophobicContact CG-CD2 4.4Å; L272-S483 WeakPolarHBondContact CD2-OG 3.19Å
273	Q	97	Very high	93.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.7	-38.2	177	-165.9	173.2	60	0	0	111.3	N228 L269 L270 L271 V276 L277 Y298 F475 Q479	N228-Q273 PolarHBondContact OD1-NE2 3.33Å; L269-Q273 WeakPolarHBondContact O-CB 3.33Å; L269-Q273 PolarHBondContact O-N 2.95Å; L270-Q273 PolarHBondContact O-N 3.24Å; L271-Q273 VanDerWaalsContact C-N 3.35Å; L271-Q273 PolarHBondContact O-N 3.37Å; Q273-V276 PolarHBondContact O-N 2.96Å; Q273-L277 VanDerWaalsContact O-CG 3.32Å; Q273-L277 WeakPolarHBondContact O-CG 3.39Å; Q273-L277 PolarHBondContact O-N 3.05Å; Q273-Y298 VanDerWaalsContact CD-OH 3.31Å; Q273-Y298 WeakPolarHBondContact CG-OH 3.33Å; Q273-Y298 PolarHBondContact OE1-OH 2.75Å; Q273-F475 HydrophobicContact CG-CE2 3.82Å; Q273-F475 HydrophobicContact CG-CZ 3.73Å; Q273-Q479 VanDerWaalsContact NE2-OE1 3.16Å
274	A	97.7	Very high	92.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65	-44.3	175.8	0	0	0	0	0	111.7	L270 L271 L272 V276 L277 Y278 Y295 Y298 F323	L270-A274 WeakPolarHBondContact O-CB 3.32Å; L270-A274 PolarHBondContact O-N 3.5Å; L271-A274 WeakPolarHBondContact O-CB 3.29Å; L271-A274 PolarHBondContact O-N 2.91Å; L272-A274 VanDerWaalsContact C-N 3.32Å; L272-A274 PolarHBondContact O-N 3.43Å; A274-V276 VanDerWaalsContact C-N 3.33Å; A274-V276 PolarHBondContact O-N 3.46Å; A274-L277 PolarHBondContact O-N 2.81Å; A274-Y278 WeakPolarHBondContact O-CB 3.39Å; A274-Y278 PolarHBondContact O-N 3.24Å; A274-Y295 HydrophobicContact CB-CE1 3.89Å; A274-Y295 PolarHBondContact O-OH 3.44Å; A274-Y298 HydrophobicContact CB-CD2 4.39Å; A274-Y298 HydrophobicContact CB-CE2 3.99Å; A274-F323 HydrophobicContact CB-CD1 3.87Å; A274-F323 HydrophobicContact CB-CE1 3.75Å
275	L	97.2	Very high	93	Very high	55 Å²	55	23.6 Å²	23.6	29%	0.288	12%	0.115	S	C	.	.	H	α-helix	trans	-61	-41.9	175.5	-72	166.2	0	0	0	111.2	L271 L272 Y278 C279 F323 F482	L271-L275 HydrophobicContact CD1-CD1 4.31Å; L271-L275 HydrophobicContact CD1-CG 4.27Å; L271-L275 HydrophobicContact CG-CD1 4.02Å; L271-L275 HydrophobicContact CG-CG 4.42Å; L271-L275 WeakPolarHBondContact O-CB 3.48Å; L271-L275 VanDerWaalsContact O-CG 3.31Å; L271-L275 WeakPolarHBondContact O-CG 3.26Å; L271-L275 PolarHBondContact O-N 3.49Å; L272-L275 PolarHBondContact O-N 3.04Å; L275-Y278 WeakPolarHBondContact O-CB 3.47Å; L275-Y278 PolarHBondContact O-N 3.31Å; L275-C279 WeakPolarHBondContact O-CB 3.27Å; L275-C279 PolarHBondContact O-N 2.99Å; L275-C279 PolarHBondContact O-SG 2.84Å; L275-F323 HydrophobicContact CD2-CD2 4.3Å; L275-F323 HydrophobicContact CD2-CE1 4.11Å; L275-F323 HydrophobicContact CD2-CE2 3.62Å; L275-F323 HydrophobicContact CD2-CZ 3.52Å; L275-F323 HydrophobicContact CG-CE1 4.34Å; L275-F323 HydrophobicContact CG-CZ 4.21Å; L275-F482 HydrophobicContact CB-CD2 4.48Å; L275-F482 HydrophobicContact CB-CE2 4.01Å
276	V	97.3	Very high	93.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60	-50.3	174.9	167.8	0	0	0	0	111.1	L272 Q273 A274 Y278 C279 L280 F475 F478 Q479 F482	L272-V276 VanDerWaalsContact O-CG2 3.27Å; L272-V276 WeakPolarHBondContact O-CG2 3.28Å; L272-V276 PolarHBondContact O-N 2.71Å; Q273-V276 PolarHBondContact O-N 2.96Å; A274-V276 VanDerWaalsContact C-N 3.33Å; A274-V276 PolarHBondContact O-N 3.46Å; V276-Y278 VanDerWaalsContact C-N 3.26Å; V276-Y278 PolarHBondContact O-N 3.17Å; V276-C279 PolarHBondContact O-N 3.25Å; V276-L280 HydrophobicContact CG1-CD1 3.99Å; V276-L280 VanDerWaalsContact O-CG 3.28Å; V276-L280 WeakPolarHBondContact O-CG 3.5Å; V276-L280 PolarHBondContact O-N 3.48Å; V276-F475 HydrophobicContact CG1-CD2 3.8Å; V276-F475 HydrophobicContact CG1-CE2 4.11Å; V276-F478 HydrophobicContact CB-CB 4.47Å; V276-F478 HydrophobicContact CG1-CB 3.61Å; V276-F478 HydrophobicContact CG2-CB 4.24Å; V276-Q479 HydrophobicContact CG1-CB 4.49Å; V276-Q479 HydrophobicContact CG2-CB 4.29Å; V276-F482 HydrophobicContact CG2-CB 4.36Å; V276-F482 HydrophobicContact CG2-CD2 3.79Å; V276-F482 HydrophobicContact CG2-CE2 4.22Å; V276-F482 HydrophobicContact CG2-CG 4.02Å
277	L	97	Very high	93	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.4	-36.9	177.5	-69.4	168.7	0	0	0	112	L235 Q273 A274 A281 V291 I294 Y295 F475	L235-L277 HydrophobicContact CD1-CD2 4.13Å; Q273-L277 VanDerWaalsContact O-CG 3.32Å; Q273-L277 WeakPolarHBondContact O-CG 3.39Å; Q273-L277 PolarHBondContact O-N 3.05Å; A274-L277 PolarHBondContact O-N 2.81Å; L277-A281 VanDerWaalsContact O-CB 3.29Å; L277-A281 WeakPolarHBondContact O-CB 3.39Å; L277-A281 PolarHBondContact O-N 2.86Å; L277-V291 HydrophobicContact CB-CG1 4.07Å; L277-V291 HydrophobicContact CB-CG2 4.43Å; L277-V291 HydrophobicContact CD2-CG2 4.46Å; L277-I294 HydrophobicContact CD1-CB 4.17Å; L277-I294 HydrophobicContact CD1-CD1 4.04Å; L277-I294 HydrophobicContact CD1-CG2 3.59Å; L277-I294 HydrophobicContact CD2-CD1 4.05Å; L277-Y295 HydrophobicContact CB-CE1 4.12Å; L277-Y295 HydrophobicContact CD1-CE1 4.21Å; L277-F475 HydrophobicContact CD2-CD2 3.78Å; L277-F475 HydrophobicContact CD2-CE2 3.87Å; L277-F475 HydrophobicContact CG-CD2 4.33Å; L277-F475 HydrophobicContact CG-CE2 4.04Å
278	Y	97	Very high	93	Very high	10 Å²	10	24 Å²	24	4%	0.039	13%	0.125	C	C	.	.	H	α-helix	trans	-63.5	-50.4	174.7	179.8	-105.1	0	0	0	111	A274 L275 V276 L280 A281 V282 Y295 F323 A327 S330 L331 Q353 V354 T357	A274-Y278 WeakPolarHBondContact O-CB 3.39Å; A274-Y278 PolarHBondContact O-N 3.24Å; L275-Y278 WeakPolarHBondContact O-CB 3.47Å; L275-Y278 PolarHBondContact O-N 3.31Å; V276-Y278 VanDerWaalsContact C-N 3.26Å; V276-Y278 PolarHBondContact O-N 3.17Å; Y278-L280 VanDerWaalsContact C-N 3.33Å; Y278-L280 PolarHBondContact O-N 3.46Å; Y278-A281 PolarHBondContact O-N 2.78Å; Y278-A281 VanDerWaalsContact O-N 3.09Å; Y278-V282 HydrophobicContact CD1-CG2 4.13Å; Y278-V282 HydrophobicContact CD2-CG2 4.16Å; Y278-V282 HydrophobicContact CE1-CG2 3.69Å; Y278-V282 HydrophobicContact CE2-CG2 3.71Å; Y278-V282 HydrophobicContact CG-CG2 4.34Å; Y278-V282 VanDerWaalsContact CZ-CG2 3.42Å; Y278-V282 WeakPolarHBondContact O-CG2 3.42Å; Y278-V282 PolarHBondContact O-N 3.41Å; Y278-Y295 WeakPolarHBondContact CA-OH 3.24Å; Y278-Y295 VanDerWaalsContact CB-OH 3.3Å; Y278-Y295 WeakPolarHBondContact CB-OH 3.13Å; Y278-Y295 PolarHBondContact N-OH 3.48Å; Y278-F323 HydrophobicContact CD1-CZ 4.28Å; Y278-F323 HydrophobicContact CD2-CZ 4.45Å; Y278-F323 AromaticContact CG-CZ 3.94Å; Y278-F323 HydrophobicContact CG-CZ 3.94Å; Y278-A327 HydrophobicContact CD2-CB 3.83Å; Y278-A327 HydrophobicContact CE2-CB 4.32Å; Y278-S330 PolarHBondContact OH-OG 3.37Å; Y278-L331 HydrophobicContact CD2-CD1 4.15Å; Y278-L331 HydrophobicContact CD2-CD2 4.04Å; Y278-L331 HydrophobicContact CD2-CG 3.99Å; Y278-L331 HydrophobicContact CE2-CD2 3.95Å; Y278-L331 HydrophobicContact CE2-CG 4Å; Y278-Q353 PolarHBondContact OH-O 3.43Å; Y278-V354 HydrophobicContact CE1-CG2 4.18Å; Y278-T357 HydrophobicContact CE1-CG2 4.5Å; Y278-T357 HydrophobicContact CE2-CG2 4Å; Y278-T357 PolarHBondContact OH-OG1 3.37Å
279	C	94.3	Very high	93	Very high	37 Å²	37	26.1 Å²	26.1	25%	0.25	14%	0.139	C	C	.	.	H	α-helix	trans	-56	-47.4	176.5	-71.2	0	0	0	0	111.4	L275 V276 A281 V282 L283 F478	L275-C279 WeakPolarHBondContact O-CB 3.27Å; L275-C279 PolarHBondContact O-N 2.99Å; L275-C279 PolarHBondContact O-SG 2.84Å; V276-C279 PolarHBondContact O-N 3.25Å; C279-A281 VanDerWaalsContact C-N 3.3Å; C279-A281 PolarHBondContact O-N 3.36Å; C279-V282 PolarHBondContact O-N 3.27Å; C279-L283 WeakPolarHBondContact O-CB 3.37Å; C279-L283 WeakPolarHBondContact O-CG 3.35Å; C279-L283 PolarHBondContact O-N 2.96Å; C279-F478 HydrophobicContact CB-CD1 4.46Å; C279-F478 HydrophobicContact CB-CE1 4.39Å
280	L	93.2	Very high	92.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63	-36.6	177.6	-64.5	169.9	0	0	0	112.3	V276 Y278 R284 L285 V286 A474 F475 F478	V276-L280 HydrophobicContact CG1-CD1 3.99Å; V276-L280 VanDerWaalsContact O-CG 3.28Å; V276-L280 WeakPolarHBondContact O-CG 3.5Å; V276-L280 PolarHBondContact O-N 3.48Å; Y278-L280 VanDerWaalsContact C-N 3.33Å; Y278-L280 PolarHBondContact O-N 3.46Å; L280-R284 PolarHBondContact O-N 3.39Å; L280-R284 VanDerWaalsContact O-N 3.13Å; L280-L285 HydrophobicContact CD2-CB 4.28Å; L280-L285 HydrophobicContact CD2-CD1 3.82Å; L280-L285 PolarHBondContact O-N 3.23Å; L280-V286 HydrophobicContact CB-CB 4.29Å; L280-V286 HydrophobicContact CB-CG1 3.72Å; L280-V286 PolarHBondContact O-N 3.23Å; L280-A474 HydrophobicContact CD2-CB 4.01Å; L280-F475 HydrophobicContact CD1-CB 3.96Å; L280-F475 HydrophobicContact CD1-CD2 4.21Å; L280-F478 HydrophobicContact CD2-CD2 3.82Å; L280-F478 HydrophobicContact CD2-CE2 3.96Å; L280-F478 HydrophobicContact CD2-CG 4.25Å
281	A	92.8	Very high	92.8	Very high	12 Å²	12	27 Å²	27	10%	0.099	14%	0.143	C	C	.	.	H	α-helix	trans	-71	-44.5	179.1	0	0	0	0	0	112	L277 Y278 C279 L283 R284 V286 V291 L331	L277-A281 VanDerWaalsContact O-CB 3.29Å; L277-A281 WeakPolarHBondContact O-CB 3.39Å; L277-A281 PolarHBondContact O-N 2.86Å; Y278-A281 PolarHBondContact O-N 2.78Å; Y278-A281 VanDerWaalsContact O-N 3.09Å; C279-A281 VanDerWaalsContact C-N 3.3Å; C279-A281 PolarHBondContact O-N 3.36Å; A281-L283 VanDerWaalsContact C-N 3.35Å; A281-R284 WeakPolarHBondContact O-CA 3.31Å; A281-R284 PolarHBondContact O-N 2.88Å; A281-V286 HydrophobicContact CB-CG1 4.06Å; A281-V291 HydrophobicContact CB-CG1 4.4Å; A281-V291 HydrophobicContact CB-CG2 4.18Å; A281-L331 HydrophobicContact CB-CD1 3.91Å; A281-L331 HydrophobicContact CB-CD2 3.63Å; A281-L331 HydrophobicContact CB-CG 4.45Å
282	V	91.8	Very high	92.7	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.03	15%	0.145	C	C	.	.	H	α-helix	trans	-62.1	-43.2	175.5	174	0	0	0	0	110.6	Y278 C279 R284 L331 H339 T350	Y278-V282 HydrophobicContact CD1-CG2 4.13Å; Y278-V282 HydrophobicContact CD2-CG2 4.16Å; Y278-V282 HydrophobicContact CE1-CG2 3.69Å; Y278-V282 HydrophobicContact CE2-CG2 3.71Å; Y278-V282 HydrophobicContact CG-CG2 4.34Å; Y278-V282 VanDerWaalsContact CZ-CG2 3.42Å; Y278-V282 WeakPolarHBondContact O-CG2 3.42Å; Y278-V282 PolarHBondContact O-N 3.41Å; C279-V282 PolarHBondContact O-N 3.27Å; V282-R284 PolarHBondContact O-N 3.39Å; V282-R284 VanDerWaalsContact O-N 3.16Å; V282-L331 HydrophobicContact CG2-CD2 3.98Å; V282-H339 PolarHBondContact O-NE2 2.95Å; V282-T350 HydrophobicContact CG1-CG2 3.69Å
283	L	87.9	Confident	92.7	Very high	30 Å²	30	30.1 Å²	30.1	16%	0.157	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-5.3	174	-64.6	175.8	0	0	0	113.3	C279 A281 L285 L442 W446 F478	C279-L283 WeakPolarHBondContact O-CB 3.37Å; C279-L283 WeakPolarHBondContact O-CG 3.35Å; C279-L283 PolarHBondContact O-N 2.96Å; A281-L283 VanDerWaalsContact C-N 3.35Å; L283-L285 VanDerWaalsContact C-N 3.25Å; L283-L285 HydrophobicContact CB-CD1 4.06Å; L283-L285 HydrophobicContact CB-CG 3.98Å; L283-L285 HydrophobicContact CD1-CD1 4.26Å; L283-L285 PolarHBondContact O-N 2.84Å; L283-L442 HydrophobicContact CB-CD2 4.16Å; L283-L442 HydrophobicContact CD1-CD1 4.17Å; L283-L442 HydrophobicContact CD2-CD1 3.91Å; L283-L442 HydrophobicContact CD2-CD2 4.21Å; L283-L442 HydrophobicContact CG-CD1 4.46Å; L283-W446 HydrophobicContact CD2-CZ2 4.42Å; L283-F478 HydrophobicContact CD1-CE1 4.44Å; L283-F478 HydrophobicContact CD1-CZ 4.04Å
284	R	86.6	Confident	92.6	Very high	88 Å²	88	30.1 Å²	30.1	33%	0.332	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	41.3	-178.1	-59	174.6	172.7	-145.1	-15.7	112.3	L280 A281 V282 W337 K445	L280-R284 PolarHBondContact O-N 3.39Å; L280-R284 VanDerWaalsContact O-N 3.13Å; A281-R284 WeakPolarHBondContact O-CA 3.31Å; A281-R284 PolarHBondContact O-N 2.88Å; V282-R284 PolarHBondContact O-N 3.39Å; V282-R284 VanDerWaalsContact O-N 3.16Å; R284-W337 PolarHBondContact NH2-O 2.91Å; R284-K445 VanDerWaalsContact CB-NZ 3.28Å; R284-K445 PolarHBondContact O-NZ 2.94Å
285	L	86.2	Confident	92.6	Very high	14 Å²	14	30.1 Å²	30.1	7%	0.073	16%	0.155	C	C	.	.			trans	-89.8	-25.9	172.6	-63.7	175.2	0	0	0	111.5	L280 L283 I438 V471	L280-L285 HydrophobicContact CD2-CB 4.28Å; L280-L285 HydrophobicContact CD2-CD1 3.82Å; L280-L285 PolarHBondContact O-N 3.23Å; L283-L285 VanDerWaalsContact C-N 3.25Å; L283-L285 HydrophobicContact CB-CD1 4.06Å; L283-L285 HydrophobicContact CB-CG 3.98Å; L283-L285 HydrophobicContact CD1-CD1 4.26Å; L283-L285 PolarHBondContact O-N 2.84Å; L285-I438 HydrophobicContact CD1-CG2 3.86Å; L285-V471 WeakPolarHBondContact O-CG2 3.47Å
286	V	88.8	Confident	92.5	Very high	8 Å²	8	31.3 Å²	31.3	5%	0.048	16%	0.162	C	C	.	.	S	Bend	trans	-117	143	178	65.3	0	0	0	0	110.8	L235 L280 A281 L288 V291 V471	L235-V286 HydrophobicContact CD2-CG2 3.66Å; L280-V286 HydrophobicContact CB-CB 4.29Å; L280-V286 HydrophobicContact CB-CG1 3.72Å; L280-V286 PolarHBondContact O-N 3.23Å; A281-V286 HydrophobicContact CB-CG1 4.06Å; V286-L288 PolarHBondContact O-N 3.07Å; V286-V291 HydrophobicContact CB-CG2 4.28Å; V286-V291 HydrophobicContact CG1-CG2 3.35Å; V286-V291 HydrophobicContact CG2-CG2 3.89Å; V286-V471 HydrophobicContact CB-CG1 3.64Å; V286-V471 HydrophobicContact CG2-CG1 3.66Å
287	P	87.5	Confident	92.5	Very high	66 Å²	66	31.6 Å²	31.6	43%	0.429	16%	0.163	S	C	.	.			trans	-60.7	126.9	172.5	-22.7	33.2	0	0	0	111.5	L289 K290	P287-L289 VanDerWaalsContact C-N 3.25Å; P287-L289 PolarHBondContact O-N 3.07Å; P287-L289 VanDerWaalsContact O-N 3.17Å; P287-K290 HydrophobicContact CB-CG 4.29Å; P287-K290 HydrophobicContact CG-CD 4.36Å; P287-K290 WeakPolarHBondContact O-CB 3.27Å; P287-K290 PolarHBondContact O-N 2.86Å
288	L	90.6	Very high	92.5	Very high	54 Å²	54	31.6 Å²	31.6	28%	0.283	16%	0.163	S	C	.	.	H	α-helix	trans	-49.7	-45.4	-178.5	173.8	59.3	0	0	0	112.6	V286 K290 V291 L292 L331 R335	V286-L288 PolarHBondContact O-N 3.07Å; L288-K290 PolarHBondContact O-N 3.35Å; L288-V291 PolarHBondContact O-N 3.39Å; L288-V291 VanDerWaalsContact O-N 3.11Å; L288-L292 HydrophobicContact CD1-CD1 4.12Å; L288-L292 HydrophobicContact CD1-CD2 4.23Å; L288-L292 HydrophobicContact CD1-CG 3.93Å; L288-L292 HydrophobicContact CD2-CD1 4.48Å; L288-L292 HydrophobicContact CG-CD1 3.95Å; L288-L292 HydrophobicContact CG-CG 4.2Å; L288-L292 WeakPolarHBondContact O-CG 3.36Å; L288-L292 PolarHBondContact O-N 2.9Å; L288-L331 HydrophobicContact CD1-CB 3.61Å; L288-L331 HydrophobicContact CD1-CD1 4.05Å; L288-L331 HydrophobicContact CD1-CG 4.3Å; L288-R335 HydrophobicContact CD2-CB 4.06Å
289	L	90.2	Very high	92.4	Very high	111 Å²	111	33.4 Å²	33.4	58%	0.581	17%	0.173	S	C	*	.	H	α-helix	trans	-58.1	-35.9	-177.3	-175.3	63.7	0	0	0	112.6	P287 L292 F293	P287-L289 VanDerWaalsContact C-N 3.25Å; P287-L289 PolarHBondContact O-N 3.07Å; P287-L289 VanDerWaalsContact O-N 3.17Å; L289-L292 PolarHBondContact O-N 3.44Å; L289-F293 HydrophobicContact CD1-CD2 4.23Å; L289-F293 HydrophobicContact CD1-CE2 3.71Å; L289-F293 HydrophobicContact CD1-CZ 4.2Å; L289-F293 HydrophobicContact CD2-CE2 3.96Å; L289-F293 HydrophobicContact CG-CD2 3.92Å; L289-F293 HydrophobicContact CG-CE2 3.52Å; L289-F293 HydrophobicContact CG-CZ 4.44Å; L289-F293 WeakPolarHBondContact O-CD2 3.2Å; L289-F293 PolarHBondContact O-N 3.11Å
290	K	91	Very high	92.5	Very high	28 Å²	28	35.2 Å²	35.2	12%	0.122	18%	0.179	C	C	.	.	H	α-helix	trans	-68.4	-41.9	178.2	-65.8	-167.6	-179.7	-164.8	0	111.8	F234 L235 G237 P287 L288 L292 F293 I294	F234-K290 HydrophobicContact CD1-CB 4.41Å; F234-K290 HydrophobicContact CE1-CB 3.75Å; F234-K290 HydrophobicContact CE1-CD 4.44Å; F234-K290 HydrophobicContact CE1-CG 4.06Å; F234-K290 HydrophobicContact CZ-CB 4.48Å; F234-K290 HydrophobicContact CZ-CG 4.45Å; F234-K290 PolarHBondContact O-NZ 3.36Å; L235-K290 VanDerWaalsContact C-NZ 3.32Å; L235-K290 HydrophobicContact CD2-CB 4.1Å; L235-K290 HydrophobicContact CD2-CD 4.24Å; L235-K290 PolarHBondContact O-NZ 3.32Å; G237-K290 WeakPolarHBondContact O-CE 3.3Å; G237-K290 PolarHBondContact O-NZ 2.87Å; P287-K290 HydrophobicContact CB-CG 4.29Å; P287-K290 HydrophobicContact CG-CD 4.36Å; P287-K290 WeakPolarHBondContact O-CB 3.27Å; P287-K290 PolarHBondContact O-N 2.86Å; L288-K290 PolarHBondContact O-N 3.35Å; K290-L292 VanDerWaalsContact C-N 3.35Å; K290-F293 PolarHBondContact O-N 3Å; K290-I294 WeakPolarHBondContact O-CG1 3.39Å; K290-I294 PolarHBondContact O-N 3.4Å; K290-I294 VanDerWaalsContact O-N 3.07Å
291	V	94.1	Very high	92.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.2	-43	177	175.8	0	0	0	0	110.7	L277 A281 V286 L288 F293 I294 Y295 L331	L277-V291 HydrophobicContact CB-CG1 4.07Å; L277-V291 HydrophobicContact CB-CG2 4.43Å; L277-V291 HydrophobicContact CD2-CG2 4.46Å; A281-V291 HydrophobicContact CB-CG1 4.4Å; A281-V291 HydrophobicContact CB-CG2 4.18Å; V286-V291 HydrophobicContact CB-CG2 4.28Å; V286-V291 HydrophobicContact CG1-CG2 3.35Å; V286-V291 HydrophobicContact CG2-CG2 3.89Å; L288-V291 PolarHBondContact O-N 3.39Å; L288-V291 VanDerWaalsContact O-N 3.11Å; V291-F293 VanDerWaalsContact C-N 3.31Å; V291-F293 PolarHBondContact O-N 3.29Å; V291-I294 PolarHBondContact O-N 3.27Å; V291-Y295 HydrophobicContact CG1-CD1 4.46Å; V291-Y295 HydrophobicContact CG1-CD2 4.04Å; V291-Y295 HydrophobicContact CG1-CE1 4.13Å; V291-Y295 HydrophobicContact CG1-CE2 3.7Å; V291-Y295 HydrophobicContact CG1-CG 4.43Å; V291-Y295 PolarHBondContact O-N 2.91Å; V291-L331 HydrophobicContact CG1-CD1 4.07Å
292	L	94.3	Very high	92.8	Very high	34 Å²	34	35.3 Å²	35.3	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-38.1	175.5	-64.6	179.2	0	0	0	112.5	L288 L289 K290 Y295 L296 M328	L288-L292 HydrophobicContact CD1-CD1 4.12Å; L288-L292 HydrophobicContact CD1-CD2 4.23Å; L288-L292 HydrophobicContact CD1-CG 3.93Å; L288-L292 HydrophobicContact CD2-CD1 4.48Å; L288-L292 HydrophobicContact CG-CD1 3.95Å; L288-L292 HydrophobicContact CG-CG 4.2Å; L288-L292 WeakPolarHBondContact O-CG 3.36Å; L288-L292 PolarHBondContact O-N 2.9Å; L289-L292 PolarHBondContact O-N 3.44Å; K290-L292 VanDerWaalsContact C-N 3.35Å; L292-Y295 PolarHBondContact O-N 3.46Å; L292-L296 WeakPolarHBondContact O-CB 3.34Å; L292-L296 PolarHBondContact O-N 3.32Å; L292-M328 HydrophobicContact CD2-CB 4.08Å; L292-M328 HydrophobicContact CD2-CE 4.19Å; L292-M328 HydrophobicContact CD2-CG 3.85Å
293	F	93.6	Very high	92.9	Very high	81 Å²	81	39.5 Å²	39.5	36%	0.355	20%	0.2	S	C	.	.	H	α-helix	trans	-65.5	-41.9	174.2	-80.6	-57.7	0	0	0	112.8	F234 L289 K290 V291 Y295 L296 V297	F234-F293 HydrophobicContact CE1-CB 4.27Å; F234-F293 HydrophobicContact CZ-CB 3.91Å; F234-F293 HydrophobicContact CZ-CD2 4.2Å; F234-F293 HydrophobicContact CZ-CG 4.38Å; L289-F293 HydrophobicContact CD1-CD2 4.23Å; L289-F293 HydrophobicContact CD1-CE2 3.71Å; L289-F293 HydrophobicContact CD1-CZ 4.2Å; L289-F293 HydrophobicContact CD2-CE2 3.96Å; L289-F293 HydrophobicContact CG-CD2 3.92Å; L289-F293 HydrophobicContact CG-CE2 3.52Å; L289-F293 HydrophobicContact CG-CZ 4.44Å; L289-F293 WeakPolarHBondContact O-CD2 3.2Å; L289-F293 PolarHBondContact O-N 3.11Å; K290-F293 PolarHBondContact O-N 3Å; V291-F293 VanDerWaalsContact C-N 3.31Å; V291-F293 PolarHBondContact O-N 3.29Å; F293-Y295 VanDerWaalsContact C-N 3.35Å; F293-L296 WeakPolarHBondContact O-CB 3.38Å; F293-L296 PolarHBondContact O-N 3.01Å; F293-V297 PolarHBondContact O-N 3.47Å
294	I	95.4	Very high	93.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.8	-41.8	176.5	-62.8	167.5	0	0	0	110.3	V231 F234 L235 L252 L277 K290 V291 L296 V297 Y298	V231-I294 HydrophobicContact CG1-CD1 4.18Å; F234-I294 HydrophobicContact CD1-CD1 4.13Å; F234-I294 HydrophobicContact CD1-CG1 4.1Å; F234-I294 HydrophobicContact CE1-CD1 4.39Å; F234-I294 HydrophobicContact CE1-CG1 4.08Å; L235-I294 HydrophobicContact CD2-CD1 3.9Å; L235-I294 HydrophobicContact CG-CD1 4.4Å; L252-I294 HydrophobicContact CD2-CG1 4.09Å; L277-I294 HydrophobicContact CD1-CB 4.17Å; L277-I294 HydrophobicContact CD1-CD1 4.04Å; L277-I294 HydrophobicContact CD1-CG2 3.59Å; L277-I294 HydrophobicContact CD2-CD1 4.05Å; K290-I294 WeakPolarHBondContact O-CG1 3.39Å; K290-I294 PolarHBondContact O-N 3.4Å; K290-I294 VanDerWaalsContact O-N 3.07Å; V291-I294 PolarHBondContact O-N 3.27Å; I294-L296 VanDerWaalsContact C-N 3.33Å; I294-L296 PolarHBondContact O-N 3.43Å; I294-V297 WeakPolarHBondContact O-CA 3.18Å; I294-V297 WeakPolarHBondContact O-CB 3.39Å; I294-V297 PolarHBondContact O-N 2.88Å; I294-V297 VanDerWaalsContact O-N 3.12Å; I294-Y298 HydrophobicContact CG2-CD1 4.32Å; I294-Y298 HydrophobicContact CG2-CE1 3.6Å; I294-Y298 HydrophobicContact CG2-CE2 4.3Å; I294-Y298 WeakPolarHBondContact CG2-OH 3.45Å; I294-Y298 WeakPolarHBondContact O-CD1 3.3Å; I294-Y298 PolarHBondContact O-N 3.09Å
295	Y	97	Very high	93.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-36.6	175.2	-74	-5.4	0	0	0	113.1	A274 L277 Y278 V291 L292 F293 V297 Y298 I299 T324 A327 M328 L331	A274-Y295 HydrophobicContact CB-CE1 3.89Å; A274-Y295 PolarHBondContact O-OH 3.44Å; L277-Y295 HydrophobicContact CB-CE1 4.12Å; L277-Y295 HydrophobicContact CD1-CE1 4.21Å; Y278-Y295 WeakPolarHBondContact CA-OH 3.24Å; Y278-Y295 VanDerWaalsContact CB-OH 3.3Å; Y278-Y295 WeakPolarHBondContact CB-OH 3.13Å; Y278-Y295 PolarHBondContact N-OH 3.48Å; V291-Y295 HydrophobicContact CG1-CD1 4.46Å; V291-Y295 HydrophobicContact CG1-CD2 4.04Å; V291-Y295 HydrophobicContact CG1-CE1 4.13Å; V291-Y295 HydrophobicContact CG1-CE2 3.7Å; V291-Y295 HydrophobicContact CG1-CG 4.43Å; V291-Y295 PolarHBondContact O-N 2.91Å; L292-Y295 PolarHBondContact O-N 3.46Å; F293-Y295 VanDerWaalsContact C-N 3.35Å; Y295-V297 VanDerWaalsContact C-N 3.31Å; Y295-V297 PolarHBondContact O-N 3.4Å; Y295-Y298 HydrophobicContact CD1-CD2 4.17Å; Y295-Y298 HydrophobicContact CD1-CE2 4.26Å; Y295-Y298 HydrophobicContact CE1-CE2 4.48Å; Y295-Y298 WeakPolarHBondContact O-CB 3.45Å; Y295-Y298 PolarHBondContact O-N 2.81Å; Y295-Y298 VanDerWaalsContact O-N 3.16Å; Y295-I299 WeakPolarHBondContact O-CG1 3.35Å; Y295-I299 PolarHBondContact O-N 3.42Å; Y295-T324 HydrophobicContact CD1-CG2 4.1Å; Y295-T324 HydrophobicContact CD2-CG2 4.28Å; Y295-T324 HydrophobicContact CG-CG2 3.74Å; Y295-A327 HydrophobicContact CE2-CB 3.74Å; Y295-M328 HydrophobicContact CD2-CG 3.56Å; Y295-M328 HydrophobicContact CG-CG 4.22Å; Y295-L331 HydrophobicContact CE2-CD1 4.11Å
296	L	95.9	Very high	94	Very high	80 Å²	80	38.5 Å²	38.5	42%	0.419	20%	0.201	S	C	.	.	H	α-helix	trans	-61.9	-40.7	171.5	-177.5	63.7	0	0	0	111.4	L292 F293 I294 Y298 I299 I300	L292-L296 WeakPolarHBondContact O-CB 3.34Å; L292-L296 PolarHBondContact O-N 3.32Å; F293-L296 WeakPolarHBondContact O-CB 3.38Å; F293-L296 PolarHBondContact O-N 3.01Å; I294-L296 VanDerWaalsContact C-N 3.33Å; I294-L296 PolarHBondContact O-N 3.43Å; L296-Y298 VanDerWaalsContact C-N 3.29Å; L296-Y298 PolarHBondContact O-N 2.8Å; L296-I299 PolarHBondContact O-N 3.36Å; L296-I300 HydrophobicContact CD1-CD1 4.24Å; L296-I300 HydrophobicContact CD1-CG1 4.38Å; L296-I300 HydrophobicContact CG-CD1 3.91Å; L296-I300 HydrophobicContact CG-CG1 4.47Å; L296-I300 VanDerWaalsContact O-CG1 3.28Å; L296-I300 WeakPolarHBondContact O-CG1 3.36Å; L296-I300 PolarHBondContact O-N 2.95Å
297	V	96.5	Very high	94.2	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.03	23%	0.231	C	C	.	.	H	α-helix	trans	-59.1	-40.7	173.1	168.1	0	0	0	0	111.3	L249 L252 L253 T256 F293 I294 Y295 T301	L249-V297 HydrophobicContact CD1-CG2 3.67Å; L252-V297 HydrophobicContact CD2-CG2 4.33Å; L252-V297 HydrophobicContact CG-CG1 4.36Å; L253-V297 HydrophobicContact CB-CG1 4.3Å; L253-V297 HydrophobicContact CD1-CG1 3.97Å; T256-V297 HydrophobicContact CG2-CG1 4.26Å; F293-V297 PolarHBondContact O-N 3.47Å; I294-V297 WeakPolarHBondContact O-CA 3.18Å; I294-V297 WeakPolarHBondContact O-CB 3.39Å; I294-V297 PolarHBondContact O-N 2.88Å; I294-V297 VanDerWaalsContact O-N 3.12Å; Y295-V297 VanDerWaalsContact C-N 3.31Å; Y295-V297 PolarHBondContact O-N 3.4Å; V297-T301 WeakPolarHBondContact O-CB 3.28Å; V297-T301 PolarHBondContact O-N 3.13Å; V297-T301 PolarHBondContact O-OG1 3.45Å
298	Y	97.2	Very high	94.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-45.7	177.4	-65.5	-0.9	0	0	0	111.5	T256 L270 Q273 A274 I294 Y295 L296 I300 T301 I302	T256-Y298 HydrophobicContact CG2-CD1 3.93Å; T256-Y298 HydrophobicContact CG2-CE1 4.19Å; L270-Y298 HydrophobicContact CD2-CE1 4.15Å; Q273-Y298 VanDerWaalsContact CD-OH 3.31Å; Q273-Y298 WeakPolarHBondContact CG-OH 3.33Å; Q273-Y298 PolarHBondContact OE1-OH 2.75Å; A274-Y298 HydrophobicContact CB-CD2 4.39Å; A274-Y298 HydrophobicContact CB-CE2 3.99Å; I294-Y298 HydrophobicContact CG2-CD1 4.32Å; I294-Y298 HydrophobicContact CG2-CE1 3.6Å; I294-Y298 HydrophobicContact CG2-CE2 4.3Å; I294-Y298 WeakPolarHBondContact CG2-OH 3.45Å; I294-Y298 WeakPolarHBondContact O-CD1 3.3Å; I294-Y298 PolarHBondContact O-N 3.09Å; Y295-Y298 HydrophobicContact CD1-CD2 4.17Å; Y295-Y298 HydrophobicContact CD1-CE2 4.26Å; Y295-Y298 HydrophobicContact CE1-CE2 4.48Å; Y295-Y298 WeakPolarHBondContact O-CB 3.45Å; Y295-Y298 PolarHBondContact O-N 2.81Å; Y295-Y298 VanDerWaalsContact O-N 3.16Å; L296-Y298 VanDerWaalsContact C-N 3.29Å; L296-Y298 PolarHBondContact O-N 2.8Å; Y298-I300 PolarHBondContact O-N 3.42Å; Y298-T301 PolarHBondContact O-N 2.87Å; Y298-I302 WeakPolarHBondContact O-CB 3.25Å; Y298-I302 VanDerWaalsContact O-CG1 3.24Å; Y298-I302 WeakPolarHBondContact O-CG1 3.2Å; Y298-I302 PolarHBondContact O-N 2.85Å
299	I	96.2	Very high	94.5	Very high	48 Å²	48	41.2 Å²	41.2	25%	0.246	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-48	177.6	-67.7	169.3	0	0	0	110.6	Y295 L296 T301 I302 L303 T324 M328	Y295-I299 WeakPolarHBondContact O-CG1 3.35Å; Y295-I299 PolarHBondContact O-N 3.42Å; L296-I299 PolarHBondContact O-N 3.36Å; I299-T301 VanDerWaalsContact C-N 3.28Å; I299-T301 PolarHBondContact O-N 2.98Å; I299-I302 PolarHBondContact O-N 3.18Å; I299-L303 HydrophobicContact CG2-CD1 3.97Å; I299-L303 HydrophobicContact CG2-CG 4.45Å; I299-L303 VanDerWaalsContact O-CG 3.3Å; I299-L303 WeakPolarHBondContact O-CG 3.38Å; I299-L303 PolarHBondContact O-N 2.91Å; I299-T324 HydrophobicContact CD1-CG2 4.17Å; I299-T324 HydrophobicContact CG1-CG2 3.95Å; I299-M328 HydrophobicContact CD1-SD 3.63Å
300	I	96.7	Very high	94.6	Very high	75 Å²	75	41 Å²	41	39%	0.385	21%	0.21	S	C	.	.	H	α-helix	trans	-60	-41.8	177.6	-66.3	167.8	0	0	0	110.5	L253 L296 Y298 L303 A304	L253-I300 HydrophobicContact CD1-CB 4.19Å; L253-I300 HydrophobicContact CD1-CG2 3.81Å; L253-I300 HydrophobicContact CD2-CG2 4.44Å; L296-I300 HydrophobicContact CD1-CD1 4.24Å; L296-I300 HydrophobicContact CD1-CG1 4.38Å; L296-I300 HydrophobicContact CG-CD1 3.91Å; L296-I300 HydrophobicContact CG-CG1 4.47Å; L296-I300 VanDerWaalsContact O-CG1 3.28Å; L296-I300 WeakPolarHBondContact O-CG1 3.36Å; L296-I300 PolarHBondContact O-N 2.95Å; Y298-I300 PolarHBondContact O-N 3.42Å; I300-L303 PolarHBondContact O-N 2.86Å; I300-A304 VanDerWaalsContact O-CB 3.31Å; I300-A304 WeakPolarHBondContact O-CB 3.44Å; I300-A304 PolarHBondContact O-N 2.98Å
301	T	96.5	Very high	94.4	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-48.2	177.9	-60.5	0	0	0	0	111.7	T256 F257 A260 V297 Y298 I299 L303 A304 L305	T256-T301 HydrophobicContact CG2-CG2 4.1Å; F257-T301 HydrophobicContact CB-CG2 4.32Å; F257-T301 HydrophobicContact CD2-CG2 4.41Å; A260-T301 HydrophobicContact CB-CG2 4Å; V297-T301 WeakPolarHBondContact O-CB 3.28Å; V297-T301 PolarHBondContact O-N 3.13Å; V297-T301 PolarHBondContact O-OG1 3.45Å; Y298-T301 PolarHBondContact O-N 2.87Å; I299-T301 VanDerWaalsContact C-N 3.28Å; I299-T301 PolarHBondContact O-N 2.98Å; T301-L303 VanDerWaalsContact C-N 3.31Å; T301-L303 PolarHBondContact O-N 3.05Å; T301-A304 PolarHBondContact O-N 2.82Å; T301-L305 HydrophobicContact CG2-CD1 3.83Å; T301-L305 HydrophobicContact CG2-CG 4.31Å; T301-L305 WeakPolarHBondContact O-CB 3.48Å; T301-L305 VanDerWaalsContact O-CG 3.28Å; T301-L305 WeakPolarHBondContact O-CG 3.14Å; T301-L305 PolarHBondContact O-N 3.47Å
302	I	94.5	Very high	94	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.067	22%	0.218	C	C	.	.	H	α-helix	trans	-58.9	-44.1	178.7	-71.4	167.8	0	0	0	110.4	Y298 I299 L305 Y306 I315 L316 V320 A321	Y298-I302 WeakPolarHBondContact O-CB 3.25Å; Y298-I302 VanDerWaalsContact O-CG1 3.24Å; Y298-I302 WeakPolarHBondContact O-CG1 3.2Å; Y298-I302 PolarHBondContact O-N 2.85Å; I299-I302 PolarHBondContact O-N 3.18Å; I302-L305 PolarHBondContact O-N 2.82Å; I302-Y306 WeakPolarHBondContact O-CB 3.34Å; I302-Y306 PolarHBondContact O-N 3.47Å; I302-I315 HydrophobicContact CG2-CG2 3.78Å; I302-L316 HydrophobicContact CG2-CD2 4.09Å; I302-V320 HydrophobicContact CD1-CG1 4.11Å; I302-A321 HydrophobicContact CD1-CB 4.23Å; I302-A321 HydrophobicContact CG2-CB 4.27Å
303	L	94.6	Very high	93.4	Very high	94 Å²	94	41.8 Å²	41.8	49%	0.492	23%	0.225	S	C	.	.	H	α-helix	trans	-66.4	-42.3	177.1	-67.5	173.7	0	0	0	112.3	I299 I300 T301 L305 Y306 V307	I299-L303 HydrophobicContact CG2-CD1 3.97Å; I299-L303 HydrophobicContact CG2-CG 4.45Å; I299-L303 VanDerWaalsContact O-CG 3.3Å; I299-L303 WeakPolarHBondContact O-CG 3.38Å; I299-L303 PolarHBondContact O-N 2.91Å; I300-L303 PolarHBondContact O-N 2.86Å; T301-L303 VanDerWaalsContact C-N 3.31Å; T301-L303 PolarHBondContact O-N 3.05Å; L303-L305 VanDerWaalsContact C-N 3.34Å; L303-L305 PolarHBondContact O-N 3.4Å; L303-Y306 PolarHBondContact O-N 3.09Å; L303-V307 PolarHBondContact O-N 3.36Å; L303-V307 VanDerWaalsContact O-N 3.17Å
304	A	95.4	Very high	92.8	Very high	34 Å²	34	40 Å²	40	28%	0.281	22%	0.217	S	C	.	.	H	α-helix	trans	-62.5	-41.7	176.7	0	0	0	0	0	111.6	F257 I300 T301 V307 I308	F257-A304 HydrophobicContact CD2-CB 4.11Å; F257-A304 HydrophobicContact CE2-CB 4.01Å; I300-A304 VanDerWaalsContact O-CB 3.31Å; I300-A304 WeakPolarHBondContact O-CB 3.44Å; I300-A304 PolarHBondContact O-N 2.98Å; T301-A304 PolarHBondContact O-N 2.82Å; A304-V307 PolarHBondContact O-N 3.44Å; A304-I308 WeakPolarHBondContact O-CB 3.23Å; A304-I308 WeakPolarHBondContact O-CG1 3.45Å; A304-I308 PolarHBondContact O-N 3.4Å
305	L	94.6	Very high	92.4	Very high	5 Å²	5	41 Å²	41	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-41.1	175.5	-69.1	168.9	0	0	0	111.9	F257 A260 L261 T301 I302 L303 V307 I308 Q309 I315	F257-L305 HydrophobicContact CD2-CD2 4.25Å; F257-L305 HydrophobicContact CD2-CG 4.39Å; F257-L305 HydrophobicContact CE2-CD2 3.84Å; F257-L305 HydrophobicContact CE2-CG 4.24Å; A260-L305 HydrophobicContact CB-CD1 3.46Å; A260-L305 VanDerWaalsContact CB-CD1 3.46Å; L261-L305 HydrophobicContact CB-CD2 4.02Å; L261-L305 HydrophobicContact CD1-CD2 3.61Å; L261-L305 HydrophobicContact CG-CD2 4.45Å; T301-L305 HydrophobicContact CG2-CD1 3.83Å; T301-L305 HydrophobicContact CG2-CG 4.31Å; T301-L305 WeakPolarHBondContact O-CB 3.48Å; T301-L305 VanDerWaalsContact O-CG 3.28Å; T301-L305 WeakPolarHBondContact O-CG 3.14Å; T301-L305 PolarHBondContact O-N 3.47Å; I302-L305 PolarHBondContact O-N 2.82Å; L303-L305 VanDerWaalsContact C-N 3.34Å; L303-L305 PolarHBondContact O-N 3.4Å; L305-V307 PolarHBondContact O-N 2.93Å; L305-I308 PolarHBondContact O-N 2.84Å; L305-Q309 WeakPolarHBondContact O-CB 3.35Å; L305-Q309 VanDerWaalsContact O-CG 3.31Å; L305-Q309 WeakPolarHBondContact O-CG 3.23Å; L305-Q309 PolarHBondContact O-N 2.97Å; L305-I315 HydrophobicContact CB-CD1 4.08Å; L305-I315 HydrophobicContact CB-CG2 4.47Å
306	Y	92.5	Very high	91.8	Very high	72 Å²	72	41.9 Å²	41.9	28%	0.282	23%	0.228	S	C	.	.	H	α-helix	trans	-55.7	-41.7	175.2	178.5	-103.1	0	0	0	111.9	I302 L303 G311 L316	I302-Y306 WeakPolarHBondContact O-CB 3.34Å; I302-Y306 PolarHBondContact O-N 3.47Å; L303-Y306 PolarHBondContact O-N 3.09Å; Y306-G311 VanDerWaalsContact CE2-CA 3.43Å; Y306-G311 VanDerWaalsContact CE2-O 3.27Å; Y306-G311 WeakPolarHBondContact CE2-O 3.48Å; Y306-G311 VanDerWaalsContact O-CA 3.3Å; Y306-G311 WeakPolarHBondContact O-CA 3.33Å; Y306-G311 PolarHBondContact O-N 2.88Å; Y306-L316 HydrophobicContact CD1-CD1 4.43Å; Y306-L316 HydrophobicContact CD2-CD1 3.62Å; Y306-L316 HydrophobicContact CD2-CG 3.74Å; Y306-L316 HydrophobicContact CE1-CD1 4.35Å; Y306-L316 HydrophobicContact CE2-CD1 3.51Å; Y306-L316 HydrophobicContact CE2-CG 4.09Å; Y306-L316 HydrophobicContact CG-CD1 4.08Å; Y306-L316 HydrophobicContact CG-CG 4.22Å
307	V	93.9	Very high	91.2	Very high	110 Å²	110	38.3 Å²	38.3	67%	0.667	21%	0.21	S	C	*	.	H	α-helix	trans	-69.7	-49.6	176.2	176.7	0	0	0	0	111.6	L303 A304 L305 Q309 F310	L303-V307 PolarHBondContact O-N 3.36Å; L303-V307 VanDerWaalsContact O-N 3.17Å; A304-V307 PolarHBondContact O-N 3.44Å; L305-V307 PolarHBondContact O-N 2.93Å; V307-Q309 VanDerWaalsContact C-N 3.35Å; V307-Q309 PolarHBondContact O-N 3.07Å; V307-F310 PolarHBondContact O-N 3.02Å
308	I	92.6	Very high	90.9	Very high	70 Å²	70	38.1 Å²	38.1	36%	0.359	21%	0.209	S	C	.	.	H	α-helix	trans	-68.4	-35	-174.6	-72.6	171.8	0	0	0	112	Y139 F257 L261 A304 L305 F310	Y139-I308 HydrophobicContact CD1-CG2 4.39Å; Y139-I308 HydrophobicContact CE1-CG2 3.57Å; Y139-I308 PolarHBondContact OH-O 3.41Å; Y139-I308 VanDerWaalsContact OH-O 3.08Å; F257-I308 HydrophobicContact CE2-CD1 3.74Å; F257-I308 HydrophobicContact CZ-CD1 3.4Å; F257-I308 VanDerWaalsContact CZ-CD1 3.4Å; L261-I308 HydrophobicContact CD1-CG2 4.13Å; A304-I308 WeakPolarHBondContact O-CB 3.23Å; A304-I308 WeakPolarHBondContact O-CG1 3.45Å; A304-I308 PolarHBondContact O-N 3.4Å; L305-I308 PolarHBondContact O-N 2.84Å; I308-F310 PolarHBondContact O-N 3.26Å
309	Q	92	Very high	90.6	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.019	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	26.4	178.5	-55.1	-169.5	-31.3	0	0	112.2	H134 N137 Y139 L305 V307 G311 Q312 I315	H134-Q309 PolarHBondContact CD2-O 3.38Å; N137-Q309 PolarHBondContact ND2-NE2 2.96Å; Y139-Q309 HydrophobicContact CE2-CG 3.85Å; Y139-Q309 WeakPolarHBondContact OH-CA 3.37Å; L305-Q309 WeakPolarHBondContact O-CB 3.35Å; L305-Q309 VanDerWaalsContact O-CG 3.31Å; L305-Q309 WeakPolarHBondContact O-CG 3.23Å; L305-Q309 PolarHBondContact O-N 2.97Å; V307-Q309 VanDerWaalsContact C-N 3.35Å; V307-Q309 PolarHBondContact O-N 3.07Å; Q309-G311 PolarHBondContact O-N 3.46Å; Q309-Q312 HydrophobicContact CB-CB 4.12Å; Q309-Q312 WeakPolarHBondContact O-CB 3.39Å; Q309-Q312 PolarHBondContact O-N 3.4Å; Q309-Q312 VanDerWaalsContact OE1-OE1 3.07Å; Q309-I315 HydrophobicContact CB-CD1 3.96Å; Q309-I315 HydrophobicContact CG-CD1 4.29Å
310	F	91.7	Very high	90.5	Very high	108 Å²	108	38.3 Å²	38.3	47%	0.474	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	41.4	172.1	-58.7	-90.6	0	0	0	114.6	I119 N131 L133 H134 V307 I308	I119-F310 HydrophobicContact CD1-CE1 4.47Å; I119-F310 HydrophobicContact CD1-CZ 3.88Å; I119-F310 HydrophobicContact CG1-CZ 4.29Å; N131-F310 VanDerWaalsContact ND2-CD2 3.35Å; N131-F310 WeakPolarHBondContact ND2-CD2 3.23Å; N131-F310 WeakPolarHBondContact ND2-CG 3.27Å; L133-F310 HydrophobicContact CB-CE2 4.1Å; H134-F310 HydrophobicContact CB-CB 4.37Å; V307-F310 PolarHBondContact O-N 3.02Å; I308-F310 PolarHBondContact O-N 3.26Å
311	G	87.6	Confident	90.3	Very high	25 Å²	25	35.2 Å²	35.2	26%	0.258	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	25.7	175.9	0	0	0	0	0	114.1	Y306 Q309 S313	Y306-G311 VanDerWaalsContact CE2-CA 3.43Å; Y306-G311 VanDerWaalsContact CE2-O 3.27Å; Y306-G311 WeakPolarHBondContact CE2-O 3.48Å; Y306-G311 VanDerWaalsContact O-CA 3.3Å; Y306-G311 WeakPolarHBondContact O-CA 3.33Å; Y306-G311 PolarHBondContact O-N 2.88Å; Q309-G311 PolarHBondContact O-N 3.46Å; G311-S313 PolarHBondContact O-N 3.44Å
312	Q	85.6	Confident	90.2	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.042	20%	0.196	C	C	.	.			trans	-57.1	110	-178.9	-172.3	178.8	9.9	0	0	112	H134 Q309 M314 I315	H134-Q312 VanDerWaalsContact NE2-CA 3.28Å; H134-Q312 WeakPolarHBondContact NE2-CA 3.37Å; H134-Q312 PolarHBondContact O-NE2 3.18Å; H134-Q312 PolarHBondContact O-OE1 3.03Å; H134-Q312 VanDerWaalsContact O-OE1 3.09Å; Q309-Q312 HydrophobicContact CB-CB 4.12Å; Q309-Q312 WeakPolarHBondContact O-CB 3.39Å; Q309-Q312 PolarHBondContact O-N 3.4Å; Q309-Q312 VanDerWaalsContact OE1-OE1 3.07Å; Q312-M314 VanDerWaalsContact C-N 3.26Å; Q312-M314 HydrophobicContact CG-CB 4.46Å; Q312-M314 VanDerWaalsContact NE2-CE 3.34Å; Q312-M314 PolarHBondContact O-N 3.32Å; Q312-I315 HydrophobicContact CB-CD1 3.87Å; Q312-I315 HydrophobicContact CB-CG1 4.3Å; Q312-I315 HydrophobicContact CG-CD1 4.5Å; Q312-I315 HydrophobicContact CG-CG1 4.47Å; Q312-I315 WeakPolarHBondContact O-CB 3.42Å; Q312-I315 PolarHBondContact O-N 2.85Å
313	S	81.8	Confident	90.3	Very high	44 Å²	44	35.2 Å²	35.2	31%	0.308	20%	0.195	S	C	.	.	H	α-helix	trans	-66.4	-27.2	-169.9	63.3	0	0	0	0	113.1	G311 I315 L316 G317 L374	G311-S313 PolarHBondContact O-N 3.44Å; S313-I315 PolarHBondContact O-N 3.46Å; S313-L316 PolarHBondContact O-N 3.22Å; S313-G317 PolarHBondContact O-N 3.21Å; S313-L374 WeakPolarHBondContact OG-CD2 3.41Å
314	M	80.6	Confident	90.4	Very high	42 Å²	42	30.8 Å²	30.8	21%	0.207	17%	0.172	C	C	.	.	H	α-helix	trans	-60.4	-28	176.7	-65.5	-163.7	-71.2	0	0	113.4	Q312 G317 S318 A376	Q312-M314 VanDerWaalsContact C-N 3.26Å; Q312-M314 HydrophobicContact CG-CB 4.46Å; Q312-M314 VanDerWaalsContact NE2-CE 3.34Å; Q312-M314 PolarHBondContact O-N 3.32Å; M314-G317 PolarHBondContact O-N 3.34Å; M314-S318 PolarHBondContact O-N 2.87Å; M314-S318 VanDerWaalsContact O-N 3.09Å; M314-A376 HydrophobicContact CG-CB 4.09Å; M314-A376 HydrophobicContact SD-CB 3.66Å
315	I	86.1	Confident	90.5	Very high	21 Å²	21	31.6 Å²	31.6	11%	0.108	18%	0.175	C	C	.	.	H	α-helix	trans	-66.5	-46.2	179.3	-61.1	165.8	0	0	0	110.7	I302 L305 Q309 Q312 S313 G317 S318	I302-I315 HydrophobicContact CG2-CG2 3.78Å; L305-I315 HydrophobicContact CB-CD1 4.08Å; L305-I315 HydrophobicContact CB-CG2 4.47Å; Q309-I315 HydrophobicContact CB-CD1 3.96Å; Q309-I315 HydrophobicContact CG-CD1 4.29Å; Q312-I315 HydrophobicContact CB-CD1 3.87Å; Q312-I315 HydrophobicContact CB-CG1 4.3Å; Q312-I315 HydrophobicContact CG-CD1 4.5Å; Q312-I315 HydrophobicContact CG-CG1 4.47Å; Q312-I315 WeakPolarHBondContact O-CB 3.42Å; Q312-I315 PolarHBondContact O-N 2.85Å; S313-I315 PolarHBondContact O-N 3.46Å; I315-G317 VanDerWaalsContact C-N 3.33Å; I315-S318 VanDerWaalsContact O-CB 3.28Å; I315-S318 WeakPolarHBondContact O-CB 3.38Å; I315-S318 PolarHBondContact O-N 2.96Å; I315-S318 PolarHBondContact O-OG 2.89Å
316	L	85.3	Confident	90.6	Very high	20 Å²	20	31.5 Å²	31.5	11%	0.105	17%	0.174	C	C	.	.	H	α-helix	trans	-75.3	-26	177.1	-62.5	-179.3	0	0	0	112	I302 Y306 S313 S318 F372	I302-L316 HydrophobicContact CG2-CD2 4.09Å; Y306-L316 HydrophobicContact CD1-CD1 4.43Å; Y306-L316 HydrophobicContact CD2-CD1 3.62Å; Y306-L316 HydrophobicContact CD2-CG 3.74Å; Y306-L316 HydrophobicContact CE1-CD1 4.35Å; Y306-L316 HydrophobicContact CE2-CD1 3.51Å; Y306-L316 HydrophobicContact CE2-CG 4.09Å; Y306-L316 HydrophobicContact CG-CD1 4.08Å; Y306-L316 HydrophobicContact CG-CG 4.22Å; S313-L316 PolarHBondContact O-N 3.22Å; L316-S318 PolarHBondContact O-N 3.11Å; L316-F372 HydrophobicContact CB-CD2 4.45Å; L316-F372 HydrophobicContact CB-CE2 4.18Å; L316-F372 HydrophobicContact CD1-CE1 4.21Å; L316-F372 HydrophobicContact CD1-CE2 3.81Å; L316-F372 HydrophobicContact CD1-CZ 3.57Å
317	G	83.9	Confident	90.8	Very high	4 Å²	4	28.1 Å²	28.1	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-70.5	-16.1	171.5	0	0	0	0	0	115.6	S313 M314 I315	S313-G317 PolarHBondContact O-N 3.21Å; M314-G317 PolarHBondContact O-N 3.34Å; I315-G317 VanDerWaalsContact C-N 3.33Å
318	S	88.7	Confident	90.9	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	14%	0.141	C	C	.	.	S	Bend	trans	-59.2	146.1	-176	69	0	0	0	0	112.5	M314 I315 L316 V320 A321 S322	M314-S318 PolarHBondContact O-N 2.87Å; M314-S318 VanDerWaalsContact O-N 3.09Å; I315-S318 VanDerWaalsContact O-CB 3.28Å; I315-S318 WeakPolarHBondContact O-CB 3.38Å; I315-S318 PolarHBondContact O-N 2.96Å; I315-S318 PolarHBondContact O-OG 2.89Å; L316-S318 PolarHBondContact O-N 3.11Å; S318-V320 PolarHBondContact O-N 3.32Å; S318-V320 WeakPolarHBondContact OG-CG1 3.43Å; S318-A321 WeakPolarHBondContact O-CB 3.48Å; S318-A321 PolarHBondContact O-N 3.05Å; S318-A321 VanDerWaalsContact O-N 3.12Å; S318-A321 WeakPolarHBondContact OG-CB 3.14Å; S318-A321 PolarHBondContact OG-N 2.88Å; S318-S322 PolarHBondContact O-N 3.1Å
319	I	91.3	Very high	91.1	Very high	48 Å²	48	25.6 Å²	25.6	25%	0.246	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-32.1	176.3	-58.2	172.3	0	0	0	110.6	L271 A321 S322 F323 K365 Y381	L271-I319 HydrophobicContact CD1-CG2 3.86Å; L271-I319 HydrophobicContact CD2-CB 3.91Å; L271-I319 HydrophobicContact CD2-CD1 4.48Å; L271-I319 HydrophobicContact CD2-CG2 3.65Å; L271-I319 HydrophobicContact CG-CG2 4.41Å; I319-A321 VanDerWaalsContact C-N 3.34Å; I319-A321 PolarHBondContact O-N 3.29Å; I319-S322 PolarHBondContact O-N 2.98Å; I319-S322 PolarHBondContact O-OG 3.04Å; I319-S322 VanDerWaalsContact O-OG 3.09Å; I319-F323 WeakPolarHBondContact O-CB 3.33Å; I319-F323 PolarHBondContact O-N 3.38Å; I319-K365 HydrophobicContact CG1-CD 4.19Å; I319-Y381 WeakPolarHBondContact CD1-OH 3.19Å
320	V	94.3	Very high	91.3	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.018	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-34.7	176.5	65.1	0	0	0	0	112.2	Q267 L270 L271 I302 S318 T324	Q267-V320 HydrophobicContact CB-CG1 3.97Å; L270-V320 HydrophobicContact CB-CG2 4.04Å; L271-V320 HydrophobicContact CB-CB 4.14Å; I302-V320 HydrophobicContact CD1-CG1 4.11Å; S318-V320 PolarHBondContact O-N 3.32Å; S318-V320 WeakPolarHBondContact OG-CG1 3.43Å; V320-T324 VanDerWaalsContact O-CB 3.3Å; V320-T324 WeakPolarHBondContact O-CB 3.34Å; V320-T324 PolarHBondContact O-N 3.23Å; V320-T324 PolarHBondContact O-OG1 2.94Å
321	A	93.5	Very high	91.5	Very high	11 Å²	11	20.7 Å²	20.7	9%	0.091	12%	0.122	C	C	.	.	H	α-helix	trans	-66.9	-34.8	176.9	0	0	0	0	0	112.6	I302 S318 I319 P325	I302-A321 HydrophobicContact CD1-CB 4.23Å; I302-A321 HydrophobicContact CG2-CB 4.27Å; S318-A321 WeakPolarHBondContact O-CB 3.48Å; S318-A321 PolarHBondContact O-N 3.05Å; S318-A321 VanDerWaalsContact O-N 3.12Å; S318-A321 WeakPolarHBondContact OG-CB 3.14Å; S318-A321 PolarHBondContact OG-N 2.88Å; I319-A321 VanDerWaalsContact C-N 3.34Å; I319-A321 PolarHBondContact O-N 3.29Å; A321-P325 WeakPolarHBondContact O-CD 3.38Å; A321-P325 VanDerWaalsContact O-CG 3.24Å; A321-P325 WeakPolarHBondContact O-CG 3.36Å
322	S	94.4	Very high	91.7	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-82.8	-38.9	174	63.1	0	0	0	0	113.1	S318 I319 P325 A326	S318-S322 PolarHBondContact O-N 3.1Å; I319-S322 PolarHBondContact O-N 2.98Å; I319-S322 PolarHBondContact O-OG 3.04Å; I319-S322 VanDerWaalsContact O-OG 3.09Å; S322-P325 WeakPolarHBondContact O-CD 3.2Å; S322-P325 WeakPolarHBondContact O-CG 3.31Å; S322-A326 WeakPolarHBondContact O-CB 3.45Å; S322-A326 PolarHBondContact O-N 2.9Å
323	F	96.9	Very high	92.1	Very high	13 Å²	13	28.4 Å²	28.4	6%	0.057	15%	0.152	C	C	.	.	H	α-helix	trans	-67.7	-43.9	-177.4	175.9	-100.1	0	0	0	112.5	L271 A274 L275 Y278 I319 A326 A327 T357 T361	L271-F323 HydrophobicContact CD1-CB 3.92Å; L271-F323 HydrophobicContact CD1-CD1 4Å; L271-F323 HydrophobicContact CD1-CG 3.95Å; A274-F323 HydrophobicContact CB-CD1 3.87Å; A274-F323 HydrophobicContact CB-CE1 3.75Å; L275-F323 HydrophobicContact CD2-CD2 4.3Å; L275-F323 HydrophobicContact CD2-CE1 4.11Å; L275-F323 HydrophobicContact CD2-CE2 3.62Å; L275-F323 HydrophobicContact CD2-CZ 3.52Å; L275-F323 HydrophobicContact CG-CE1 4.34Å; L275-F323 HydrophobicContact CG-CZ 4.21Å; Y278-F323 HydrophobicContact CD1-CZ 4.28Å; Y278-F323 HydrophobicContact CD2-CZ 4.45Å; Y278-F323 AromaticContact CG-CZ 3.94Å; Y278-F323 HydrophobicContact CG-CZ 3.94Å; I319-F323 WeakPolarHBondContact O-CB 3.33Å; I319-F323 PolarHBondContact O-N 3.38Å; F323-A326 PolarHBondContact O-N 3.21Å; F323-A327 HydrophobicContact CD1-CB 4.39Å; F323-A327 HydrophobicContact CE1-CB 3.96Å; F323-A327 HydrophobicContact CE2-CB 4.31Å; F323-A327 HydrophobicContact CZ-CB 3.91Å; F323-A327 WeakPolarHBondContact O-CB 3.23Å; F323-A327 PolarHBondContact O-N 3.41Å; F323-T357 HydrophobicContact CE2-CG2 4.05Å; F323-T361 HydrophobicContact CB-CG2 3.87Å; F323-T361 HydrophobicContact CD2-CG2 4.27Å
324	T	96.5	Very high	92.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.6	-53.9	-175.3	-55.8	0	0	0	0	113	Y295 I299 V320 A326 A327 M328	Y295-T324 HydrophobicContact CD1-CG2 4.1Å; Y295-T324 HydrophobicContact CD2-CG2 4.28Å; Y295-T324 HydrophobicContact CG-CG2 3.74Å; I299-T324 HydrophobicContact CD1-CG2 4.17Å; I299-T324 HydrophobicContact CG1-CG2 3.95Å; V320-T324 VanDerWaalsContact O-CB 3.3Å; V320-T324 WeakPolarHBondContact O-CB 3.34Å; V320-T324 PolarHBondContact O-N 3.23Å; V320-T324 PolarHBondContact O-OG1 2.94Å; T324-A326 PolarHBondContact O-N 3.37Å; T324-A327 PolarHBondContact O-N 3.02Å; T324-M328 WeakPolarHBondContact O-CG 3.41Å; T324-M328 PolarHBondContact O-N 2.87Å
325	P	95.8	Very high	93	Very high	52 Å²	52	31.5 Å²	31.5	34%	0.338	16%	0.156	S	C	.	.	H	α-helix	trans	-65.7	-36.7	176.4	25.6	-33.9	0	0	0	112.8	A321 S322 A327 M328 L329	A321-P325 WeakPolarHBondContact O-CD 3.38Å; A321-P325 VanDerWaalsContact O-CG 3.24Å; A321-P325 WeakPolarHBondContact O-CG 3.36Å; S322-P325 WeakPolarHBondContact O-CD 3.2Å; S322-P325 WeakPolarHBondContact O-CG 3.31Å; P325-A327 PolarHBondContact O-N 3.09Å; P325-M328 PolarHBondContact O-N 3.31Å; P325-L329 WeakPolarHBondContact O-CB 3.25Å; P325-L329 PolarHBondContact O-N 3.49Å
326	A	96.8	Very high	92.9	Very high	3 Å²	3	40 Å²	40	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-42.7	175.7	0	0	0	0	0	112.1	S322 F323 T324 L329 S330 V360 T361	S322-A326 WeakPolarHBondContact O-CB 3.45Å; S322-A326 PolarHBondContact O-N 2.9Å; F323-A326 PolarHBondContact O-N 3.21Å; T324-A326 PolarHBondContact O-N 3.37Å; A326-L329 PolarHBondContact O-N 3.48Å; A326-S330 WeakPolarHBondContact O-CB 3.46Å; A326-S330 PolarHBondContact O-N 3.04Å; A326-V360 HydrophobicContact CB-CB 4.12Å; A326-V360 HydrophobicContact CB-CG1 3.65Å; A326-T361 WeakPolarHBondContact CB-OG1 3.46Å
327	A	97.3	Very high	92.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.5	-42.4	175.4	0	0	0	0	0	111.4	Y278 Y295 F323 T324 P325 L329 S330 L331 T357	Y278-A327 HydrophobicContact CD2-CB 3.83Å; Y278-A327 HydrophobicContact CE2-CB 4.32Å; Y295-A327 HydrophobicContact CE2-CB 3.74Å; F323-A327 HydrophobicContact CD1-CB 4.39Å; F323-A327 HydrophobicContact CE1-CB 3.96Å; F323-A327 HydrophobicContact CE2-CB 4.31Å; F323-A327 HydrophobicContact CZ-CB 3.91Å; F323-A327 WeakPolarHBondContact O-CB 3.23Å; F323-A327 PolarHBondContact O-N 3.41Å; T324-A327 PolarHBondContact O-N 3.02Å; P325-A327 PolarHBondContact O-N 3.09Å; A327-L329 PolarHBondContact O-N 3.12Å; A327-S330 PolarHBondContact O-N 3.46Å; A327-L331 VanDerWaalsContact O-CB 3.32Å; A327-L331 WeakPolarHBondContact O-CB 3.41Å; A327-L331 WeakPolarHBondContact O-CG 3.43Å; A327-L331 PolarHBondContact O-N 2.95Å; A327-T357 HydrophobicContact CB-CG2 4.31Å
328	M	96.7	Very high	92.2	Very high	49 Å²	49	46.7 Å²	46.7	24%	0.241	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-47.1	173.4	-71	178.5	74.1	0	0	111.8	L292 Y295 I299 T324 P325 L331 F332	L292-M328 HydrophobicContact CD2-CB 4.08Å; L292-M328 HydrophobicContact CD2-CE 4.19Å; L292-M328 HydrophobicContact CD2-CG 3.85Å; Y295-M328 HydrophobicContact CD2-CG 3.56Å; Y295-M328 HydrophobicContact CG-CG 4.22Å; I299-M328 HydrophobicContact CD1-SD 3.63Å; T324-M328 WeakPolarHBondContact O-CG 3.41Å; T324-M328 PolarHBondContact O-N 2.87Å; P325-M328 PolarHBondContact O-N 3.31Å; M328-L331 PolarHBondContact O-N 2.86Å; M328-F332 WeakPolarHBondContact O-CB 3.43Å; M328-F332 PolarHBondContact O-N 3.23Å
329	L	96.1	Very high	91.1	Very high	79 Å²	79	47.2 Å²	47.2	41%	0.414	22%	0.219	S	C	.	.	H	α-helix	trans	-60.9	-50.2	178.2	178.2	62.6	0	0	0	111.1	P325 A326 A327 F332 L333 V360	P325-L329 WeakPolarHBondContact O-CB 3.25Å; P325-L329 PolarHBondContact O-N 3.49Å; A326-L329 PolarHBondContact O-N 3.48Å; A327-L329 PolarHBondContact O-N 3.12Å; L329-F332 PolarHBondContact O-N 2.71Å; L329-L333 HydrophobicContact CD1-CD1 3.87Å; L329-L333 HydrophobicContact CD1-CD2 4.49Å; L329-L333 HydrophobicContact CD1-CG 3.98Å; L329-L333 HydrophobicContact CG-CD1 3.89Å; L329-L333 HydrophobicContact CG-CG 4.35Å; L329-L333 WeakPolarHBondContact O-CB 3.41Å; L329-L333 VanDerWaalsContact O-CG 3.32Å; L329-L333 WeakPolarHBondContact O-CG 3.45Å; L329-L333 PolarHBondContact O-N 3.45Å; L329-V360 HydrophobicContact CD2-CG1 4.37Å
330	S	96.2	Very high	89.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-55.4	-54.5	176.4	171.1	0	0	0	0	111.6	Y278 A326 A327 F332 L333 F334 Q353 T357	Y278-S330 PolarHBondContact OH-OG 3.37Å; A326-S330 WeakPolarHBondContact O-CB 3.46Å; A326-S330 PolarHBondContact O-N 3.04Å; A327-S330 PolarHBondContact O-N 3.46Å; S330-F332 PolarHBondContact O-N 3.17Å; S330-L333 PolarHBondContact O-N 3.35Å; S330-F334 WeakPolarHBondContact O-CD2 3.45Å; S330-F334 PolarHBondContact O-N 3.25Å; S330-Q353 WeakPolarHBondContact OG-CG 3.11Å; S330-T357 WeakPolarHBondContact CB-OG1 3.35Å; S330-T357 PolarHBondContact OG-OG1 3.5Å
331	L	95	Very high	88.4	Confident	8 Å²	8	50.1 Å²	50.1	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-60.2	-33.4	-179.3	-69.6	174.6	0	0	0	112.5	Y278 A281 V282 L288 V291 Y295 A327 M328 R335	Y278-L331 HydrophobicContact CD2-CD1 4.15Å; Y278-L331 HydrophobicContact CD2-CD2 4.04Å; Y278-L331 HydrophobicContact CD2-CG 3.99Å; Y278-L331 HydrophobicContact CE2-CD2 3.95Å; Y278-L331 HydrophobicContact CE2-CG 4Å; A281-L331 HydrophobicContact CB-CD1 3.91Å; A281-L331 HydrophobicContact CB-CD2 3.63Å; A281-L331 HydrophobicContact CB-CG 4.45Å; V282-L331 HydrophobicContact CG2-CD2 3.98Å; L288-L331 HydrophobicContact CD1-CB 3.61Å; L288-L331 HydrophobicContact CD1-CD1 4.05Å; L288-L331 HydrophobicContact CD1-CG 4.3Å; V291-L331 HydrophobicContact CG1-CD1 4.07Å; Y295-L331 HydrophobicContact CE2-CD1 4.11Å; A327-L331 VanDerWaalsContact O-CB 3.32Å; A327-L331 WeakPolarHBondContact O-CB 3.41Å; A327-L331 WeakPolarHBondContact O-CG 3.43Å; A327-L331 PolarHBondContact O-N 2.95Å; M328-L331 PolarHBondContact O-N 2.86Å; L331-R335 WeakPolarHBondContact O-CB 3.35Å; L331-R335 PolarHBondContact O-N 3.5Å
332	F	93.3	Very high	87.6	Confident	101 Å²	101	51 Å²	51	44%	0.443	26%	0.262	S	S	.	.	H	α-helix	trans	-72.8	-46.6	176.1	-174.8	-96.1	0	0	0	112.8	M328 L329 S330 R335	M328-F332 WeakPolarHBondContact O-CB 3.43Å; M328-F332 PolarHBondContact O-N 3.23Å; L329-F332 PolarHBondContact O-N 2.71Å; S330-F332 PolarHBondContact O-N 3.17Å; F332-R335 WeakPolarHBondContact O-CB 3.23Å; F332-R335 VanDerWaalsContact O-CD 3.29Å; F332-R335 WeakPolarHBondContact O-CD 2.81Å; F332-R335 WeakPolarHBondContact O-CG 3.44Å; F332-R335 PolarHBondContact O-N 3.31Å
333	L	93.5	Very high	86.8	Confident	95 Å²	95	54.5 Å²	54.5	50%	0.497	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-45.1	180	-70.7	176.5	0	0	0	111.4	L329 S330 R335 F356	L329-L333 HydrophobicContact CD1-CD1 3.87Å; L329-L333 HydrophobicContact CD1-CD2 4.49Å; L329-L333 HydrophobicContact CD1-CG 3.98Å; L329-L333 HydrophobicContact CG-CD1 3.89Å; L329-L333 HydrophobicContact CG-CG 4.35Å; L329-L333 WeakPolarHBondContact O-CB 3.41Å; L329-L333 VanDerWaalsContact O-CG 3.32Å; L329-L333 WeakPolarHBondContact O-CG 3.45Å; L329-L333 PolarHBondContact O-N 3.45Å; S330-L333 PolarHBondContact O-N 3.35Å; L333-R335 VanDerWaalsContact C-N 3.29Å; L333-R335 PolarHBondContact O-N 3.39Å; L333-F356 HydrophobicContact CD1-CE1 4.12Å; L333-F356 HydrophobicContact CD1-CZ 3.89Å
334	F	91.7	Very high	86.2	Confident	27 Å²	27	59.4 Å²	59.4	12%	0.118	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-86.7	7.7	-178.4	-61.7	-70.6	0	0	0	113.5	S330 R336 W337 Q353 F356	S330-F334 WeakPolarHBondContact O-CD2 3.45Å; S330-F334 PolarHBondContact O-N 3.25Å; F334-R336 PolarHBondContact O-N 3.33Å; F334-W337 HydrophobicContact CB-CG 4.47Å; F334-W337 AromaticContact CD1-CD2 3.4Å; F334-W337 HydrophobicContact CD1-CD2 3.4Å; F334-W337 VanDerWaalsContact CD1-CD2 3.4Å; F334-W337 AromaticContact CD1-CE2 3.48Å; F334-W337 VanDerWaalsContact CD1-CE2 3.48Å; F334-W337 AromaticContact CD1-CE3 3.48Å; F334-W337 HydrophobicContact CD1-CE3 3.48Å; F334-W337 VanDerWaalsContact CD1-CE3 3.48Å; F334-W337 HydrophobicContact CD1-CG 4.02Å; F334-W337 AromaticContact CD1-CH2 3.79Å; F334-W337 HydrophobicContact CD1-CH2 3.79Å; F334-W337 AromaticContact CD1-CZ2 3.7Å; F334-W337 HydrophobicContact CD1-CZ2 3.7Å; F334-W337 AromaticContact CD1-CZ3 3.67Å; F334-W337 HydrophobicContact CD1-CZ3 3.67Å; F334-W337 HydrophobicContact CE1-CD2 4.04Å; F334-W337 AromaticContact CE1-CE2 3.74Å; F334-W337 AromaticContact CE1-CE3 3.97Å; F334-W337 HydrophobicContact CE1-CE3 3.97Å; F334-W337 AromaticContact CE1-CH2 3.38Å; F334-W337 HydrophobicContact CE1-CH2 3.38Å; F334-W337 AromaticContact CE1-CZ2 3.44Å; F334-W337 HydrophobicContact CE1-CZ2 3.44Å; F334-W337 VanDerWaalsContact CE1-CZ2 3.44Å; F334-W337 AromaticContact CE1-CZ3 3.64Å; F334-W337 HydrophobicContact CE1-CZ3 3.64Å; F334-W337 HydrophobicContact CG-CD2 4.41Å; F334-W337 HydrophobicContact CG-CE3 4.39Å; F334-W337 HydrophobicContact CZ-CH2 4.46Å; F334-W337 WeakPolarHBondContact O-CB 3.48Å; F334-W337 PolarHBondContact O-N 3.13Å; F334-Q353 HydrophobicContact CB-CG 4.2Å; F334-Q353 HydrophobicContact CD2-CB 4.18Å; F334-Q353 HydrophobicContact CD2-CG 3.58Å; F334-Q353 HydrophobicContact CE2-CB 4.46Å; F334-Q353 HydrophobicContact CE2-CG 4.16Å; F334-Q353 HydrophobicContact CG-CB 4.34Å; F334-Q353 HydrophobicContact CG-CG 3.96Å; F334-F356 HydrophobicContact CE2-CB 4.18Å; F334-F356 AromaticContact CE2-CD1 3.57Å; F334-F356 HydrophobicContact CE2-CD1 3.57Å; F334-F356 HydrophobicContact CE2-CE1 4.04Å; F334-F356 AromaticContact CE2-CG 3.84Å; F334-F356 HydrophobicContact CE2-CG 3.84Å; F334-F356 HydrophobicContact CZ-CB 4.33Å; F334-F356 HydrophobicContact CZ-CD1 4.27Å; F334-F356 HydrophobicContact CZ-CD2 4.47Å; F334-F356 HydrophobicContact CZ-CG 4.1Å
335	R	89.2	Confident	85.6	Confident	125 Å²	125	62 Å²	62	47%	0.472	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-55.6	-31.4	-177.4	74.9	-173.1	172.5	163	-3.9	114.2	L288 L331 F332 L333	L288-R335 HydrophobicContact CD2-CB 4.06Å; L331-R335 WeakPolarHBondContact O-CB 3.35Å; L331-R335 PolarHBondContact O-N 3.5Å; F332-R335 WeakPolarHBondContact O-CB 3.23Å; F332-R335 VanDerWaalsContact O-CD 3.29Å; F332-R335 WeakPolarHBondContact O-CD 2.81Å; F332-R335 WeakPolarHBondContact O-CG 3.44Å; F332-R335 PolarHBondContact O-N 3.31Å; L333-R335 VanDerWaalsContact C-N 3.29Å; L333-R335 PolarHBondContact O-N 3.39Å
336	R	85.3	Confident	84.9	Confident	198 Å²	198	59.5 Å²	59.5	75%	0.747	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-87.8	-12.1	-178.8	-67.4	-174	-178.6	166.4	-0.1	113.3	F334 T338	F334-R336 PolarHBondContact O-N 3.33Å; R336-T338 PolarHBondContact O-N 3.35Å
337	W	82.6	Confident	84.3	Confident	97 Å²	97	64.8 Å²	64.8	37%	0.367	33%	0.334	S	S	.	.			trans	-71.1	101.8	-177.2	-84.2	23.1	0	0	0	111.6	R284 F334 K349 I352	R284-W337 PolarHBondContact NH2-O 2.91Å; F334-W337 HydrophobicContact CB-CG 4.47Å; F334-W337 AromaticContact CD1-CD2 3.4Å; F334-W337 HydrophobicContact CD1-CD2 3.4Å; F334-W337 VanDerWaalsContact CD1-CD2 3.4Å; F334-W337 AromaticContact CD1-CE2 3.48Å; F334-W337 VanDerWaalsContact CD1-CE2 3.48Å; F334-W337 AromaticContact CD1-CE3 3.48Å; F334-W337 HydrophobicContact CD1-CE3 3.48Å; F334-W337 VanDerWaalsContact CD1-CE3 3.48Å; F334-W337 HydrophobicContact CD1-CG 4.02Å; F334-W337 AromaticContact CD1-CH2 3.79Å; F334-W337 HydrophobicContact CD1-CH2 3.79Å; F334-W337 AromaticContact CD1-CZ2 3.7Å; F334-W337 HydrophobicContact CD1-CZ2 3.7Å; F334-W337 AromaticContact CD1-CZ3 3.67Å; F334-W337 HydrophobicContact CD1-CZ3 3.67Å; F334-W337 HydrophobicContact CE1-CD2 4.04Å; F334-W337 AromaticContact CE1-CE2 3.74Å; F334-W337 AromaticContact CE1-CE3 3.97Å; F334-W337 HydrophobicContact CE1-CE3 3.97Å; F334-W337 AromaticContact CE1-CH2 3.38Å; F334-W337 HydrophobicContact CE1-CH2 3.38Å; F334-W337 AromaticContact CE1-CZ2 3.44Å; F334-W337 HydrophobicContact CE1-CZ2 3.44Å; F334-W337 VanDerWaalsContact CE1-CZ2 3.44Å; F334-W337 AromaticContact CE1-CZ3 3.64Å; F334-W337 HydrophobicContact CE1-CZ3 3.64Å; F334-W337 HydrophobicContact CG-CD2 4.41Å; F334-W337 HydrophobicContact CG-CE3 4.39Å; F334-W337 HydrophobicContact CZ-CH2 4.46Å; F334-W337 WeakPolarHBondContact O-CB 3.48Å; F334-W337 PolarHBondContact O-N 3.13Å; W337-K349 HydrophobicContact CE3-CB 3.95Å; W337-K349 HydrophobicContact CE3-CG 4.05Å; W337-K349 HydrophobicContact CZ3-CB 4.09Å; W337-K349 HydrophobicContact CZ3-CG 4.16Å; W337-I352 HydrophobicContact CH2-CG2 3.92Å; W337-I352 HydrophobicContact CZ3-CB 4.37Å; W337-I352 HydrophobicContact CZ3-CG2 4.13Å
338	T	71	Confident	83.9	Confident	68 Å²	68	69.4 Å²	69.4	42%	0.417	36%	0.357	S	S	.	.			trans	-71.3	138.2	171.3	58.6	0	0	0	0	109.6	R336 S340 K349	R336-T338 PolarHBondContact O-N 3.35Å; T338-S340 PolarHBondContact O-N 3.47Å; T338-K349 WeakPolarHBondContact O-CD 3.17Å; T338-K349 PolarHBondContact O-NZ 3.26Å
339	H	66.3	Low	83.4	Confident	13 Å²	13	69.8 Å²	69.8	6%	0.06	36%	0.358	C	S	.	.			trans	-76	14.4	167.1	-62	-89.5	0	0	0	112	V282 G346 T350 W446	V282-H339 PolarHBondContact O-NE2 2.95Å; H339-G346 PolarHBondContact ND1-O 3.23Å; H339-G346 VanDerWaalsContact ND1-O 3.07Å; H339-T350 PolarHBondContact CE1-OG1 3.09Å; H339-T350 PolarHBondContact ND1-OG1 3.28Å; H339-W446 AromaticContact CG-NE1 3.7Å; H339-W446 AromaticContact ND1-NE1 3.98Å
340	S	62.1	Low	83	Confident	58 Å²	58	67 Å²	67	41%	0.406	34%	0.344	S	S	.	.			trans	-68.9	143.5	173.3	-50.9	0	0	0	0	109.7	T338 K349	T338-S340 PolarHBondContact O-N 3.47Å; S340-K349 PolarHBondContact O-NZ 3.34Å; S340-K349 VanDerWaalsContact O-NZ 3.11Å
341	G	67.4	Low	82.8	Confident	55 Å²	55	70.3 Å²	70.3	57%	0.567	36%	0.361	S	S	*	.	S	Bend	trans	117.9	18.2	-178	0	0	0	0	0	115.2	T345	G341-T345 WeakPolarHBondContact CA-OG1 3.3Å; G341-T345 WeakPolarHBondContact O-CG2 3.47Å; G341-T345 PolarHBondContact O-OG1 3.29Å
342	G	75.2	Confident	82.7	Confident	28 Å²	28	73.5 Å²	73.5	29%	0.289	38%	0.378	S	S	.	.			trans	95	166.5	179	0	0	0	0	0	114.7	V344 T345 G346 W446	G342-V344 PolarHBondContact O-N 2.79Å; G342-T345 PolarHBondContact O-N 2.57Å; G342-T345 PolarHBondContact O-OG1 2.91Å; G342-T345 VanDerWaalsContact O-OG1 3.07Å; G342-G346 PolarHBondContact O-N 3.31Å; G342-W446 CarbonylContact C-O 3.34Å; G342-W446 VanDerWaalsContact CA-O 3.25Å; G342-W446 WeakPolarHBondContact CA-O 3.41Å; G342-W446 PolarHBondContact N-O 3.29Å
343	I	78.3	Confident	82.8	Confident	76 Å²	76	69.3 Å²	69.3	39%	0.39	36%	0.359	S	S	.	.	H	α-helix	trans	-55.7	-48.4	-176.5	-60.6	173.6	0	0	0	111.4	T345 G346 F347 L443 W446 C447	I343-T345 PolarHBondContact O-N 2.86Å; I343-G346 PolarHBondContact O-N 3.27Å; I343-F347 VanDerWaalsContact O-CB 3.26Å; I343-F347 WeakPolarHBondContact O-CB 3Å; I343-F347 PolarHBondContact O-N 2.85Å; I343-L443 HydrophobicContact CD1-CD2 4.06Å; I343-W446 HydrophobicContact CG1-CB 4.46Å; I343-W446 HydrophobicContact CG2-CE3 4.2Å; I343-C447 VanDerWaalsContact CD1-SG 3.58Å; I343-C447 VanDerWaalsContact CG1-SG 3.6Å
344	V	83.5	Confident	82.8	Confident	116 Å²	116	67.1 Å²	67.1	70%	0.703	35%	0.35	S	S	*	.	H	α-helix	trans	-62.7	-44.1	-175.6	179.9	0	0	0	0	111	G342 F347 L348	G342-V344 PolarHBondContact O-N 2.79Å; V344-F347 PolarHBondContact O-N 2.96Å; V344-L348 WeakPolarHBondContact O-CB 3.47Å; V344-L348 PolarHBondContact O-N 3.4Å
345	T	83.4	Confident	83	Confident	54 Å²	54	69.2 Å²	69.2	33%	0.331	37%	0.365	S	S	.	.	H	α-helix	trans	-71.6	-38.7	-179.9	66.8	0	0	0	0	111.5	G341 G342 I343 K349	G341-T345 WeakPolarHBondContact CA-OG1 3.3Å; G341-T345 WeakPolarHBondContact O-CG2 3.47Å; G341-T345 PolarHBondContact O-OG1 3.29Å; G342-T345 PolarHBondContact O-N 2.57Å; G342-T345 PolarHBondContact O-OG1 2.91Å; G342-T345 VanDerWaalsContact O-OG1 3.07Å; I343-T345 PolarHBondContact O-N 2.86Å; T345-K349 VanDerWaalsContact O-CB 3.27Å; T345-K349 WeakPolarHBondContact O-CB 3.24Å; T345-K349 WeakPolarHBondContact O-CD 3.37Å; T345-K349 WeakPolarHBondContact O-CG 3.48Å; T345-K349 PolarHBondContact O-N 3.47Å
346	G	81.8	Confident	83.3	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-44.5	174.2	0	0	0	0	0	112.2	H339 G342 I343 T350	H339-G346 PolarHBondContact ND1-O 3.23Å; H339-G346 VanDerWaalsContact ND1-O 3.07Å; G342-G346 PolarHBondContact O-N 3.31Å; I343-G346 PolarHBondContact O-N 3.27Å; G346-T350 PolarHBondContact O-N 2.95Å; G346-T350 VanDerWaalsContact O-N 3.14Å; G346-T350 PolarHBondContact O-OG1 3Å
347	F	84.6	Confident	83.9	Confident	114 Å²	114	57.1 Å²	57.1	50%	0.5	32%	0.321	S	S	.	.	H	α-helix	trans	-67.9	-47.8	177.4	-175.2	-108.4	0	0	0	112.1	I343 V344 K349 T350 I351 W446	I343-F347 VanDerWaalsContact O-CB 3.26Å; I343-F347 WeakPolarHBondContact O-CB 3Å; I343-F347 PolarHBondContact O-N 2.85Å; V344-F347 PolarHBondContact O-N 2.96Å; F347-K349 PolarHBondContact O-N 3.31Å; F347-T350 WeakPolarHBondContact O-CA 3.34Å; F347-T350 VanDerWaalsContact O-CB 3.28Å; F347-T350 WeakPolarHBondContact O-CB 3.36Å; F347-T350 PolarHBondContact O-N 2.82Å; F347-T350 VanDerWaalsContact O-N 3.1Å; F347-I351 HydrophobicContact CD1-CD1 3.71Å; F347-I351 HydrophobicContact CD1-CG1 4.46Å; F347-I351 HydrophobicContact CE1-CD1 3.19Å; F347-I351 HydrophobicContact CE1-CG1 4.18Å; F347-I351 HydrophobicContact CE2-CD1 4.33Å; F347-I351 HydrophobicContact CG-CD1 4.48Å; F347-I351 HydrophobicContact CZ-CD1 3.55Å; F347-I351 HydrophobicContact CZ-CG1 4.25Å; F347-I351 PolarHBondContact O-N 3.4Å; F347-W446 HydrophobicContact CB-CZ3 4.35Å; F347-W446 HydrophobicContact CD2-CH2 4.49Å
348	L	88	Confident	84.5	Confident	96 Å²	96	57.6 Å²	57.6	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-61.7	-44.2	178.8	-176.3	62.5	0	0	0	111.8	V344 T350 I351 I352	V344-L348 WeakPolarHBondContact O-CB 3.47Å; V344-L348 PolarHBondContact O-N 3.4Å; L348-T350 VanDerWaalsContact C-N 3.27Å; L348-T350 PolarHBondContact O-N 3.1Å; L348-I351 PolarHBondContact O-N 3.19Å; L348-I352 HydrophobicContact CD1-CD1 4.33Å; L348-I352 HydrophobicContact CD1-CG1 4.49Å; L348-I352 HydrophobicContact CG-CD1 3.95Å; L348-I352 VanDerWaalsContact O-CG1 3.27Å; L348-I352 WeakPolarHBondContact O-CG1 3.45Å; L348-I352 PolarHBondContact O-N 3.08Å
349	K	87.6	Confident	85.7	Confident	58 Å²	58	59.4 Å²	59.4	25%	0.252	34%	0.336	S	S	.	.	H	α-helix	trans	-58.3	-40.4	173.7	-75.5	170	179.8	172.2	0	111.8	W337 T338 S340 T345 F347 I352 Q353	W337-K349 HydrophobicContact CE3-CB 3.95Å; W337-K349 HydrophobicContact CE3-CG 4.05Å; W337-K349 HydrophobicContact CZ3-CB 4.09Å; W337-K349 HydrophobicContact CZ3-CG 4.16Å; T338-K349 WeakPolarHBondContact O-CD 3.17Å; T338-K349 PolarHBondContact O-NZ 3.26Å; S340-K349 PolarHBondContact O-NZ 3.34Å; S340-K349 VanDerWaalsContact O-NZ 3.11Å; T345-K349 VanDerWaalsContact O-CB 3.27Å; T345-K349 WeakPolarHBondContact O-CB 3.24Å; T345-K349 WeakPolarHBondContact O-CD 3.37Å; T345-K349 WeakPolarHBondContact O-CG 3.48Å; T345-K349 PolarHBondContact O-N 3.47Å; F347-K349 PolarHBondContact O-N 3.31Å; K349-I352 PolarHBondContact O-N 2.79Å; K349-Q353 WeakPolarHBondContact O-CB 3.44Å; K349-Q353 PolarHBondContact O-N 2.91Å
350	T	87.5	Confident	87.1	Confident	19 Å²	19	60.2 Å²	60.2	12%	0.117	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-48.9	176.2	-57.3	0	0	0	0	110.9	V282 H339 G346 F347 L348 I352 Q353 V354	V282-T350 HydrophobicContact CG1-CG2 3.69Å; H339-T350 PolarHBondContact CE1-OG1 3.09Å; H339-T350 PolarHBondContact ND1-OG1 3.28Å; G346-T350 PolarHBondContact O-N 2.95Å; G346-T350 VanDerWaalsContact O-N 3.14Å; G346-T350 PolarHBondContact O-OG1 3Å; F347-T350 WeakPolarHBondContact O-CA 3.34Å; F347-T350 VanDerWaalsContact O-CB 3.28Å; F347-T350 WeakPolarHBondContact O-CB 3.36Å; F347-T350 PolarHBondContact O-N 2.82Å; F347-T350 VanDerWaalsContact O-N 3.1Å; L348-T350 VanDerWaalsContact C-N 3.27Å; L348-T350 PolarHBondContact O-N 3.1Å; T350-I352 PolarHBondContact O-N 3.43Å; T350-Q353 PolarHBondContact O-N 2.97Å; T350-V354 HydrophobicContact CG2-CG2 4.43Å; T350-V354 VanDerWaalsContact O-CG2 3.26Å; T350-V354 WeakPolarHBondContact O-CG2 3.27Å; T350-V354 PolarHBondContact O-N 3.11Å
351	I	91.3	Very high	88.7	Confident	70 Å²	70	58.1 Å²	58.1	36%	0.359	33%	0.327	S	S	.	.	H	α-helix	trans	-58.8	-48.6	177.4	-72.1	178.5	0	0	0	110.7	F347 L348 Q353 V354 V355	F347-I351 HydrophobicContact CD1-CD1 3.71Å; F347-I351 HydrophobicContact CD1-CG1 4.46Å; F347-I351 HydrophobicContact CE1-CD1 3.19Å; F347-I351 HydrophobicContact CE1-CG1 4.18Å; F347-I351 HydrophobicContact CE2-CD1 4.33Å; F347-I351 HydrophobicContact CG-CD1 4.48Å; F347-I351 HydrophobicContact CZ-CD1 3.55Å; F347-I351 HydrophobicContact CZ-CG1 4.25Å; F347-I351 PolarHBondContact O-N 3.4Å; L348-I351 PolarHBondContact O-N 3.19Å; I351-Q353 VanDerWaalsContact C-N 3.29Å; I351-Q353 PolarHBondContact O-N 3.34Å; I351-V354 PolarHBondContact O-N 2.9Å; I351-V354 VanDerWaalsContact O-N 3.14Å; I351-V355 HydrophobicContact CG2-CG2 4.05Å; I351-V355 WeakPolarHBondContact O-CB 3.22Å; I351-V355 WeakPolarHBondContact O-CG2 3.06Å; I351-V355 PolarHBondContact O-N 3.06Å
352	I	93.4	Very high	90	Very high	76 Å²	76	58.2 Å²	58.2	39%	0.39	32%	0.322	S	S	.	.	H	α-helix	trans	-56.9	-46.1	179.7	-69.2	165.3	0	0	0	110.5	W337 L348 K349 T350 V354 V355 F356	W337-I352 HydrophobicContact CH2-CG2 3.92Å; W337-I352 HydrophobicContact CZ3-CB 4.37Å; W337-I352 HydrophobicContact CZ3-CG2 4.13Å; L348-I352 HydrophobicContact CD1-CD1 4.33Å; L348-I352 HydrophobicContact CD1-CG1 4.49Å; L348-I352 HydrophobicContact CG-CD1 3.95Å; L348-I352 VanDerWaalsContact O-CG1 3.27Å; L348-I352 WeakPolarHBondContact O-CG1 3.45Å; L348-I352 PolarHBondContact O-N 3.08Å; K349-I352 PolarHBondContact O-N 2.79Å; T350-I352 PolarHBondContact O-N 3.43Å; I352-V354 PolarHBondContact O-N 3.36Å; I352-V355 PolarHBondContact O-N 2.87Å; I352-F356 VanDerWaalsContact O-CB 3.3Å; I352-F356 WeakPolarHBondContact O-CB 3.17Å; I352-F356 PolarHBondContact O-N 3.43Å
353	Q	94.3	Very high	90.9	Very high	12 Å²	12	62.5 Å²	62.5	6%	0.056	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-41.4	177.9	-179.8	175.1	7.2	0	0	112.5	Y278 S330 F334 K349 T350 I351 T357	Y278-Q353 PolarHBondContact OH-O 3.43Å; S330-Q353 WeakPolarHBondContact OG-CG 3.11Å; F334-Q353 HydrophobicContact CB-CG 4.2Å; F334-Q353 HydrophobicContact CD2-CB 4.18Å; F334-Q353 HydrophobicContact CD2-CG 3.58Å; F334-Q353 HydrophobicContact CE2-CB 4.46Å; F334-Q353 HydrophobicContact CE2-CG 4.16Å; F334-Q353 HydrophobicContact CG-CB 4.34Å; F334-Q353 HydrophobicContact CG-CG 3.96Å; K349-Q353 WeakPolarHBondContact O-CB 3.44Å; K349-Q353 PolarHBondContact O-N 2.91Å; T350-Q353 PolarHBondContact O-N 2.97Å; I351-Q353 VanDerWaalsContact C-N 3.29Å; I351-Q353 PolarHBondContact O-N 3.34Å; Q353-T357 PolarHBondContact O-N 3.37Å; Q353-T357 PolarHBondContact O-OG1 3.38Å
354	V	94.5	Very high	91.5	Very high	50 Å²	50	60.4 Å²	60.4	30%	0.303	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-49.8	177	172.2	0	0	0	0	110.9	Y278 T350 I351 I352 F356 T357 I358	Y278-V354 HydrophobicContact CE1-CG2 4.18Å; T350-V354 HydrophobicContact CG2-CG2 4.43Å; T350-V354 VanDerWaalsContact O-CG2 3.26Å; T350-V354 WeakPolarHBondContact O-CG2 3.27Å; T350-V354 PolarHBondContact O-N 3.11Å; I351-V354 PolarHBondContact O-N 2.9Å; I351-V354 VanDerWaalsContact O-N 3.14Å; I352-V354 PolarHBondContact O-N 3.36Å; V354-F356 VanDerWaalsContact C-N 3.34Å; V354-F356 PolarHBondContact O-N 2.92Å; V354-T357 WeakPolarHBondContact O-CB 3.22Å; V354-T357 PolarHBondContact O-N 2.8Å; V354-T357 VanDerWaalsContact O-N 3.09Å; V354-I358 HydrophobicContact CG1-CD1 3.91Å; V354-I358 WeakPolarHBondContact O-CG1 3.44Å; V354-I358 PolarHBondContact O-N 2.77Å
355	V	95.6	Very high	91.9	Very high	71 Å²	71	56.5 Å²	56.5	43%	0.43	31%	0.305	S	S	.	.	H	α-helix	trans	-59.5	-45.2	178.2	172.1	0	0	0	0	110.7	I351 I352 T357 I358 L359	I351-V355 HydrophobicContact CG2-CG2 4.05Å; I351-V355 WeakPolarHBondContact O-CB 3.22Å; I351-V355 WeakPolarHBondContact O-CG2 3.06Å; I351-V355 PolarHBondContact O-N 3.06Å; I352-V355 PolarHBondContact O-N 2.87Å; V355-T357 VanDerWaalsContact C-N 3.28Å; V355-T357 PolarHBondContact O-N 3.3Å; V355-I358 PolarHBondContact O-N 3.49Å; V355-L359 HydrophobicContact CG1-CD1 4.01Å; V355-L359 HydrophobicContact CG1-CG 4.37Å; V355-L359 WeakPolarHBondContact O-CG 3.46Å; V355-L359 PolarHBondContact O-N 2.87Å
356	F	96.5	Very high	92.1	Very high	66 Å²	66	58.7 Å²	58.7	29%	0.289	32%	0.315	S	S	.	.	H	α-helix	trans	-54.9	-45.8	174.1	176.3	-90.9	0	0	0	111.6	L333 F334 I352 V354 I358 L359 V360	L333-F356 HydrophobicContact CD1-CE1 4.12Å; L333-F356 HydrophobicContact CD1-CZ 3.89Å; F334-F356 HydrophobicContact CE2-CB 4.18Å; F334-F356 AromaticContact CE2-CD1 3.57Å; F334-F356 HydrophobicContact CE2-CD1 3.57Å; F334-F356 HydrophobicContact CE2-CE1 4.04Å; F334-F356 AromaticContact CE2-CG 3.84Å; F334-F356 HydrophobicContact CE2-CG 3.84Å; F334-F356 HydrophobicContact CZ-CB 4.33Å; F334-F356 HydrophobicContact CZ-CD1 4.27Å; F334-F356 HydrophobicContact CZ-CD2 4.47Å; F334-F356 HydrophobicContact CZ-CG 4.1Å; I352-F356 VanDerWaalsContact O-CB 3.3Å; I352-F356 WeakPolarHBondContact O-CB 3.17Å; I352-F356 PolarHBondContact O-N 3.43Å; V354-F356 VanDerWaalsContact C-N 3.34Å; V354-F356 PolarHBondContact O-N 2.92Å; F356-I358 PolarHBondContact O-N 3.26Å; F356-L359 PolarHBondContact O-N 3.33Å; F356-V360 HydrophobicContact CD1-CG2 4.1Å; F356-V360 HydrophobicContact CD2-CG2 4.46Å; F356-V360 HydrophobicContact CE1-CG2 3.69Å; F356-V360 HydrophobicContact CE2-CG2 4.07Å; F356-V360 HydrophobicContact CG-CG2 4.48Å; F356-V360 HydrophobicContact CZ-CG2 3.67Å; F356-V360 WeakPolarHBondContact O-CG2 3.48Å; F356-V360 PolarHBondContact O-N 3.42Å
357	T	96.8	Very high	92.4	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.012	33%	0.331	C	S	.	.	H	α-helix	trans	-65.3	-40.4	-179.1	-53.2	0	0	0	0	111.9	Y278 F323 A327 S330 Q353 V354 V355 T361	Y278-T357 HydrophobicContact CE1-CG2 4.5Å; Y278-T357 HydrophobicContact CE2-CG2 4Å; Y278-T357 PolarHBondContact OH-OG1 3.37Å; F323-T357 HydrophobicContact CE2-CG2 4.05Å; A327-T357 HydrophobicContact CB-CG2 4.31Å; S330-T357 WeakPolarHBondContact CB-OG1 3.35Å; S330-T357 PolarHBondContact OG-OG1 3.5Å; Q353-T357 PolarHBondContact O-N 3.37Å; Q353-T357 PolarHBondContact O-OG1 3.38Å; V354-T357 WeakPolarHBondContact O-CB 3.22Å; V354-T357 PolarHBondContact O-N 2.8Å; V354-T357 VanDerWaalsContact O-N 3.09Å; V355-T357 VanDerWaalsContact C-N 3.28Å; V355-T357 PolarHBondContact O-N 3.3Å; T357-T361 VanDerWaalsContact O-CB 3.27Å; T357-T361 WeakPolarHBondContact O-CB 3.44Å; T357-T361 PolarHBondContact O-N 2.75Å; T357-T361 PolarHBondContact O-OG1 3.49Å
358	I	95.5	Very high	92.5	Very high	108 Å²	108	57.7 Å²	57.7	55%	0.554	32%	0.32	S	S	*	.	H	α-helix	trans	-62.3	-46.5	175.7	-67.3	168	0	0	0	110.3	V354 V355 F356 T361 A362	V354-I358 HydrophobicContact CG1-CD1 3.91Å; V354-I358 WeakPolarHBondContact O-CG1 3.44Å; V354-I358 PolarHBondContact O-N 2.77Å; V355-I358 PolarHBondContact O-N 3.49Å; F356-I358 PolarHBondContact O-N 3.26Å; I358-T361 PolarHBondContact O-N 3.45Å; I358-A362 WeakPolarHBondContact O-CB 3.31Å; I358-A362 PolarHBondContact O-N 3.04Å
359	L	96.7	Very high	92.3	Very high	105 Å²	105	58.3 Å²	58.3	55%	0.55	32%	0.315	S	S	.	.	H	α-helix	trans	-62.3	-46.8	178.9	-68.7	173.8	0	0	0	111.8	V355 F356 T361 A362 L363	V355-L359 HydrophobicContact CG1-CD1 4.01Å; V355-L359 HydrophobicContact CG1-CG 4.37Å; V355-L359 WeakPolarHBondContact O-CG 3.46Å; V355-L359 PolarHBondContact O-N 2.87Å; F356-L359 PolarHBondContact O-N 3.33Å; L359-T361 VanDerWaalsContact C-N 3.32Å; L359-T361 PolarHBondContact O-N 3.06Å; L359-A362 PolarHBondContact O-N 2.94Å; L359-L363 WeakPolarHBondContact O-CG 3.21Å; L359-L363 PolarHBondContact O-N 3.45Å
360	V	96.3	Very high	92.1	Very high	31 Å²	31	60.1 Å²	60.1	19%	0.188	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-39.7	176.6	176.7	0	0	0	0	111.2	A326 L329 F356 A362 L363 A364	A326-V360 HydrophobicContact CB-CB 4.12Å; A326-V360 HydrophobicContact CB-CG1 3.65Å; L329-V360 HydrophobicContact CD2-CG1 4.37Å; F356-V360 HydrophobicContact CD1-CG2 4.1Å; F356-V360 HydrophobicContact CD2-CG2 4.46Å; F356-V360 HydrophobicContact CE1-CG2 3.69Å; F356-V360 HydrophobicContact CE2-CG2 4.07Å; F356-V360 HydrophobicContact CG-CG2 4.48Å; F356-V360 HydrophobicContact CZ-CG2 3.67Å; F356-V360 WeakPolarHBondContact O-CG2 3.48Å; F356-V360 PolarHBondContact O-N 3.42Å; V360-A362 VanDerWaalsContact C-N 3.35Å; V360-A362 PolarHBondContact O-N 2.7Å; V360-L363 PolarHBondContact O-N 2.76Å; V360-A364 VanDerWaalsContact O-CB 3.31Å; V360-A364 WeakPolarHBondContact O-CB 3.48Å; V360-A364 PolarHBondContact O-N 3.07Å
361	T	95.8	Very high	92	Very high	14 Å²	14	65.2 Å²	65.2	9%	0.086	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-42.7	175.6	-59.3	0	0	0	0	111.3	F323 A326 T357 I358 L359 A364 K365	F323-T361 HydrophobicContact CB-CG2 3.87Å; F323-T361 HydrophobicContact CD2-CG2 4.27Å; A326-T361 WeakPolarHBondContact CB-OG1 3.46Å; T357-T361 VanDerWaalsContact O-CB 3.27Å; T357-T361 WeakPolarHBondContact O-CB 3.44Å; T357-T361 PolarHBondContact O-N 2.75Å; T357-T361 PolarHBondContact O-OG1 3.49Å; I358-T361 PolarHBondContact O-N 3.45Å; L359-T361 VanDerWaalsContact C-N 3.32Å; L359-T361 PolarHBondContact O-N 3.06Å; T361-A364 PolarHBondContact O-N 3.29Å; T361-K365 WeakPolarHBondContact O-CB 3.22Å; T361-K365 PolarHBondContact O-N 3.24Å
362	A	92.7	Very high	91.5	Very high	56 Å²	56	65 Å²	65	46%	0.463	35%	0.354	S	S	.	.	H	α-helix	trans	-65.3	-43.1	177.6	0	0	0	0	0	111.8	I358 L359 V360 K365 L366	I358-A362 WeakPolarHBondContact O-CB 3.31Å; I358-A362 PolarHBondContact O-N 3.04Å; L359-A362 PolarHBondContact O-N 2.94Å; V360-A362 VanDerWaalsContact C-N 3.35Å; V360-A362 PolarHBondContact O-N 2.7Å; A362-K365 PolarHBondContact O-N 3.29Å; A362-L366 WeakPolarHBondContact O-CB 3.38Å; A362-L366 PolarHBondContact O-N 3.11Å
363	L	94.4	Very high	90.7	Very high	119 Å²	119	69.7 Å²	69.7	62%	0.623	37%	0.374	S	S	*	.	H	α-helix	trans	-63.6	-44.6	175	-70.5	173.5	0	0	0	111.8	L359 V360 L366 G367	L359-L363 WeakPolarHBondContact O-CG 3.21Å; L359-L363 PolarHBondContact O-N 3.45Å; V360-L363 PolarHBondContact O-N 2.76Å; L363-L366 PolarHBondContact O-N 2.71Å; L363-G367 PolarHBondContact O-N 2.78Å
364	A	92.4	Very high	89.6	Confident	31 Å²	31	70 Å²	70	26%	0.256	38%	0.376	S	S	.	.	H	α-helix	trans	-62.3	-43	175.4	0	0	0	0	0	111.3	V360 T361 G367 F368	V360-A364 VanDerWaalsContact O-CB 3.31Å; V360-A364 WeakPolarHBondContact O-CB 3.48Å; V360-A364 PolarHBondContact O-N 3.07Å; T361-A364 PolarHBondContact O-N 3.29Å; A364-G367 PolarHBondContact O-N 3.08Å; A364-F368 WeakPolarHBondContact O-CD2 3.3Å; A364-F368 PolarHBondContact O-N 3.17Å
365	K	90.5	Very high	88.2	Confident	35 Å²	35	72.6 Å²	72.6	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-43.1	175.4	-178.6	160.2	-177.7	148.9	0	111.6	I319 T361 A362 G367 F368 R369 D377 Y381	I319-K365 HydrophobicContact CG1-CD 4.19Å; T361-K365 WeakPolarHBondContact O-CB 3.22Å; T361-K365 PolarHBondContact O-N 3.24Å; A362-K365 PolarHBondContact O-N 3.29Å; K365-G367 VanDerWaalsContact C-N 3.32Å; K365-G367 PolarHBondContact O-N 2.93Å; K365-F368 PolarHBondContact O-N 3.12Å; K365-R369 WeakPolarHBondContact O-CB 3.41Å; K365-R369 PolarHBondContact O-N 3.49Å; K365-D377 IonicContact NZ-OD2 2.64Å; K365-D377 PolarHBondContact NZ-OD2 3.48Å; K365-D377 VanDerWaalsContact NZ-OD2 3.08Å; K365-Y381 VanDerWaalsContact CE-OH 3.28Å; K365-Y381 WeakPolarHBondContact CE-OH 3.25Å; K365-Y381 PolarHBondContact NZ-OH 3.32Å
366	L	88.2	Confident	86.5	Confident	100 Å²	100	70 Å²	70	52%	0.524	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-43.9	175.5	-177.5	63.2	0	0	0	110.9	A362 L363 R369 T370	A362-L366 WeakPolarHBondContact O-CB 3.38Å; A362-L366 PolarHBondContact O-N 3.11Å; L363-L366 PolarHBondContact O-N 2.71Å; L366-R369 PolarHBondContact O-N 3.33Å; L366-T370 HydrophobicContact CD1-CG2 4.43Å; L366-T370 WeakPolarHBondContact O-CG2 3.26Å; L366-T370 PolarHBondContact O-N 3.46Å; L366-T370 PolarHBondContact O-OG1 3.1Å; L366-T370 VanDerWaalsContact O-OG1 3.13Å
367	G	88.6	Confident	84.9	Confident	34 Å²	34	68 Å²	68	35%	0.351	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-43.8	175.3	0	0	0	0	0	113.3	L363 A364 K365 T370 L371	L363-G367 PolarHBondContact O-N 2.78Å; A364-G367 PolarHBondContact O-N 3.08Å; K365-G367 VanDerWaalsContact C-N 3.32Å; K365-G367 PolarHBondContact O-N 2.93Å; G367-T370 PolarHBondContact O-OG1 3.14Å; G367-L371 VanDerWaalsContact O-CB 3.22Å; G367-L371 WeakPolarHBondContact O-CB 3.28Å; G367-L371 PolarHBondContact O-N 3.48Å
368	F	85.9	Confident	83.7	Confident	59 Å²	59	70.5 Å²	70.5	26%	0.259	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-40.7	174.1	-73.9	-55.3	0	0	0	112.1	A364 K365 T370 L371 F372	A364-F368 WeakPolarHBondContact O-CD2 3.3Å; A364-F368 PolarHBondContact O-N 3.17Å; K365-F368 PolarHBondContact O-N 3.12Å; F368-T370 PolarHBondContact O-N 2.73Å; F368-L371 PolarHBondContact O-N 2.86Å; F368-F372 HydrophobicContact CD1-CD2 4.24Å; F368-F372 AromaticContact CD1-CE2 3.91Å; F368-F372 HydrophobicContact CD1-CE2 3.91Å; F368-F372 HydrophobicContact CE1-CE2 4.5Å; F368-F372 WeakPolarHBondContact O-CB 3.48Å; F368-F372 WeakPolarHBondContact O-CD2 3.26Å; F368-F372 PolarHBondContact O-N 3.34Å
369	R	83.5	Confident	82.6	Confident	108 Å²	108	66.3 Å²	66.3	41%	0.408	35%	0.354	S	S	.	.	H	α-helix	trans	-60.7	-45.8	177.7	-172.6	-174.9	-176.9	167.5	9	111.7	K365 L366 Q373 L374 D378	K365-R369 WeakPolarHBondContact O-CB 3.41Å; K365-R369 PolarHBondContact O-N 3.49Å; L366-R369 PolarHBondContact O-N 3.33Å; R369-Q373 WeakPolarHBondContact O-CA 3.45Å; R369-Q373 PolarHBondContact O-N 3.44Å; R369-L374 HydrophobicContact CG-CB 4.33Å; R369-L374 PolarHBondContact NE-O 2.83Å; R369-L374 PolarHBondContact O-N 3.37Å; R369-D378 IonicContact CZ-OD1 2.94Å; R369-D378 IonicContact NH1-OD1 3.95Å; R369-D378 IonicContact NH2-OD1 3.7Å; R369-D378 PolarHBondContact NH2-OD1 2.7Å; R369-D378 IonicContact NH2-OD2 2.8Å; R369-D378 PolarHBondContact NH2-OD2 3.01Å; R369-D378 VanDerWaalsContact NH2-OD2 3.09Å
370	T	84.6	Confident	81.5	Confident	96 Å²	96	63.1 Å²	63.1	59%	0.589	34%	0.338	S	S	*	.	H	α-helix	trans	-70.9	-40.8	-179.7	53.1	0	0	0	0	111.9	L366 G367 F368 F372	L366-T370 HydrophobicContact CD1-CG2 4.43Å; L366-T370 WeakPolarHBondContact O-CG2 3.26Å; L366-T370 PolarHBondContact O-N 3.46Å; L366-T370 PolarHBondContact O-OG1 3.1Å; L366-T370 VanDerWaalsContact O-OG1 3.13Å; G367-T370 PolarHBondContact O-OG1 3.14Å; F368-T370 PolarHBondContact O-N 2.73Å; T370-F372 PolarHBondContact O-N 2.98Å
371	L	85.4	Confident	80.6	Confident	127 Å²	127	65.4 Å²	65.4	67%	0.665	34%	0.344	S	S	*	.	H	α-helix	trans	-65.7	-37.2	-179.9	-172.6	66.3	0	0	0	112.6	G367 F368	G367-L371 VanDerWaalsContact O-CB 3.22Å; G367-L371 WeakPolarHBondContact O-CB 3.28Å; G367-L371 PolarHBondContact O-N 3.48Å; F368-L371 PolarHBondContact O-N 2.86Å
372	F	80.5	Confident	79.8	Confident	64 Å²	64	69.2 Å²	69.2	28%	0.281	36%	0.359	S	S	.	.	H	α-helix	trans	-109.8	8.2	-173.5	-65.7	-68.6	0	0	0	114.8	L316 F368 T370 L374	L316-F372 HydrophobicContact CB-CD2 4.45Å; L316-F372 HydrophobicContact CB-CE2 4.18Å; L316-F372 HydrophobicContact CD1-CE1 4.21Å; L316-F372 HydrophobicContact CD1-CE2 3.81Å; L316-F372 HydrophobicContact CD1-CZ 3.57Å; F368-F372 HydrophobicContact CD1-CD2 4.24Å; F368-F372 AromaticContact CD1-CE2 3.91Å; F368-F372 HydrophobicContact CD1-CE2 3.91Å; F368-F372 HydrophobicContact CE1-CE2 4.5Å; F368-F372 WeakPolarHBondContact O-CB 3.48Å; F368-F372 WeakPolarHBondContact O-CD2 3.26Å; F368-F372 PolarHBondContact O-N 3.34Å; T370-F372 PolarHBondContact O-N 2.98Å; F372-L374 VanDerWaalsContact C-N 3.32Å; F372-L374 HydrophobicContact CB-CD1 4.03Å; F372-L374 HydrophobicContact CB-CD2 4.2Å; F372-L374 HydrophobicContact CB-CG 3.79Å; F372-L374 PolarHBondContact O-N 2.85Å
373	Q	75.8	Confident	79.1	Confident	175 Å²	175	67.9 Å²	67.9	82%	0.818	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	49.2	-179.9	-63.6	-176.7	-13.2	0	0	113.4	R369 E375	R369-Q373 WeakPolarHBondContact O-CA 3.45Å; R369-Q373 PolarHBondContact O-N 3.44Å; Q373-E375 PolarHBondContact O-N 3.33Å
374	L	71.4	Confident	78.4	Confident	18 Å²	18	65.6 Å²	65.6	9%	0.094	33%	0.33	C	S	.	.			trans	-83.2	112.8	-173.1	-63.7	167.5	0	0	0	111.5	S313 R369 F372	S313-L374 WeakPolarHBondContact OG-CD2 3.41Å; R369-L374 HydrophobicContact CG-CB 4.33Å; R369-L374 PolarHBondContact NE-O 2.83Å; R369-L374 PolarHBondContact O-N 3.37Å; F372-L374 VanDerWaalsContact C-N 3.32Å; F372-L374 HydrophobicContact CB-CD1 4.03Å; F372-L374 HydrophobicContact CB-CD2 4.2Å; F372-L374 HydrophobicContact CB-CG 3.79Å; F372-L374 PolarHBondContact O-N 2.85Å
375	E	66	Low	77.9	Confident	106 Å²	106	69.5 Å²	69.5	50%	0.495	34%	0.342	S	S	.	.			trans	-109.4	-11.7	172.6	-62.7	-173.4	172.9	0	0	113.5	Q373 D377 D378 K612	Q373-E375 PolarHBondContact O-N 3.33Å; E375-D377 VanDerWaalsContact C-N 3.34Å; E375-D377 PolarHBondContact O-N 3.12Å; E375-D378 PolarHBondContact O-N 3.38Å; E375-K612 HydrophobicContact CB-CD 4.29Å; E375-K612 IonicContact OE2-NZ 3.34Å; E375-K612 PolarHBondContact OE2-NZ 3.37Å
376	A	58.5	Low	77.4	Confident	16 Å²	16	68.7 Å²	68.7	13%	0.132	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-35.7	-170	0	0	0	0	0	113.3	M314 D378 H379	M314-A376 HydrophobicContact CG-CB 4.09Å; M314-A376 HydrophobicContact SD-CB 3.66Å; A376-D378 VanDerWaalsContact C-N 3.3Å; A376-D378 PolarHBondContact O-N 2.96Å; A376-H379 PolarHBondContact O-CE1 3.01Å; A376-H379 PolarHBondContact O-ND1 3.44Å
377	D	64.2	Low	77.1	Confident	23 Å²	23	65.5 Å²	65.5	12%	0.123	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.3	-173.9	-81.7	8.3	0	0	0	114.9	K365 E375 H379 I380 Y381	K365-D377 IonicContact NZ-OD2 2.64Å; K365-D377 PolarHBondContact NZ-OD2 3.48Å; K365-D377 VanDerWaalsContact NZ-OD2 3.08Å; E375-D377 VanDerWaalsContact C-N 3.34Å; E375-D377 PolarHBondContact O-N 3.12Å; D377-H379 PolarHBondContact O-N 2.9Å; D377-H379 VanDerWaalsContact O-N 3.14Å; D377-I380 PolarHBondContact O-N 2.72Å; D377-I380 VanDerWaalsContact O-N 3.11Å; D377-Y381 HydrophobicContact CB-CE2 4.3Å; D377-Y381 WeakPolarHBondContact O-CD2 3.24Å
378	D	71.5	Confident	76.8	Confident	56 Å²	56	68.4 Å²	68.4	30%	0.299	33%	0.33	S	S	.	.	H	α-helix	trans	-61.2	-29.3	-172.3	-74.1	-24	0	0	0	112.1	R369 E375 A376 I380 Y381 K382	R369-D378 IonicContact CZ-OD1 2.94Å; R369-D378 IonicContact NH1-OD1 3.95Å; R369-D378 IonicContact NH2-OD1 3.7Å; R369-D378 PolarHBondContact NH2-OD1 2.7Å; R369-D378 IonicContact NH2-OD2 2.8Å; R369-D378 PolarHBondContact NH2-OD2 3.01Å; R369-D378 VanDerWaalsContact NH2-OD2 3.09Å; E375-D378 PolarHBondContact O-N 3.38Å; A376-D378 VanDerWaalsContact C-N 3.3Å; A376-D378 PolarHBondContact O-N 2.96Å; D378-I380 PolarHBondContact O-N 3.04Å; D378-Y381 PolarHBondContact O-N 2.92Å; D378-K382 WeakPolarHBondContact O-CG 3.31Å; D378-K382 PolarHBondContact O-N 3.37Å
379	H	72.6	Confident	76.6	Confident	19 Å²	19	68.7 Å²	68.7	9%	0.088	35%	0.349	C	S	.	.	H	α-helix	trans	-66	-32.2	178.4	77	-78.4	0	0	0	113.6	A376 D377 F383 R615	A376-H379 PolarHBondContact O-CE1 3.01Å; A376-H379 PolarHBondContact O-ND1 3.44Å; D377-H379 PolarHBondContact O-N 2.9Å; D377-H379 VanDerWaalsContact O-N 3.14Å; H379-F383 WeakPolarHBondContact O-CB 3.5Å; H379-F383 PolarHBondContact O-N 3.28Å; H379-R615 PolarHBondContact ND1-NH1 2.66Å
380	I	74	Confident	76.5	Confident	38 Å²	38	71.2 Å²	71.2	20%	0.195	36%	0.363	C	S	.	.	H	α-helix	trans	-68.8	-43.3	178.2	-64.7	153.7	0	0	0	109.7	F268 D377 D378 F383 I384	F268-I380 HydrophobicContact CZ-CD1 3.77Å; D377-I380 PolarHBondContact O-N 2.72Å; D377-I380 VanDerWaalsContact O-N 3.11Å; D378-I380 PolarHBondContact O-N 3.04Å; I380-F383 PolarHBondContact O-N 3.09Å; I380-I384 HydrophobicContact CG2-CD1 3.99Å; I380-I384 WeakPolarHBondContact O-CG1 3.5Å; I380-I384 PolarHBondContact O-N 3Å
381	Y	76	Confident	75.9	Confident	80 Å²	80	67.9 Å²	67.9	31%	0.314	35%	0.348	S	S	.	.	H	α-helix	trans	-65.8	-45.5	176.8	-67.3	-72.5	0	0	0	111.1	I319 K365 D377 D378 F383 I384 F385	I319-Y381 WeakPolarHBondContact CD1-OH 3.19Å; K365-Y381 VanDerWaalsContact CE-OH 3.28Å; K365-Y381 WeakPolarHBondContact CE-OH 3.25Å; K365-Y381 PolarHBondContact NZ-OH 3.32Å; D377-Y381 HydrophobicContact CB-CE2 4.3Å; D377-Y381 WeakPolarHBondContact O-CD2 3.24Å; D378-Y381 PolarHBondContact O-N 2.92Å; Y381-F383 VanDerWaalsContact C-N 3.3Å; Y381-F383 PolarHBondContact O-N 3.44Å; Y381-I384 PolarHBondContact O-N 3.47Å; Y381-F385 WeakPolarHBondContact O-CD2 3.15Å; Y381-F385 PolarHBondContact O-N 2.82Å
382	K	78.8	Confident	75.4	Confident	93 Å²	93	65.4 Å²	65.4	40%	0.404	34%	0.341	S	S	.	.	H	α-helix	trans	-54.5	-47.5	172.9	-74.4	179.4	179.1	-173.1	0	111.4	D378 I384 F385 S386 D395	D378-K382 WeakPolarHBondContact O-CG 3.31Å; D378-K382 PolarHBondContact O-N 3.37Å; K382-I384 PolarHBondContact O-N 2.63Å; K382-F385 PolarHBondContact O-N 3.09Å; K382-S386 VanDerWaalsContact O-CB 3.27Å; K382-S386 WeakPolarHBondContact O-CB 3.32Å; K382-S386 PolarHBondContact O-N 3.14Å; K382-S386 PolarHBondContact O-OG 3.46Å; K382-D395 IonicContact NZ-OD1 3.42Å
383	F	79.1	Confident	74.9	Confident	28 Å²	28	65.1 Å²	65.1	12%	0.123	35%	0.351	C	S	.	.	H	α-helix	trans	-58.8	-47.8	176.7	168.3	-103	0	0	0	112.3	H379 I380 Y381 S386 K387 Y401 L402 F407	H379-F383 WeakPolarHBondContact O-CB 3.5Å; H379-F383 PolarHBondContact O-N 3.28Å; I380-F383 PolarHBondContact O-N 3.09Å; Y381-F383 VanDerWaalsContact C-N 3.3Å; Y381-F383 PolarHBondContact O-N 3.44Å; F383-S386 PolarHBondContact O-N 3.15Å; F383-K387 HydrophobicContact CE1-CD 4.1Å; F383-K387 HydrophobicContact CE2-CD 4.29Å; F383-K387 HydrophobicContact CZ-CD 3.68Å; F383-K387 VanDerWaalsContact O-CB 3.24Å; F383-K387 WeakPolarHBondContact O-CB 3.48Å; F383-K387 PolarHBondContact O-N 3.27Å; F383-Y401 HydrophobicContact CD2-CG 4.33Å; F383-L402 HydrophobicContact CD2-CD2 4.31Å; F383-L402 HydrophobicContact CD2-CG 4.34Å; F383-L402 HydrophobicContact CE2-CD2 3.84Å; F383-L402 HydrophobicContact CE2-CG 4.17Å; F383-F407 HydrophobicContact CE1-CD1 4.2Å; F383-F407 HydrophobicContact CE2-CB 4.27Å; F383-F407 HydrophobicContact CE2-CD1 4.32Å; F383-F407 HydrophobicContact CE2-CG 4.41Å; F383-F407 HydrophobicContact CZ-CB 4.01Å; F383-F407 AromaticContact CZ-CD1 3.65Å; F383-F407 HydrophobicContact CZ-CD1 3.65Å; F383-F407 HydrophobicContact CZ-CE1 4.46Å; F383-F407 HydrophobicContact CZ-CG 4.08Å
384	I	79.6	Confident	75	Confident	72 Å²	72	59.8 Å²	59.8	37%	0.369	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-46.6	178.9	-68	167.3	0	0	0	110.8	I380 Y381 K382 K387 L388	I380-I384 HydrophobicContact CG2-CD1 3.99Å; I380-I384 WeakPolarHBondContact O-CG1 3.5Å; I380-I384 PolarHBondContact O-N 3Å; Y381-I384 PolarHBondContact O-N 3.47Å; K382-I384 PolarHBondContact O-N 2.63Å; I384-K387 PolarHBondContact O-N 3.03Å; I384-L388 HydrophobicContact CG2-CD1 3.91Å; I384-L388 HydrophobicContact CG2-CG 4.46Å; I384-L388 WeakPolarHBondContact O-CB 3.37Å; I384-L388 VanDerWaalsContact O-CG 3.3Å; I384-L388 WeakPolarHBondContact O-CG 3.34Å; I384-L388 PolarHBondContact O-N 3.23Å
385	F	81.6	Confident	75.5	Confident	112 Å²	112	60.3 Å²	60.3	49%	0.491	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-44.8	177.3	-77.4	-63.8	0	0	0	111.7	Y381 K382 K387 L388 G389 F390 G391	Y381-F385 WeakPolarHBondContact O-CD2 3.15Å; Y381-F385 PolarHBondContact O-N 2.82Å; K382-F385 PolarHBondContact O-N 3.09Å; F385-K387 VanDerWaalsContact C-N 3.31Å; F385-K387 PolarHBondContact O-N 3.28Å; F385-L388 CarbonylContact O-C 3.59Å; F385-L388 PolarHBondContact O-N 3.46Å; F385-G389 PolarHBondContact O-N 3.27Å; F385-G389 VanDerWaalsContact O-N 3.14Å; F385-F390 HydrophobicContact CB-CB 4.37Å; F385-F390 HydrophobicContact CD1-CB 4.16Å; F385-F390 WeakPolarHBondContact O-CA 3.4Å; F385-F390 PolarHBondContact O-N 3.31Å; F385-G391 PolarHBondContact O-N 3.21Å; F385-G391 VanDerWaalsContact O-N 3.17Å
386	S	80	Confident	76.2	Confident	19 Å²	19	55.3 Å²	55.3	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-41.3	175.1	-63.3	0	0	0	0	111.6	K382 F383 L388 G389 G391 S398	K382-S386 VanDerWaalsContact O-CB 3.27Å; K382-S386 WeakPolarHBondContact O-CB 3.32Å; K382-S386 PolarHBondContact O-N 3.14Å; K382-S386 PolarHBondContact O-OG 3.46Å; F383-S386 PolarHBondContact O-N 3.15Å; S386-L388 VanDerWaalsContact C-N 3.32Å; S386-L388 PolarHBondContact O-N 3.05Å; S386-G389 PolarHBondContact O-N 3.42Å; S386-G389 VanDerWaalsContact O-N 3.08Å; S386-G391 WeakPolarHBondContact OG-CA 2.98Å; S386-S398 WeakPolarHBondContact OG-CB 3.25Å; S386-S398 PolarHBondContact OG-OG 3.3Å
387	K	82.3	Confident	77.3	Confident	33 Å²	33	55.4 Å²	55.4	14%	0.143	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-31.6	177.2	-170.6	156.7	-175.7	162.1	0	113.7	F383 I384 F385 G389 L402 F407 M489	F383-K387 HydrophobicContact CE1-CD 4.1Å; F383-K387 HydrophobicContact CE2-CD 4.29Å; F383-K387 HydrophobicContact CZ-CD 3.68Å; F383-K387 VanDerWaalsContact O-CB 3.24Å; F383-K387 WeakPolarHBondContact O-CB 3.48Å; F383-K387 PolarHBondContact O-N 3.27Å; I384-K387 PolarHBondContact O-N 3.03Å; F385-K387 VanDerWaalsContact C-N 3.31Å; F385-K387 PolarHBondContact O-N 3.28Å; K387-G389 VanDerWaalsContact C-N 3.26Å; K387-L402 HydrophobicContact CB-CD2 3.86Å; K387-L402 HydrophobicContact CD-CD2 4.28Å; K387-L402 HydrophobicContact CG-CD2 4.09Å; K387-F407 PolarHBondContact NZ-O 3.05Å; K387-M489 WeakPolarHBondContact CE-O 3.39Å; K387-M489 PolarHBondContact NZ-O 2.86Å
388	L	82.7	Confident	78.1	Confident	95 Å²	95	54.5 Å²	54.5	50%	0.497	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	1.6	173.7	-66.1	174.5	0	0	0	112.9	I384 F385 S386 F390	I384-L388 HydrophobicContact CG2-CD1 3.91Å; I384-L388 HydrophobicContact CG2-CG 4.46Å; I384-L388 WeakPolarHBondContact O-CB 3.37Å; I384-L388 VanDerWaalsContact O-CG 3.3Å; I384-L388 WeakPolarHBondContact O-CG 3.34Å; I384-L388 PolarHBondContact O-N 3.23Å; F385-L388 CarbonylContact O-C 3.59Å; F385-L388 PolarHBondContact O-N 3.46Å; S386-L388 VanDerWaalsContact C-N 3.32Å; S386-L388 PolarHBondContact O-N 3.05Å; L388-F390 HydrophobicContact CB-CD2 3.67Å; L388-F390 HydrophobicContact CB-CE2 3.94Å
389	G	80.9	Confident	78.7	Confident	64 Å²	64	53.9 Å²	53.9	66%	0.66	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	8	178.5	0	0	0	0	0	115.3	F385 S386 K387	F385-G389 PolarHBondContact O-N 3.27Å; F385-G389 VanDerWaalsContact O-N 3.14Å; S386-G389 PolarHBondContact O-N 3.42Å; S386-G389 VanDerWaalsContact O-N 3.08Å; K387-G389 VanDerWaalsContact C-N 3.26Å
390	F	80.4	Confident	79.3	Confident	161 Å²	161	54.9 Å²	54.9	71%	0.706	30%	0.295	S	S	*	.			trans	-100.2	-8.5	-179.6	-59.3	-66.3	0	0	0	114.1	F385 L388	F385-F390 HydrophobicContact CB-CB 4.37Å; F385-F390 HydrophobicContact CD1-CB 4.16Å; F385-F390 WeakPolarHBondContact O-CA 3.4Å; F385-F390 PolarHBondContact O-N 3.31Å; L388-F390 HydrophobicContact CB-CD2 3.67Å; L388-F390 HydrophobicContact CB-CE2 3.94Å
391	G	73.4	Confident	79.5	Confident	27 Å²	27	55.2 Å²	55.2	28%	0.278	29%	0.294	S	S	.	.	S	Bend	trans	-88.9	167.8	-178.6	0	0	0	0	0	113.8	F385 S386 A393	F385-G391 PolarHBondContact O-N 3.21Å; F385-G391 VanDerWaalsContact O-N 3.17Å; S386-G391 WeakPolarHBondContact OG-CA 2.98Å; G391-A393 PolarHBondContact O-N 3.29Å
392	S	74	Confident	79.8	Confident	74 Å²	74	54.4 Å²	54.4	52%	0.517	30%	0.295	S	S	.	.			trans	-62.5	121.8	174.4	173.7	0	0	0	0	110	R394 D395	S392-R394 PolarHBondContact O-N 2.92Å; S392-R394 PolarHBondContact OG-N 2.9Å; S392-D395 PolarHBondContact O-N 3.03Å
393	A	70.4	Confident	80.1	Confident	58 Å²	58	51.9 Å²	51.9	48%	0.479	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-0.3	175.3	0	0	0	0	0	113.3	G391 R399	G391-A393 PolarHBondContact O-N 3.29Å; A393-R399 PolarHBondContact O-NE 3.22Å; A393-R399 PolarHBondContact O-NH2 2.89Å
394	R	77.4	Confident	80.3	Confident	64 Å²	64	55.2 Å²	55.2	24%	0.242	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-16.1	-178.1	-65.6	-177.4	178.1	172.2	-2.2	114.7	S392 F396 L682 P683 G684	S392-R394 PolarHBondContact O-N 2.92Å; S392-R394 PolarHBondContact OG-N 2.9Å; R394-F396 PolarHBondContact O-N 3.4Å; R394-L682 PolarHBondContact NH2-O 3.16Å; R394-P683 PolarHBondContact NH2-O 3.32Å; R394-G684 PolarHBondContact NH1-O 3.37Å
395	D	81.7	Confident	80.3	Confident	29 Å²	29	55.5 Å²	55.5	16%	0.155	32%	0.317	C	S	.	.			trans	-60.7	116.9	-170.5	-179.7	80.9	0	0	0	111.6	K382 S392 E397 S398 R399	K382-D395 IonicContact NZ-OD1 3.42Å; S392-D395 PolarHBondContact O-N 3.03Å; D395-E397 VanDerWaalsContact C-N 3.33Å; D395-E397 PolarHBondContact O-N 3.11Å; D395-S398 PolarHBondContact O-N 3.17Å; D395-S398 VanDerWaalsContact OD2-CB 3.27Å; D395-S398 WeakPolarHBondContact OD2-CB 3.47Å; D395-S398 PolarHBondContact OD2-N 3.44Å; D395-S398 PolarHBondContact OD2-OG 3.23Å; D395-R399 PolarHBondContact O-N 3.49Å
396	F	82	Confident	80.1	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-51.1	-48.7	-178.7	171.9	-95.4	0	0	0	112.7	R394 R399 L400 F609 K619 Y622 L662 I665 I666 E669	R394-F396 PolarHBondContact O-N 3.4Å; F396-R399 PolarHBondContact O-N 2.96Å; F396-L400 HydrophobicContact CZ-CD2 4.48Å; F396-L400 WeakPolarHBondContact O-CB 3.27Å; F396-L400 PolarHBondContact O-N 3.07Å; F396-F609 HydrophobicContact CE1-CZ 4.11Å; F396-K619 HydrophobicContact CD1-CB 4.01Å; F396-K619 HydrophobicContact CD1-CD 4.39Å; F396-K619 HydrophobicContact CD1-CG 3.99Å; F396-K619 HydrophobicContact CE1-CB 4.04Å; F396-K619 HydrophobicContact CE1-CG 4.43Å; F396-K619 HydrophobicContact CG-CG 4.17Å; F396-Y622 HydrophobicContact CE2-CD2 4.18Å; F396-Y622 AromaticContact CZ-CD2 3.75Å; F396-Y622 HydrophobicContact CZ-CD2 3.75Å; F396-Y622 HydrophobicContact CZ-CE2 4.37Å; F396-L662 HydrophobicContact CE2-CD1 4.32Å; F396-I665 HydrophobicContact CD2-CG2 3.62Å; F396-I665 HydrophobicContact CE2-CG2 4.09Å; F396-I665 HydrophobicContact CG-CG2 4.45Å; F396-I666 HydrophobicContact CD2-CD1 3.74Å; F396-I666 HydrophobicContact CE2-CD1 3.5Å; F396-I666 VanDerWaalsContact CE2-CD1 3.5Å; F396-I666 HydrophobicContact CE2-CG1 4.32Å; F396-I666 HydrophobicContact CZ-CD1 4.48Å; F396-E669 HydrophobicContact CB-CB 4.16Å; F396-E669 HydrophobicContact CB-CG 3.9Å; F396-E669 WeakPolarHBondContact CB-OE2 3.46Å; F396-E669 PolarHBondContact N-OE2 2.64Å
397	E	81.4	Confident	80.2	Confident	18 Å²	18	51.7 Å²	51.7	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-50.1	-176.8	-58.6	-177.4	159.1	0	0	110.8	D395 R399 L400 Y401 R615	D395-E397 VanDerWaalsContact C-N 3.33Å; D395-E397 PolarHBondContact O-N 3.11Å; E397-R399 PolarHBondContact O-N 3.27Å; E397-L400 PolarHBondContact O-N 2.7Å; E397-Y401 WeakPolarHBondContact O-CD2 3.35Å; E397-Y401 PolarHBondContact O-N 2.89Å; E397-R615 WeakPolarHBondContact OE1-CB 3.25Å; E397-R615 VanDerWaalsContact OE1-CD 3.26Å; E397-R615 WeakPolarHBondContact OE1-CD 3.38Å; E397-R615 IonicContact OE1-CZ 3.05Å; E397-R615 IonicContact OE1-NE 3.08Å; E397-R615 PolarHBondContact OE1-NE 3.46Å; E397-R615 IonicContact OE2-NE 2.61Å; E397-R615 PolarHBondContact OE2-NE 2.51Å
398	S	81.4	Confident	80.3	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-43.5	179.8	-60.4	0	0	0	0	111.8	S386 D395 Y401 L402	S386-S398 WeakPolarHBondContact OG-CB 3.25Å; S386-S398 PolarHBondContact OG-OG 3.3Å; D395-S398 PolarHBondContact O-N 3.17Å; D395-S398 VanDerWaalsContact OD2-CB 3.27Å; D395-S398 WeakPolarHBondContact OD2-CB 3.47Å; D395-S398 PolarHBondContact OD2-N 3.44Å; D395-S398 PolarHBondContact OD2-OG 3.23Å; S398-Y401 PolarHBondContact O-N 3.37Å; S398-L402 WeakPolarHBondContact O-CB 3.46Å; S398-L402 VanDerWaalsContact O-CG 3.27Å; S398-L402 WeakPolarHBondContact O-CG 3.49Å; S398-L402 PolarHBondContact O-N 3.13Å
399	R	83.8	Confident	80.6	Confident	44 Å²	44	54.8 Å²	54.8	17%	0.166	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-40.1	-180	-81.6	-167.3	169.7	-110	-3.9	113	A393 D395 F396 E397 Y401 L402 C403 G659 I665	A393-R399 PolarHBondContact O-NE 3.22Å; A393-R399 PolarHBondContact O-NH2 2.89Å; D395-R399 PolarHBondContact O-N 3.49Å; F396-R399 PolarHBondContact O-N 2.96Å; E397-R399 PolarHBondContact O-N 3.27Å; R399-Y401 PolarHBondContact O-N 3.43Å; R399-L402 PolarHBondContact O-N 2.99Å; R399-C403 VanDerWaalsContact O-CB 3.25Å; R399-C403 WeakPolarHBondContact O-CB 3.45Å; R399-C403 PolarHBondContact O-N 3.27Å; R399-C403 PolarHBondContact O-SG 3.29Å; R399-G659 PolarHBondContact NH1-O 2.85Å; R399-I665 HydrophobicContact CB-CD1 4.45Å; R399-I665 HydrophobicContact CB-CG1 4.27Å; R399-I665 HydrophobicContact CB-CG2 4.01Å
400	L	83.6	Confident	81.1	Confident	40 Å²	40	52.7 Å²	52.7	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-57.1	-38.1	177.5	-169.3	67.6	0	0	0	111.3	F396 E397 F609	F396-L400 HydrophobicContact CZ-CD2 4.48Å; F396-L400 WeakPolarHBondContact O-CB 3.27Å; F396-L400 PolarHBondContact O-N 3.07Å; E397-L400 PolarHBondContact O-N 2.7Å; L400-F609 HydrophobicContact CD2-CE1 4.46Å
401	Y	79.1	Confident	81.6	Confident	44 Å²	44	47.7 Å²	47.7	17%	0.173	28%	0.277	C	S	.	.	H	α-helix	trans	-75.7	-47.3	173.9	-72.8	-68.6	0	0	0	113	F383 E397 S398 R399 C403 H404 F407	F383-Y401 HydrophobicContact CD2-CG 4.33Å; E397-Y401 WeakPolarHBondContact O-CD2 3.35Å; E397-Y401 PolarHBondContact O-N 2.89Å; S398-Y401 PolarHBondContact O-N 3.37Å; R399-Y401 PolarHBondContact O-N 3.43Å; Y401-C403 VanDerWaalsContact C-N 3.3Å; Y401-C403 PolarHBondContact O-N 2.99Å; Y401-H404 WeakPolarHBondContact O-CB 3.34Å; Y401-H404 PolarHBondContact O-N 3.49Å; Y401-H404 VanDerWaalsContact O-N 3.15Å; Y401-F407 HydrophobicContact CD1-CD2 4.04Å; Y401-F407 HydrophobicContact CD1-CE1 4.38Å; Y401-F407 AromaticContact CD1-CE2 3.48Å; Y401-F407 HydrophobicContact CD1-CE2 3.48Å; Y401-F407 VanDerWaalsContact CD1-CE2 3.48Å; Y401-F407 AromaticContact CD1-CZ 3.66Å; Y401-F407 HydrophobicContact CD1-CZ 3.66Å; Y401-F407 HydrophobicContact CE1-CE2 4.1Å; Y401-F407 HydrophobicContact CE1-CZ 4.03Å; Y401-F407 WeakPolarHBondContact O-CB 3.45Å; Y401-F407 WeakPolarHBondContact O-CD2 3.18Å
402	L	83.2	Confident	82.6	Confident	64 Å²	64	52.5 Å²	52.5	34%	0.335	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-35.1	-177	-72.4	170.9	0	0	0	113.3	F383 K387 S398 R399 H404	F383-L402 HydrophobicContact CD2-CD2 4.31Å; F383-L402 HydrophobicContact CD2-CG 4.34Å; F383-L402 HydrophobicContact CE2-CD2 3.84Å; F383-L402 HydrophobicContact CE2-CG 4.17Å; K387-L402 HydrophobicContact CB-CD2 3.86Å; K387-L402 HydrophobicContact CD-CD2 4.28Å; K387-L402 HydrophobicContact CG-CD2 4.09Å; S398-L402 WeakPolarHBondContact O-CB 3.46Å; S398-L402 VanDerWaalsContact O-CG 3.27Å; S398-L402 WeakPolarHBondContact O-CG 3.49Å; S398-L402 PolarHBondContact O-N 3.13Å; R399-L402 PolarHBondContact O-N 2.99Å; L402-H404 VanDerWaalsContact C-N 3.29Å
403	C	84.7	Confident	83.5	Confident	40 Å²	40	53.9 Å²	53.9	27%	0.27	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.7	178.6	-72	0	0	0	0	113.5	R399 Y401 C660 I665	R399-C403 VanDerWaalsContact O-CB 3.25Å; R399-C403 WeakPolarHBondContact O-CB 3.45Å; R399-C403 PolarHBondContact O-N 3.27Å; R399-C403 PolarHBondContact O-SG 3.29Å; Y401-C403 VanDerWaalsContact C-N 3.3Å; Y401-C403 PolarHBondContact O-N 2.99Å; C403-C660 VanDerWaalsContact CA-SG 3.58Å; C403-C660 HydrophobicContact CB-CB 3.45Å; C403-C660 VanDerWaalsContact CB-CB 3.45Å; C403-C660 WeakPolarHBondContact CB-SG 3.43Å; C403-C660 WeakPolarHBondContact SG-CA 3.41Å; C403-C660 WeakPolarHBondContact SG-CB 3.45Å; C403-C660 CovalentContact SG-SG 2.04Å; C403-C660 PolarHBondContact SG-SG 3.32Å; C403-I665 HydrophobicContact CB-CD1 4.49Å
404	H	83.6	Confident	84.7	Confident	98 Å²	98	51.1 Å²	51.1	45%	0.454	28%	0.275	S	S	.	.	S	Bend	trans	-84.1	125.8	178.3	-175.5	-81.2	0	0	0	110.4	Y401 L402 G406 F407	Y401-H404 WeakPolarHBondContact O-CB 3.34Å; Y401-H404 PolarHBondContact O-N 3.49Å; Y401-H404 VanDerWaalsContact O-N 3.15Å; L402-H404 VanDerWaalsContact C-N 3.29Å; H404-G406 PolarHBondContact ND1-N 2.99Å; H404-G406 PolarHBondContact O-N 2.78Å; H404-F407 HydrophobicContact CB-CD2 4.19Å; H404-F407 PolarHBondContact O-N 3.14Å
405	A	78.7	Confident	85.5	Confident	78 Å²	78	50 Å²	50	65%	0.645	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-52.8	-32.1	-175.9	0	0	0	0	0	114	F407 S408	A405-F407 PolarHBondContact O-N 3.38Å; A405-F407 VanDerWaalsContact O-N 3.16Å; A405-S408 WeakPolarHBondContact O-CB 3.31Å; A405-S408 PolarHBondContact O-N 3.03Å; A405-S408 VanDerWaalsContact O-N 3.09Å; A405-S408 PolarHBondContact O-OG 3.11Å
406	G	77.2	Confident	86.2	Confident	13 Å²	13	52.3 Å²	52.3	13%	0.134	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-61.6	-21.2	175.3	0	0	0	0	0	115.1	H404 A491 R492	H404-G406 PolarHBondContact ND1-N 2.99Å; H404-G406 PolarHBondContact O-N 2.78Å; G406-A491 PolarHBondContact O-N 2.9Å; G406-R492 WeakPolarHBondContact O-CB 3.12Å; G406-R492 PolarHBondContact O-N 3.25Å
407	F	82.6	Confident	86.9	Confident	38 Å²	38	54.5 Å²	54.5	17%	0.167	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-108.1	11.6	176.5	-61.6	-85.6	0	0	0	112.2	F383 K387 Y401 H404 A405	F383-F407 HydrophobicContact CE1-CD1 4.2Å; F383-F407 HydrophobicContact CE2-CB 4.27Å; F383-F407 HydrophobicContact CE2-CD1 4.32Å; F383-F407 HydrophobicContact CE2-CG 4.41Å; F383-F407 HydrophobicContact CZ-CB 4.01Å; F383-F407 AromaticContact CZ-CD1 3.65Å; F383-F407 HydrophobicContact CZ-CD1 3.65Å; F383-F407 HydrophobicContact CZ-CE1 4.46Å; F383-F407 HydrophobicContact CZ-CG 4.08Å; K387-F407 PolarHBondContact NZ-O 3.05Å; Y401-F407 HydrophobicContact CD1-CD2 4.04Å; Y401-F407 HydrophobicContact CD1-CE1 4.38Å; Y401-F407 AromaticContact CD1-CE2 3.48Å; Y401-F407 HydrophobicContact CD1-CE2 3.48Å; Y401-F407 VanDerWaalsContact CD1-CE2 3.48Å; Y401-F407 AromaticContact CD1-CZ 3.66Å; Y401-F407 HydrophobicContact CD1-CZ 3.66Å; Y401-F407 HydrophobicContact CE1-CE2 4.1Å; Y401-F407 HydrophobicContact CE1-CZ 4.03Å; Y401-F407 WeakPolarHBondContact O-CB 3.45Å; Y401-F407 WeakPolarHBondContact O-CD2 3.18Å; H404-F407 HydrophobicContact CB-CD2 4.19Å; H404-F407 PolarHBondContact O-N 3.14Å; A405-F407 PolarHBondContact O-N 3.38Å; A405-F407 VanDerWaalsContact O-N 3.16Å
408	S	84.9	Confident	87.6	Confident	54 Å²	54	53.6 Å²	53.6	38%	0.378	30%	0.295	S	S	.	.	S	Bend	trans	-69.5	166.6	166.9	72.9	0	0	0	0	110.4	A405 A490 A491	A405-S408 WeakPolarHBondContact O-CB 3.31Å; A405-S408 PolarHBondContact O-N 3.03Å; A405-S408 VanDerWaalsContact O-N 3.09Å; A405-S408 PolarHBondContact O-OG 3.11Å; S408-A490 WeakPolarHBondContact O-CA 3.01Å; S408-A491 PolarHBondContact O-N 3.28Å
409	F	88.7	Confident	88.4	Confident	139 Å²	139	56.5 Å²	56.5	61%	0.61	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-60.7	154.1	162.8	-65.9	-82.6	0	0	0	110	M488	F409-M488 VanDerWaalsContact CD1-O 3.3Å; F409-M488 WeakPolarHBondContact CD1-O 3.49Å
410	L	90.5	Very high	88.9	Confident	20 Å²	20	60 Å²	60	11%	0.105	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-65.6	132.1	177.5	-170.1	65.1	0	0	0	110.4	F414 F415 M488 A491 W497	L410-F414 HydrophobicContact CD1-CB 4.13Å; L410-F414 HydrophobicContact CD1-CD2 4.47Å; L410-F414 HydrophobicContact CD1-CG 4.13Å; L410-F414 HydrophobicContact CD2-CB 4.33Å; L410-F414 HydrophobicContact CD2-CD1 3.54Å; L410-F414 HydrophobicContact CD2-CE1 3.99Å; L410-F414 HydrophobicContact CD2-CG 3.94Å; L410-F414 HydrophobicContact CG-CB 4.1Å; L410-F414 HydrophobicContact CG-CD1 4.25Å; L410-F414 HydrophobicContact CG-CG 4.19Å; L410-F415 HydrophobicContact CD2-CE2 4.14Å; L410-F415 HydrophobicContact CD2-CZ 3.96Å; L410-M488 HydrophobicContact CB-SD 4.36Å; L410-M488 HydrophobicContact CD2-SD 4.01Å; L410-M488 PolarHBondContact N-O 2.97Å; L410-A491 HydrophobicContact CD1-CB 4.3Å; L410-W497 HydrophobicContact CD2-CZ3 3.96Å
411	S	91.6	Very high	89.5	Confident	56 Å²	56	58.2 Å²	58.2	39%	0.392	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-71.1	153.9	178.7	65	0	0	0	0	111.7	D413 F414	S411-D413 PolarHBondContact O-N 3.38Å; S411-F414 PolarHBondContact O-N 3.02Å
412	N	93.1	Very high	90.4	Very high	127 Å²	127	58.5 Å²	58.5	68%	0.679	33%	0.326	S	S	*	.	H	α-helix	trans	-66.4	-23.5	176.3	-73	-30	0	0	0	112.8	F414 F415 V416	N412-F414 PolarHBondContact O-N 2.82Å; N412-F415 PolarHBondContact O-N 2.69Å; N412-V416 PolarHBondContact O-N 3.25Å
413	D	94.1	Very high	91.1	Very high	103 Å²	103	55.5 Å²	55.5	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-57.2	-37.9	178.1	-55	-38.3	0	0	0	111.8	S411 F415 V416 D417	S411-D413 PolarHBondContact O-N 3.38Å; D413-F415 VanDerWaalsContact C-N 3.3Å; D413-F415 PolarHBondContact O-N 3.5Å; D413-V416 PolarHBondContact O-N 3.18Å; D413-V416 VanDerWaalsContact O-N 3.15Å; D413-D417 WeakPolarHBondContact O-CB 3.14Å; D413-D417 PolarHBondContact O-N 3.18Å
414	F	94.6	Very high	91.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-54.1	-45.5	174.9	172.8	-93.5	0	0	0	112.2	Y205 L410 S411 N412 T418 V494 W497 M498 M501	Y205-F414 AromaticContact CD1-CD2 3.88Å; Y205-F414 HydrophobicContact CD1-CD2 3.88Å; Y205-F414 HydrophobicContact CD1-CE2 4.37Å; Y205-F414 HydrophobicContact CD2-CD2 4.05Å; Y205-F414 HydrophobicContact CD2-CE2 4.28Å; Y205-F414 HydrophobicContact CE1-CD2 4.04Å; Y205-F414 HydrophobicContact CE2-CD2 4.22Å; Y205-F414 AromaticContact CG-CD2 3.89Å; Y205-F414 HydrophobicContact CG-CD2 3.89Å; Y205-F414 HydrophobicContact CG-CE2 4.03Å; L410-F414 HydrophobicContact CD1-CB 4.13Å; L410-F414 HydrophobicContact CD1-CD2 4.47Å; L410-F414 HydrophobicContact CD1-CG 4.13Å; L410-F414 HydrophobicContact CD2-CB 4.33Å; L410-F414 HydrophobicContact CD2-CD1 3.54Å; L410-F414 HydrophobicContact CD2-CE1 3.99Å; L410-F414 HydrophobicContact CD2-CG 3.94Å; L410-F414 HydrophobicContact CG-CB 4.1Å; L410-F414 HydrophobicContact CG-CD1 4.25Å; L410-F414 HydrophobicContact CG-CG 4.19Å; S411-F414 PolarHBondContact O-N 3.02Å; N412-F414 PolarHBondContact O-N 2.82Å; F414-T418 HydrophobicContact CD2-CG2 4.27Å; F414-T418 HydrophobicContact CE1-CG2 4.3Å; F414-T418 HydrophobicContact CE2-CG2 3.89Å; F414-T418 HydrophobicContact CZ-CG2 3.91Å; F414-T418 WeakPolarHBondContact O-CB 3.35Å; F414-T418 WeakPolarHBondContact O-CG2 3.43Å; F414-T418 PolarHBondContact O-N 2.86Å; F414-T418 PolarHBondContact O-OG1 2.85Å; F414-V494 HydrophobicContact CD2-CG2 3.95Å; F414-V494 HydrophobicContact CE2-CG2 3.43Å; F414-V494 VanDerWaalsContact CE2-CG2 3.43Å; F414-V494 HydrophobicContact CZ-CG2 4.12Å; F414-W497 HydrophobicContact CE1-CE3 4.23Å; F414-W497 HydrophobicContact CE1-CH2 4.26Å; F414-W497 AromaticContact CE1-CZ3 3.67Å; F414-W497 HydrophobicContact CE1-CZ3 3.67Å; F414-W497 HydrophobicContact CZ-CE3 4.22Å; F414-W497 HydrophobicContact CZ-CZ3 4.12Å; F414-M498 HydrophobicContact CE2-SD 4.14Å; F414-M498 HydrophobicContact CZ-SD 4.17Å; F414-M501 HydrophobicContact CE1-SD 4.49Å; F414-M501 HydrophobicContact CZ-CE 4.31Å; F414-M501 HydrophobicContact CZ-SD 4.05Å
415	F	95.9	Very high	92.3	Very high	40 Å²	40	53.2 Å²	53.2	18%	0.175	30%	0.3	C	S	.	.	H	α-helix	trans	-70.8	-37.2	-179.4	-65.4	-68.4	0	0	0	112.1	L410 N412 D413 T418 T419 F424 M488 W497	L410-F415 HydrophobicContact CD2-CE2 4.14Å; L410-F415 HydrophobicContact CD2-CZ 3.96Å; N412-F415 PolarHBondContact O-N 2.69Å; D413-F415 VanDerWaalsContact C-N 3.3Å; D413-F415 PolarHBondContact O-N 3.5Å; F415-T418 PolarHBondContact O-OG1 3.16Å; F415-T419 WeakPolarHBondContact O-CB 3.12Å; F415-T419 PolarHBondContact O-N 3.3Å; F415-T419 PolarHBondContact O-OG1 3.33Å; F415-F424 HydrophobicContact CD1-CD1 4.35Å; F415-F424 HydrophobicContact CD1-CD2 4.03Å; F415-F424 AromaticContact CD1-CE1 3.9Å; F415-F424 HydrophobicContact CD1-CE1 3.9Å; F415-F424 AromaticContact CD1-CE2 3.53Å; F415-F424 HydrophobicContact CD1-CE2 3.53Å; F415-F424 HydrophobicContact CD1-CG 4.4Å; F415-F424 AromaticContact CD1-CZ 3.45Å; F415-F424 HydrophobicContact CD1-CZ 3.45Å; F415-F424 VanDerWaalsContact CD1-CZ 3.45Å; F415-F424 HydrophobicContact CE1-CD2 4.29Å; F415-F424 HydrophobicContact CE1-CE1 4.47Å; F415-F424 AromaticContact CE1-CE2 3.49Å; F415-F424 HydrophobicContact CE1-CE2 3.49Å; F415-F424 VanDerWaalsContact CE1-CE2 3.49Å; F415-F424 AromaticContact CE1-CZ 3.58Å; F415-F424 HydrophobicContact CE1-CZ 3.58Å; F415-M488 HydrophobicContact CE2-CE 4.12Å; F415-M488 HydrophobicContact CE2-SD 4.12Å; F415-M488 HydrophobicContact CZ-CE 4Å; F415-M488 HydrophobicContact CZ-SD 3.53Å; F415-M488 VanDerWaalsContact CZ-SD 3.53Å; F415-W497 HydrophobicContact CE1-CH2 4.14Å; F415-W497 HydrophobicContact CE1-CZ3 4.5Å
416	V	96.4	Very high	93.2	Very high	79 Å²	79	51 Å²	51	48%	0.479	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-50.2	176.5	173.3	0	0	0	0	109.8	N412 D413 T419 K420	N412-V416 PolarHBondContact O-N 3.25Å; D413-V416 PolarHBondContact O-N 3.18Å; D413-V416 VanDerWaalsContact O-N 3.15Å; V416-T419 PolarHBondContact O-N 3.16Å; V416-K420 WeakPolarHBondContact O-CG 3.36Å; V416-K420 PolarHBondContact O-N 2.95Å
417	D	94.9	Very high	94.2	Very high	46 Å²	46	50.4 Å²	50.4	25%	0.246	27%	0.271	C	S	.	.	H	α-helix	trans	-66.5	-46	-177.1	-67.3	-22.2	0	0	0	112.3	H202 Y205 D413 T419 K420 S421	H202-D417 PolarHBondContact CE1-O 2.81Å; Y205-D417 HydrophobicContact CE2-CB 4.44Å; Y205-D417 PolarHBondContact OH-OD2 3.26Å; D413-D417 WeakPolarHBondContact O-CB 3.14Å; D413-D417 PolarHBondContact O-N 3.18Å; D417-T419 PolarHBondContact O-N 3.01Å; D417-K420 WeakPolarHBondContact O-CB 3.33Å; D417-K420 PolarHBondContact O-N 2.82Å; D417-K420 IonicContact OD1-NZ 2.81Å; D417-K420 PolarHBondContact OD1-NZ 3.12Å; D417-S421 PolarHBondContact O-N 2.99Å
418	T	96.9	Very high	94.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-25	176.9	55.5	0	0	0	0	112.6	F414 F415 S421 L423 F424 M498	F414-T418 HydrophobicContact CD2-CG2 4.27Å; F414-T418 HydrophobicContact CE1-CG2 4.3Å; F414-T418 HydrophobicContact CE2-CG2 3.89Å; F414-T418 HydrophobicContact CZ-CG2 3.91Å; F414-T418 WeakPolarHBondContact O-CB 3.35Å; F414-T418 WeakPolarHBondContact O-CG2 3.43Å; F414-T418 PolarHBondContact O-N 2.86Å; F414-T418 PolarHBondContact O-OG1 2.85Å; F415-T418 PolarHBondContact O-OG1 3.16Å; T418-S421 PolarHBondContact O-OG 3.1Å; T418-L423 HydrophobicContact CG2-CD2 4.33Å; T418-L423 PolarHBondContact O-N 3.48Å; T418-L423 VanDerWaalsContact O-N 3.13Å; T418-F424 PolarHBondContact O-N 3.15Å; T418-F424 VanDerWaalsContact O-N 3.14Å; T418-F424 WeakPolarHBondContact OG1-CB 3.29Å; T418-M498 HydrophobicContact CG2-CE 4.18Å; T418-M498 HydrophobicContact CG2-SD 4.19Å
419	T	97.4	Very high	95.4	Very high	63 Å²	63	53.2 Å²	53.2	39%	0.387	29%	0.285	S	S	.	.	H	α-helix	trans	-74.4	-39.2	172.3	-62.5	0	0	0	0	112.5	F415 V416 D417 S421 T422 P425	F415-T419 WeakPolarHBondContact O-CB 3.12Å; F415-T419 PolarHBondContact O-N 3.3Å; F415-T419 PolarHBondContact O-OG1 3.33Å; V416-T419 PolarHBondContact O-N 3.16Å; D417-T419 PolarHBondContact O-N 3.01Å; T419-S421 PolarHBondContact O-N 3.14Å; T419-T422 WeakPolarHBondContact O-CA 3.36Å; T419-T422 PolarHBondContact O-N 3.39Å; T419-P425 HydrophobicContact CG2-CG 3.88Å
420	K	96	Very high	95.7	Very high	119 Å²	119	46.9 Å²	46.9	52%	0.517	26%	0.257	S	S	.	.	H	α-helix	trans	-53.7	-43	175.1	-70.5	169.8	-170.4	155.1	0	111.6	V416 D417 T422 Y544	V416-K420 WeakPolarHBondContact O-CG 3.36Å; V416-K420 PolarHBondContact O-N 2.95Å; D417-K420 WeakPolarHBondContact O-CB 3.33Å; D417-K420 PolarHBondContact O-N 2.82Å; D417-K420 IonicContact OD1-NZ 2.81Å; D417-K420 PolarHBondContact OD1-NZ 3.12Å; K420-T422 PolarHBondContact O-N 2.71Å; K420-Y544 WeakPolarHBondContact O-CE1 3.42Å; K420-Y544 PolarHBondContact O-OH 3.14Å; K420-Y544 VanDerWaalsContact O-OH 3.11Å
421	S	96.1	Very high	96	Very high	1 Å²	1	47 Å²	47	1%	0.007	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-3.2	177.7	71.8	0	0	0	0	115.3	F198 H202 D417 T418 T419 L423 N545	F198-S421 WeakPolarHBondContact CE1-O 3.35Å; H202-S421 WeakPolarHBondContact NE2-CB 3.21Å; H202-S421 PolarHBondContact NE2-OG 2.66Å; D417-S421 PolarHBondContact O-N 2.99Å; T418-S421 PolarHBondContact O-OG 3.1Å; T419-S421 PolarHBondContact O-N 3.14Å; S421-L423 PolarHBondContact O-N 3.32Å; S421-L423 VanDerWaalsContact OG-CB 3.23Å; S421-L423 WeakPolarHBondContact OG-CB 3.3Å; S421-L423 PolarHBondContact OG-N 3.29Å; S421-N545 WeakPolarHBondContact CB-OD1 3.44Å; S421-N545 PolarHBondContact O-ND2 3.2Å; S421-N545 PolarHBondContact O-OD1 2.92Å
422	T	96.5	Very high	96.2	Very high	51 Å²	51	48.8 Å²	48.8	31%	0.313	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	-1.4	-168	73.9	0	0	0	0	116.1	T419 K420 P425 L426 Y544	T419-T422 WeakPolarHBondContact O-CA 3.36Å; T419-T422 PolarHBondContact O-N 3.39Å; K420-T422 PolarHBondContact O-N 2.71Å; T422-P425 WeakPolarHBondContact O-CD 3.47Å; T422-L426 WeakPolarHBondContact O-CB 3.33Å; T422-L426 VanDerWaalsContact O-CG 3.26Å; T422-L426 WeakPolarHBondContact O-CG 3.45Å; T422-L426 PolarHBondContact O-N 2.83Å; T422-L426 VanDerWaalsContact O-N 3.09Å; T422-Y544 HydrophobicContact CG2-CE1 4.31Å
423	L	97.9	Very high	96.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-54.5	-178.2	175.5	67.9	0	0	0	112.7	F198 T418 S421 L426 Y427 M498 M501 A505	F198-L423 HydrophobicContact CB-CD1 4.05Å; F198-L423 HydrophobicContact CD1-CB 4.01Å; F198-L423 HydrophobicContact CD1-CD1 4.07Å; F198-L423 HydrophobicContact CD2-CD1 3.67Å; F198-L423 HydrophobicContact CE1-CB 4.08Å; F198-L423 HydrophobicContact CE1-CD1 4.42Å; F198-L423 HydrophobicContact CE2-CD1 4.04Å; F198-L423 HydrophobicContact CG-CB 4.49Å; F198-L423 HydrophobicContact CG-CD1 3.7Å; F198-L423 HydrophobicContact CZ-CD1 4.42Å; T418-L423 HydrophobicContact CG2-CD2 4.33Å; T418-L423 PolarHBondContact O-N 3.48Å; T418-L423 VanDerWaalsContact O-N 3.13Å; S421-L423 PolarHBondContact O-N 3.32Å; S421-L423 VanDerWaalsContact OG-CB 3.23Å; S421-L423 WeakPolarHBondContact OG-CB 3.3Å; S421-L423 PolarHBondContact OG-N 3.29Å; L423-L426 PolarHBondContact O-N 2.93Å; L423-Y427 WeakPolarHBondContact O-CB 3.44Å; L423-Y427 PolarHBondContact O-N 3.47Å; L423-M498 HydrophobicContact CD2-CE 3.03Å; L423-M498 HydrophobicContact CD2-SD 3.69Å; L423-M501 HydrophobicContact CD1-CB 4.49Å; L423-M501 HydrophobicContact CD2-CE 4.24Å; L423-M501 HydrophobicContact CG-CE 4.27Å; L423-A505 HydrophobicContact CD1-CB 3.52Å
424	F	97.5	Very high	96	Very high	37 Å²	37	39.6 Å²	39.6	16%	0.162	23%	0.226	C	C	.	.	H	α-helix	trans	-65.4	-44.1	-175.6	-179.8	-102.8	0	0	0	112.9	F415 T418 L426 Y427 M428 W497 M501	F415-F424 HydrophobicContact CD1-CD1 4.35Å; F415-F424 HydrophobicContact CD1-CD2 4.03Å; F415-F424 AromaticContact CD1-CE1 3.9Å; F415-F424 HydrophobicContact CD1-CE1 3.9Å; F415-F424 AromaticContact CD1-CE2 3.53Å; F415-F424 HydrophobicContact CD1-CE2 3.53Å; F415-F424 HydrophobicContact CD1-CG 4.4Å; F415-F424 AromaticContact CD1-CZ 3.45Å; F415-F424 HydrophobicContact CD1-CZ 3.45Å; F415-F424 VanDerWaalsContact CD1-CZ 3.45Å; F415-F424 HydrophobicContact CE1-CD2 4.29Å; F415-F424 HydrophobicContact CE1-CE1 4.47Å; F415-F424 AromaticContact CE1-CE2 3.49Å; F415-F424 HydrophobicContact CE1-CE2 3.49Å; F415-F424 VanDerWaalsContact CE1-CE2 3.49Å; F415-F424 AromaticContact CE1-CZ 3.58Å; F415-F424 HydrophobicContact CE1-CZ 3.58Å; T418-F424 PolarHBondContact O-N 3.15Å; T418-F424 VanDerWaalsContact O-N 3.14Å; T418-F424 WeakPolarHBondContact OG1-CB 3.29Å; F424-L426 PolarHBondContact O-N 3.34Å; F424-Y427 HydrophobicContact CD2-CD1 4.4Å; F424-Y427 PolarHBondContact O-N 3.18Å; F424-M428 HydrophobicContact CD1-CG 4.34Å; F424-M428 HydrophobicContact CD2-CE 4.22Å; F424-M428 HydrophobicContact CD2-CG 4.46Å; F424-M428 HydrophobicContact CE1-CE 4.32Å; F424-M428 HydrophobicContact CE1-CG 3.99Å; F424-M428 HydrophobicContact CE2-CE 3.23Å; F424-M428 HydrophobicContact CE2-CG 4.13Å; F424-M428 HydrophobicContact CZ-CE 3.31Å; F424-M428 HydrophobicContact CZ-CG 3.89Å; F424-M428 HydrophobicContact CZ-SD 4.37Å; F424-M428 WeakPolarHBondContact O-CB 3.28Å; F424-M428 WeakPolarHBondContact O-CG 3.23Å; F424-M428 PolarHBondContact O-N 2.98Å; F424-W497 HydrophobicContact CE2-CH2 4.32Å; F424-M501 HydrophobicContact CB-CE 4.22Å; F424-M501 HydrophobicContact CD2-CE 3.78Å
425	P	97.7	Very high	95.9	Very high	54 Å²	54	43 Å²	43	35%	0.351	24%	0.241	S	C	.	.	H	α-helix	trans	-55.6	-47.6	170.8	-28.8	34.6	0	0	0	113.7	T419 T422 Y427 M428 V429	T419-P425 HydrophobicContact CG2-CG 3.88Å; T422-P425 WeakPolarHBondContact O-CD 3.47Å; P425-Y427 PolarHBondContact O-N 3.44Å; P425-M428 PolarHBondContact O-N 3.41Å; P425-V429 WeakPolarHBondContact O-CG2 3.33Å; P425-V429 PolarHBondContact O-N 3.41Å
426	L	97.5	Very high	95.7	Very high	31 Å²	31	48.1 Å²	48.1	16%	0.162	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-41.4	178.7	-71.4	172.1	0	0	0	111.6	F198 T422 L423 F424 V429 M430 A505 V508 L509	F198-L426 HydrophobicContact CE2-CD1 4.47Å; F198-L426 HydrophobicContact CZ-CD1 3.87Å; T422-L426 WeakPolarHBondContact O-CB 3.33Å; T422-L426 VanDerWaalsContact O-CG 3.26Å; T422-L426 WeakPolarHBondContact O-CG 3.45Å; T422-L426 PolarHBondContact O-N 2.83Å; T422-L426 VanDerWaalsContact O-N 3.09Å; L423-L426 PolarHBondContact O-N 2.93Å; F424-L426 PolarHBondContact O-N 3.34Å; L426-V429 PolarHBondContact O-N 3.23Å; L426-M430 PolarHBondContact O-N 3.27Å; L426-A505 HydrophobicContact CB-CB 3.85Å; L426-V508 WeakPolarHBondContact O-CG2 3.22Å; L426-L509 HydrophobicContact CD1-CD1 3.96Å; L426-L509 HydrophobicContact CD1-CG 4.43Å; L426-L509 HydrophobicContact CD2-CD1 4.44Å; L426-L509 HydrophobicContact CD2-CD2 4.04Å; L426-L509 HydrophobicContact CD2-CG 4.24Å
427	Y	97.9	Very high	95.2	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-45.4	172.9	168.7	-104.9	0	0	0	111.9	L423 F424 P425 V429 M430 L431 S480 W497 M501 L504	L423-Y427 WeakPolarHBondContact O-CB 3.44Å; L423-Y427 PolarHBondContact O-N 3.47Å; F424-Y427 HydrophobicContact CD2-CD1 4.4Å; F424-Y427 PolarHBondContact O-N 3.18Å; P425-Y427 PolarHBondContact O-N 3.44Å; Y427-V429 VanDerWaalsContact C-N 3.35Å; Y427-V429 PolarHBondContact O-N 3.31Å; Y427-M430 VanDerWaalsContact O-CB 3.3Å; Y427-M430 WeakPolarHBondContact O-CB 3.48Å; Y427-M430 PolarHBondContact O-N 3.01Å; Y427-M430 VanDerWaalsContact O-N 3.12Å; Y427-L431 HydrophobicContact CE1-CD2 3.94Å; Y427-L431 HydrophobicContact CE2-CD1 4.42Å; Y427-L431 WeakPolarHBondContact O-CB 3.49Å; Y427-L431 PolarHBondContact O-N 3.43Å; Y427-S480 WeakPolarHBondContact CE2-OG 3.26Å; Y427-S480 PolarHBondContact OH-OG 3.23Å; Y427-W497 AromaticContact CE1-CZ2 3.82Å; Y427-W497 HydrophobicContact CE1-CZ2 3.82Å; Y427-W497 AromaticContact CE1-NE1 3.94Å; Y427-W497 AromaticContact CZ-NE1 3.59Å; Y427-W497 PolarHBondContact OH-NE1 3.29Å; Y427-M501 HydrophobicContact CD1-CE 4.28Å; Y427-M501 HydrophobicContact CD1-CG 4.05Å; Y427-M501 HydrophobicContact CD2-CB 4.11Å; Y427-M501 HydrophobicContact CD2-CG 3.83Å; Y427-M501 HydrophobicContact CE1-CG 4.19Å; Y427-M501 HydrophobicContact CE2-CG 3.98Å; Y427-M501 HydrophobicContact CG-CB 4.21Å; Y427-M501 HydrophobicContact CG-CE 4.43Å; Y427-M501 HydrophobicContact CG-CG 3.86Å; Y427-L504 HydrophobicContact CD2-CB 4.08Å; Y427-L504 HydrophobicContact CD2-CD1 4.28Å; Y427-L504 HydrophobicContact CE2-CB 4.46Å; Y427-L504 HydrophobicContact CE2-CD1 3.81Å
428	M	97.5	Very high	94.8	Very high	59 Å²	59	44.5 Å²	44.5	29%	0.291	24%	0.242	S	C	.	.	H	α-helix	trans	-65.2	-37.3	178.9	-77	-61.5	165.4	0	0	112.4	F424 P425 M430 L431 V432	F424-M428 HydrophobicContact CD1-CG 4.34Å; F424-M428 HydrophobicContact CD2-CE 4.22Å; F424-M428 HydrophobicContact CD2-CG 4.46Å; F424-M428 HydrophobicContact CE1-CE 4.32Å; F424-M428 HydrophobicContact CE1-CG 3.99Å; F424-M428 HydrophobicContact CE2-CE 3.23Å; F424-M428 HydrophobicContact CE2-CG 4.13Å; F424-M428 HydrophobicContact CZ-CE 3.31Å; F424-M428 HydrophobicContact CZ-CG 3.89Å; F424-M428 HydrophobicContact CZ-SD 4.37Å; F424-M428 WeakPolarHBondContact O-CB 3.28Å; F424-M428 WeakPolarHBondContact O-CG 3.23Å; F424-M428 PolarHBondContact O-N 2.98Å; P425-M428 PolarHBondContact O-N 3.41Å; M428-M430 VanDerWaalsContact C-N 3.33Å; M428-M430 PolarHBondContact O-N 3.25Å; M428-L431 HydrophobicContact CE-CD2 4.19Å; M428-L431 PolarHBondContact O-N 2.78Å; M428-L431 HydrophobicContact SD-CD2 3.82Å; M428-V432 WeakPolarHBondContact O-CB 3.47Å; M428-V432 WeakPolarHBondContact O-CG2 3.49Å; M428-V432 PolarHBondContact O-N 3.41Å
429	V	95.9	Very high	94.3	Very high	91 Å²	91	45.8 Å²	45.8	55%	0.552	26%	0.256	S	S	*	.	H	α-helix	trans	-60	-43.3	170.8	172	0	0	0	0	110.9	P425 L426 Y427 G433 V508	P425-V429 WeakPolarHBondContact O-CG2 3.33Å; P425-V429 PolarHBondContact O-N 3.41Å; L426-V429 PolarHBondContact O-N 3.23Å; Y427-V429 VanDerWaalsContact C-N 3.35Å; Y427-V429 PolarHBondContact O-N 3.31Å; V429-G433 WeakPolarHBondContact O-CA 3.47Å; V429-G433 PolarHBondContact O-N 3Å; V429-V508 HydrophobicContact CG1-CG1 4.19Å
430	M	95.1	Very high	93.7	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-51.1	174.5	-167.9	52.1	102	0	0	111.7	L426 Y427 M428 C434 L473 V477 L504 C507 V508 L514	L426-M430 PolarHBondContact O-N 3.27Å; Y427-M430 VanDerWaalsContact O-CB 3.3Å; Y427-M430 WeakPolarHBondContact O-CB 3.48Å; Y427-M430 PolarHBondContact O-N 3.01Å; Y427-M430 VanDerWaalsContact O-N 3.12Å; M428-M430 VanDerWaalsContact C-N 3.33Å; M428-M430 PolarHBondContact O-N 3.25Å; M430-C434 VanDerWaalsContact O-CB 3.23Å; M430-C434 WeakPolarHBondContact O-CB 3.4Å; M430-C434 PolarHBondContact O-N 2.76Å; M430-C434 PolarHBondContact O-SG 2.9Å; M430-L473 HydrophobicContact CE-CD1 4.21Å; M430-L473 HydrophobicContact SD-CD1 4.35Å; M430-V477 HydrophobicContact CG-CG2 4.44Å; M430-L504 WeakPolarHBondContact CE-O 3.45Å; M430-L504 HydrophobicContact CG-CB 4.17Å; M430-L504 HydrophobicContact CG-CD2 4.22Å; M430-C507 HydrophobicContact CE-CB 3.5Å; M430-V508 HydrophobicContact CB-CG2 3.33Å; M430-V508 HydrophobicContact CE-CB 4.25Å; M430-V508 HydrophobicContact CE-CG2 3.48Å; M430-V508 VanDerWaalsContact CE-CG2 3.48Å; M430-V508 VanDerWaalsContact CE-N 3.3Å; M430-V508 HydrophobicContact CG-CG2 3.89Å; M430-V508 HydrophobicContact SD-CG2 3.78Å; M430-L514 HydrophobicContact CE-CD1 3.49Å; M430-L514 VanDerWaalsContact CE-CD1 3.49Å; M430-L514 HydrophobicContact SD-CD1 3.83Å
431	L	95.8	Very high	92.9	Very high	22 Å²	22	41.2 Å²	41.2	12%	0.115	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-56.1	-172.4	-170.1	72.4	0	0	0	110.2	Y427 M428 C434 F435 V477 A481	Y427-L431 HydrophobicContact CE1-CD2 3.94Å; Y427-L431 HydrophobicContact CE2-CD1 4.42Å; Y427-L431 WeakPolarHBondContact O-CB 3.49Å; Y427-L431 PolarHBondContact O-N 3.43Å; M428-L431 HydrophobicContact CE-CD2 4.19Å; M428-L431 PolarHBondContact O-N 2.78Å; M428-L431 HydrophobicContact SD-CD2 3.82Å; L431-C434 PolarHBondContact O-N 2.73Å; L431-F435 HydrophobicContact CD1-CD2 4.09Å; L431-F435 HydrophobicContact CD1-CE2 3.52Å; L431-F435 HydrophobicContact CD1-CZ 4.48Å; L431-F435 HydrophobicContact CG-CD2 3.96Å; L431-F435 HydrophobicContact CG-CE2 3.82Å; L431-F435 WeakPolarHBondContact O-CD2 3.41Å; L431-F435 PolarHBondContact O-N 2.99Å; L431-V477 HydrophobicContact CD1-CG1 3.98Å; L431-A481 HydrophobicContact CD1-CB 4.07Å
432	V	95.2	Very high	92.2	Very high	95 Å²	95	42.1 Å²	42.1	58%	0.576	24%	0.236	S	C	*	.	H	α-helix	trans	-65.4	-43.7	-179.7	176.8	0	0	0	0	110.6	M428 C434 F435 F436	M428-V432 WeakPolarHBondContact O-CB 3.47Å; M428-V432 WeakPolarHBondContact O-CG2 3.49Å; M428-V432 PolarHBondContact O-N 3.41Å; V432-C434 PolarHBondContact O-N 3.11Å; V432-F435 PolarHBondContact O-N 3.45Å; V432-F436 VanDerWaalsContact O-CB 3.23Å; V432-F436 WeakPolarHBondContact O-CB 3.5Å; V432-F436 PolarHBondContact O-N 3.09Å
433	G	91.7	Very high	91.4	Very high	34 Å²	34	43.8 Å²	43.8	35%	0.351	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-44.7	178.1	0	0	0	0	0	112.6	V429 V437	V429-G433 WeakPolarHBondContact O-CA 3.47Å; V429-G433 PolarHBondContact O-N 3Å; G433-V437 WeakPolarHBondContact O-CG2 3.21Å; G433-V437 PolarHBondContact O-N 3.37Å; G433-V437 VanDerWaalsContact O-N 3.09Å
434	C	92.2	Very high	90.4	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.02	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-47.9	177.1	-71.3	0	0	0	0	111.8	M430 L431 V432 F436 V437 I438 F467 V477	M430-C434 VanDerWaalsContact O-CB 3.23Å; M430-C434 WeakPolarHBondContact O-CB 3.4Å; M430-C434 PolarHBondContact O-N 2.76Å; M430-C434 PolarHBondContact O-SG 2.9Å; L431-C434 PolarHBondContact O-N 2.73Å; V432-C434 PolarHBondContact O-N 3.11Å; C434-F436 VanDerWaalsContact C-N 3.31Å; C434-F436 PolarHBondContact O-N 3.4Å; C434-V437 PolarHBondContact O-N 2.69Å; C434-I438 WeakPolarHBondContact O-CB 3.21Å; C434-I438 VanDerWaalsContact O-CG1 3.25Å; C434-I438 WeakPolarHBondContact O-CG1 3.32Å; C434-I438 PolarHBondContact O-N 2.85Å; C434-F467 HydrophobicContact CB-CE1 4.48Å; C434-F467 HydrophobicContact CB-CZ 3.76Å; C434-V477 HydrophobicContact CB-CB 4.42Å; C434-V477 HydrophobicContact CB-CG1 3.86Å; C434-V477 HydrophobicContact CB-CG2 3.94Å
435	F	92.6	Very high	89.2	Confident	72 Å²	72	48.1 Å²	48.1	32%	0.316	26%	0.263	S	S	.	.	H	α-helix	trans	-62.9	-36.7	177.9	-79.3	-57.1	0	0	0	112.8	L431 V432 I438 G439 V477 F478 A481	L431-F435 HydrophobicContact CD1-CD2 4.09Å; L431-F435 HydrophobicContact CD1-CE2 3.52Å; L431-F435 HydrophobicContact CD1-CZ 4.48Å; L431-F435 HydrophobicContact CG-CD2 3.96Å; L431-F435 HydrophobicContact CG-CE2 3.82Å; L431-F435 WeakPolarHBondContact O-CD2 3.41Å; L431-F435 PolarHBondContact O-N 2.99Å; V432-F435 PolarHBondContact O-N 3.45Å; F435-I438 PolarHBondContact O-N 3.45Å; F435-G439 PolarHBondContact O-N 2.88Å; F435-V477 HydrophobicContact CD2-CG1 4.36Å; F435-V477 HydrophobicContact CE2-CG1 4.04Å; F435-V477 HydrophobicContact CZ-CG1 4.11Å; F435-F478 HydrophobicContact CD1-CE2 4.27Å; F435-F478 HydrophobicContact CD1-CZ 4.39Å; F435-F478 HydrophobicContact CE1-CD1 4.36Å; F435-F478 AromaticContact CE1-CD2 3.96Å; F435-F478 HydrophobicContact CE1-CD2 3.96Å; F435-F478 HydrophobicContact CE1-CE1 4.08Å; F435-F478 AromaticContact CE1-CE2 3.66Å; F435-F478 HydrophobicContact CE1-CE2 3.66Å; F435-F478 HydrophobicContact CE1-CG 4.32Å; F435-F478 AromaticContact CE1-CZ 3.74Å; F435-F478 HydrophobicContact CE1-CZ 3.74Å; F435-A481 HydrophobicContact CE2-CB 3.94Å; F435-A481 HydrophobicContact CZ-CB 3.8Å
436	F	90.6	Very high	88.1	Confident	147 Å²	147	46.9 Å²	46.9	65%	0.645	25%	0.251	S	S	*	.	H	α-helix	trans	-61.5	-48.2	174.3	178.4	-97.4	0	0	0	111.5	V432 C434 G439 K440	V432-F436 VanDerWaalsContact O-CB 3.23Å; V432-F436 WeakPolarHBondContact O-CB 3.5Å; V432-F436 PolarHBondContact O-N 3.09Å; C434-F436 VanDerWaalsContact C-N 3.31Å; C434-F436 PolarHBondContact O-N 3.4Å; F436-G439 PolarHBondContact O-N 3.39Å; F436-K440 WeakPolarHBondContact O-CB 3.5Å; F436-K440 PolarHBondContact O-N 3.5Å
437	V	85.9	Confident	86.9	Confident	44 Å²	44	47.3 Å²	47.3	27%	0.267	26%	0.256	S	S	.	.	H	α-helix	trans	-66.2	-41	179	172.5	0	0	0	0	111.3	G433 C434 K440 D441 F466 F467	G433-V437 WeakPolarHBondContact O-CG2 3.21Å; G433-V437 PolarHBondContact O-N 3.37Å; G433-V437 VanDerWaalsContact O-N 3.09Å; C434-V437 PolarHBondContact O-N 2.69Å; V437-K440 PolarHBondContact O-N 2.94Å; V437-D441 WeakPolarHBondContact O-CB 3.27Å; V437-D441 VanDerWaalsContact O-CG 3.26Å; V437-D441 PolarHBondContact O-N 3.47Å; V437-F466 HydrophobicContact CG1-CD1 4.45Å; V437-F467 HydrophobicContact CB-CE2 3.78Å; V437-F467 HydrophobicContact CG1-CD2 3.89Å; V437-F467 HydrophobicContact CG1-CE2 3.55Å
438	I	87	Confident	85.2	Confident	4 Å²	4	50 Å²	50	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-47.1	174.1	-68.1	173.7	0	0	0	110.7	L285 C434 F435 K440 D441 L442 F467 A474 F478	L285-I438 HydrophobicContact CD1-CG2 3.86Å; C434-I438 WeakPolarHBondContact O-CB 3.21Å; C434-I438 VanDerWaalsContact O-CG1 3.25Å; C434-I438 WeakPolarHBondContact O-CG1 3.32Å; C434-I438 PolarHBondContact O-N 2.85Å; F435-I438 PolarHBondContact O-N 3.45Å; I438-K440 PolarHBondContact O-N 3.29Å; I438-D441 PolarHBondContact O-N 3.23Å; I438-L442 HydrophobicContact CG2-CD1 3.8Å; I438-L442 HydrophobicContact CG2-CG 4.29Å; I438-L442 WeakPolarHBondContact O-CB 3.11Å; I438-L442 VanDerWaalsContact O-CG 3.29Å; I438-L442 WeakPolarHBondContact O-CG 3.49Å; I438-L442 PolarHBondContact O-N 3.09Å; I438-F467 HydrophobicContact CB-CD2 4.42Å; I438-F467 HydrophobicContact CB-CE2 4.5Å; I438-F467 HydrophobicContact CD1-CD1 4.3Å; I438-F467 HydrophobicContact CD1-CD2 4.14Å; I438-F467 HydrophobicContact CD1-CE1 4.21Å; I438-F467 HydrophobicContact CD1-CE2 4.05Å; I438-F467 HydrophobicContact CD1-CG 4.24Å; I438-F467 HydrophobicContact CD1-CZ 4.08Å; I438-F467 HydrophobicContact CG1-CD1 4.28Å; I438-F467 HydrophobicContact CG1-CD2 3.27Å; I438-F467 HydrophobicContact CG1-CE1 4.33Å; I438-F467 HydrophobicContact CG1-CE2 3.35Å; I438-F467 HydrophobicContact CG1-CG 3.77Å; I438-F467 HydrophobicContact CG1-CZ 3.9Å; I438-A474 HydrophobicContact CD1-CB 4.2Å; I438-F478 HydrophobicContact CD1-CD2 4.44Å; I438-F478 HydrophobicContact CD1-CE2 3.76Å
439	G	86.9	Confident	83.1	Confident	28 Å²	28	51.9 Å²	51.9	29%	0.289	28%	0.281	S	S	.	.	H	α-helix	trans	-59.3	-45.2	177.6	0	0	0	0	0	111.9	F435 F436 D441 L442 L443	F435-G439 PolarHBondContact O-N 2.88Å; F436-G439 PolarHBondContact O-N 3.39Å; G439-D441 PolarHBondContact O-N 2.96Å; G439-L442 PolarHBondContact O-N 3.31Å; G439-L443 WeakPolarHBondContact O-CB 3.39Å; G439-L443 VanDerWaalsContact O-CG 3.27Å; G439-L443 WeakPolarHBondContact O-CG 3.36Å; G439-L443 PolarHBondContact O-N 2.91Å
440	K	83.9	Confident	81	Confident	74 Å²	74	52.4 Å²	52.4	32%	0.322	28%	0.281	S	S	.	.	H	α-helix	trans	-57.8	-47.5	173.6	-172.7	-168.7	58.1	62.8	0	111.5	F436 V437 I438 L443 M444	F436-K440 WeakPolarHBondContact O-CB 3.5Å; F436-K440 PolarHBondContact O-N 3.5Å; V437-K440 PolarHBondContact O-N 2.94Å; I438-K440 PolarHBondContact O-N 3.29Å; K440-L443 PolarHBondContact O-N 3.44Å; K440-M444 HydrophobicContact CD-CE 4.37Å; K440-M444 HydrophobicContact CG-CE 3.99Å; K440-M444 HydrophobicContact CG-SD 4.3Å; K440-M444 WeakPolarHBondContact O-CE 3.21Å; K440-M444 VanDerWaalsContact O-CG 3.29Å; K440-M444 WeakPolarHBondContact O-CG 3.5Å; K440-M444 PolarHBondContact O-N 3.48Å
441	D	79.4	Confident	78.9	Confident	12 Å²	12	59.4 Å²	59.4	6%	0.064	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-37.9	-178.5	-69.9	-8.1	0	0	0	112.4	V437 I438 G439 M444 K445	V437-D441 WeakPolarHBondContact O-CB 3.27Å; V437-D441 VanDerWaalsContact O-CG 3.26Å; V437-D441 PolarHBondContact O-N 3.47Å; I438-D441 PolarHBondContact O-N 3.23Å; G439-D441 PolarHBondContact O-N 2.96Å; D441-M444 HydrophobicContact CB-CE 4.49Å; D441-M444 WeakPolarHBondContact OD1-CE 3.48Å; D441-K445 WeakPolarHBondContact O-CB 3.36Å; D441-K445 PolarHBondContact O-N 3.34Å; D441-K445 VanDerWaalsContact O-N 3.14Å
442	L	80.9	Confident	76.7	Confident	19 Å²	19	65.2 Å²	65.2	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-67.4	-44.1	174	-70	171.8	0	0	0	112.3	L283 I438 G439 M444 K445 W446	L283-L442 HydrophobicContact CB-CD2 4.16Å; L283-L442 HydrophobicContact CD1-CD1 4.17Å; L283-L442 HydrophobicContact CD2-CD1 3.91Å; L283-L442 HydrophobicContact CD2-CD2 4.21Å; L283-L442 HydrophobicContact CG-CD1 4.46Å; I438-L442 HydrophobicContact CG2-CD1 3.8Å; I438-L442 HydrophobicContact CG2-CG 4.29Å; I438-L442 WeakPolarHBondContact O-CB 3.11Å; I438-L442 VanDerWaalsContact O-CG 3.29Å; I438-L442 WeakPolarHBondContact O-CG 3.49Å; I438-L442 PolarHBondContact O-N 3.09Å; G439-L442 PolarHBondContact O-N 3.31Å; L442-M444 PolarHBondContact O-N 2.83Å; L442-K445 WeakPolarHBondContact O-CB 3.23Å; L442-K445 PolarHBondContact O-N 3.5Å; L442-W446 PolarHBondContact O-N 2.95Å
443	L	80.8	Confident	74.6	Confident	87 Å²	87	64.4 Å²	64.4	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-59	-48.5	176.9	-77.8	168.5	0	0	0	111	I343 G439 K440 K445 W446 C447	I343-L443 HydrophobicContact CD1-CD2 4.06Å; G439-L443 WeakPolarHBondContact O-CB 3.39Å; G439-L443 VanDerWaalsContact O-CG 3.27Å; G439-L443 WeakPolarHBondContact O-CG 3.36Å; G439-L443 PolarHBondContact O-N 2.91Å; K440-L443 PolarHBondContact O-N 3.44Å; L443-K445 VanDerWaalsContact C-N 3.27Å; L443-K445 PolarHBondContact O-N 3.14Å; L443-W446 PolarHBondContact O-N 3.34Å; L443-C447 VanDerWaalsContact O-CB 3.26Å; L443-C447 WeakPolarHBondContact O-CB 3.31Å; L443-C447 PolarHBondContact O-N 2.89Å; L443-C447 PolarHBondContact O-SG 3.23Å
444	M	76.1	Confident	72.4	Confident	58 Å²	58	66.1 Å²	66.1	29%	0.286	36%	0.359	S	S	.	.	H	α-helix	trans	-63.5	-35.2	179.1	-62.8	178.5	-61.3	0	0	112.2	K440 D441 L442 H464	K440-M444 HydrophobicContact CD-CE 4.37Å; K440-M444 HydrophobicContact CG-CE 3.99Å; K440-M444 HydrophobicContact CG-SD 4.3Å; K440-M444 WeakPolarHBondContact O-CE 3.21Å; K440-M444 VanDerWaalsContact O-CG 3.29Å; K440-M444 WeakPolarHBondContact O-CG 3.5Å; K440-M444 PolarHBondContact O-N 3.48Å; D441-M444 HydrophobicContact CB-CE 4.49Å; D441-M444 WeakPolarHBondContact OD1-CE 3.48Å; L442-M444 PolarHBondContact O-N 2.83Å; M444-H464 WeakPolarHBondContact CB-CE1 3.34Å; M444-H464 WeakPolarHBondContact CE-CE1 3.3Å; M444-H464 WeakPolarHBondContact CE-ND1 3.45Å; M444-H464 PolarHBondContact SD-CE1 3.03Å
445	K	73.1	Confident	70	Confident	69 Å²	69	71.3 Å²	71.3	30%	0.3	38%	0.383	S	S	.	.	H	α-helix	trans	-68.3	-37.1	175.8	-176.5	-179.7	-173.9	171.6	0	113.2	R284 D441 L442 L443	R284-K445 VanDerWaalsContact CB-NZ 3.28Å; R284-K445 PolarHBondContact O-NZ 2.94Å; D441-K445 WeakPolarHBondContact O-CB 3.36Å; D441-K445 PolarHBondContact O-N 3.34Å; D441-K445 VanDerWaalsContact O-N 3.14Å; L442-K445 WeakPolarHBondContact O-CB 3.23Å; L442-K445 PolarHBondContact O-N 3.5Å; L443-K445 VanDerWaalsContact C-N 3.27Å; L443-K445 PolarHBondContact O-N 3.14Å
446	W	74.7	Confident	67.5	Low	28 Å²	28	79.8 Å²	79.8	11%	0.106	41%	0.413	C	S	.	.	H	α-helix	trans	-83.4	-31.8	-179.8	-67.1	-9.2	0	0	0	113	L283 H339 G342 I343 F347 L442 L443 D448	L283-W446 HydrophobicContact CD2-CZ2 4.42Å; H339-W446 AromaticContact CG-NE1 3.7Å; H339-W446 AromaticContact ND1-NE1 3.98Å; G342-W446 CarbonylContact C-O 3.34Å; G342-W446 VanDerWaalsContact CA-O 3.25Å; G342-W446 WeakPolarHBondContact CA-O 3.41Å; G342-W446 PolarHBondContact N-O 3.29Å; I343-W446 HydrophobicContact CG1-CB 4.46Å; I343-W446 HydrophobicContact CG2-CE3 4.2Å; F347-W446 HydrophobicContact CB-CZ3 4.35Å; F347-W446 HydrophobicContact CD2-CH2 4.49Å; L442-W446 PolarHBondContact O-N 2.95Å; L443-W446 PolarHBondContact O-N 3.34Å; W446-D448 PolarHBondContact O-N 3.37Å
447	C	72.5	Confident	65	Low	40 Å²	40	79.7 Å²	79.7	27%	0.27	41%	0.412	S	S	.	.	H	α-helix	trans	-71.6	-17.2	178.8	-73.4	0	0	0	0	113.4	I343 L443 L449	I343-C447 VanDerWaalsContact CD1-SG 3.58Å; I343-C447 VanDerWaalsContact CG1-SG 3.6Å; L443-C447 VanDerWaalsContact O-CB 3.26Å; L443-C447 WeakPolarHBondContact O-CB 3.31Å; L443-C447 PolarHBondContact O-N 2.89Å; L443-C447 PolarHBondContact O-SG 3.23Å; C447-L449 HydrophobicContact CB-CD1 4.02Å; C447-L449 PolarHBondContact O-N 3.47Å
448	D	61.5	Low	62.5	Low	58 Å²	58	81.9 Å²	81.9	31%	0.31	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	38.7	44.9	-174	-143.8	-5.4	0	0	0	110.8	W446 N450 M451	W446-D448 PolarHBondContact O-N 3.37Å; D448-N450 PolarHBondContact O-N 3.2Å; D448-M451 HydrophobicContact CB-CB 4.44Å; D448-M451 WeakPolarHBondContact O-CB 3.34Å; D448-M451 PolarHBondContact O-N 3.25Å
449	L	52.7	Low	60	Low	98 Å²	98	86.5 Å²	86.5	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-64	-20.5	-170.8	-139.4	88.8	0	0	0	111	C447 M451 L452 T453	C447-L449 HydrophobicContact CB-CD1 4.02Å; C447-L449 PolarHBondContact O-N 3.47Å; L449-M451 VanDerWaalsContact C-N 3.25Å; L449-M451 PolarHBondContact O-N 3.37Å; L449-L452 PolarHBondContact O-N 3Å; L449-T453 PolarHBondContact O-N 3.27Å; L449-T453 VanDerWaalsContact O-N 3.09Å; L449-T453 PolarHBondContact O-OG1 2.7Å
450	N	52.5	Low	57.3	Low	103 Å²	103	89 Å²	89	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-68	-20	172.5	-66.8	-16	0	0	0	113.2	D448	D448-N450 PolarHBondContact O-N 3.2Å
451	M	51.3	Low	55.1	Low	153 Å²	153	94.6 Å²	94.6	75%	0.754	51%	0.511	S	S	*	.	H	α-helix	trans	-81	-30.4	169.6	-84.4	-94.3	-111	0	0	112.3	D448 L449	D448-M451 HydrophobicContact CB-CB 4.44Å; D448-M451 WeakPolarHBondContact O-CB 3.34Å; D448-M451 PolarHBondContact O-N 3.25Å; L449-M451 VanDerWaalsContact C-N 3.25Å; L449-M451 PolarHBondContact O-N 3.37Å
452	L	49.2	Very low	53.2	Low	143 Å²	143	97.6 Å²	97.6	75%	0.749	53%	0.527	S	S	*	.	H	α-helix	trans	-83.1	-27.8	-179.2	-81.4	161.2	0	0	0	113.5	L449	L449-L452 PolarHBondContact O-N 3Å
453	T	50.6	Low	51.5	Low	78 Å²	78	100.6 Å²	100.6	48%	0.479	55%	0.547	S	S	.	.	S	Bend	trans	-89	-5	-177.4	51.8	0	0	0	0	114.6	L449 E455	L449-T453 PolarHBondContact O-N 3.27Å; L449-T453 VanDerWaalsContact O-N 3.09Å; L449-T453 PolarHBondContact O-OG1 2.7Å; T453-E455 PolarHBondContact O-N 3.38Å
454	G	45.6	Very low	50.1	Low	70 Å²	70	98.6 Å²	98.6	72%	0.722	54%	0.536	S	S	*	.			trans	61.1	-5.8	175.9	0	0	0	0	0	115.7	R456	G454-R456 PolarHBondContact O-N 3.29Å
455	E	41.6	Very low	49.5	Very low	112 Å²	112	99 Å²	99	52%	0.523	54%	0.537	S	S	.	.			trans	-83	97.2	179.2	-71.3	-164.9	150.9	0	0	109.3	T453 K457	T453-E455 PolarHBondContact O-N 3.38Å; E455-K457 HydrophobicContact CB-CG 4.44Å; E455-K457 PolarHBondContact O-N 3.22Å; E455-K457 IonicContact OE1-NZ 2.8Å; E455-K457 WeakPolarHBondContact OE2-CD 3.35Å; E455-K457 WeakPolarHBondContact OE2-CE 3.27Å; E455-K457 IonicContact OE2-NZ 3.88Å; E455-K457 PolarHBondContact OE2-NZ 3.09Å
456	R	41.5	Very low	49.5	Very low	251 Å²	251	97.8 Å²	97.8	95%	0.947	53%	0.532	S	S	*	.			trans	-62	69.5	152.9	-81.9	-177.8	173.7	171.8	-0.5	109.1	G454 A458	G454-R456 PolarHBondContact O-N 3.29Å; R456-A458 PolarHBondContact O-N 2.83Å; R456-A458 VanDerWaalsContact O-N 3.07Å
457	K	37.7	Very low	49.5	Very low	144 Å²	144	96.6 Å²	96.6	63%	0.626	53%	0.527	S	S	*	.			trans	-70.4	107.4	165.8	-93	174.7	176.6	147	0	107.5	E455 A459	E455-K457 HydrophobicContact CB-CG 4.44Å; E455-K457 PolarHBondContact O-N 3.22Å; E455-K457 IonicContact OE1-NZ 2.8Å; E455-K457 WeakPolarHBondContact OE2-CD 3.35Å; E455-K457 WeakPolarHBondContact OE2-CE 3.27Å; E455-K457 IonicContact OE2-NZ 3.88Å; E455-K457 PolarHBondContact OE2-NZ 3.09Å; K457-A459 PolarHBondContact O-N 2.9Å
458	A	33.6	Very low	49.4	Very low	91 Å²	91	99.3 Å²	99.3	75%	0.752	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.5	107.3	176.4	0	0	0	0	0	111.3	R456 S460	R456-A458 PolarHBondContact O-N 2.83Å; R456-A458 VanDerWaalsContact O-N 3.07Å; A458-S460 PolarHBondContact O-N 3.06Å
459	A	32.9	Very low	50.2	Low	100 Å²	100	103.3 Å²	103.3	83%	0.826	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	32.3	47.5	157.6	0	0	0	0	0	116	K457 K461	K457-A459 PolarHBondContact O-N 2.9Å; A459-K461 PolarHBondContact O-N 3.31Å
460	S	32.1	Very low	51.8	Low	80 Å²	80	99.6 Å²	99.6	56%	0.559	53%	0.526	S	S	*	.			trans	-80.8	88	177.9	67.8	0	0	0	0	108.1	A458 D462	A458-S460 PolarHBondContact O-N 3.06Å; S460-D462 WeakPolarHBondContact O-CA 3.27Å; S460-D462 PolarHBondContact O-N 3.35Å
461	K	36.3	Very low	53.7	Low	192 Å²	192	95 Å²	95	84%	0.835	50%	0.501	S	S	*	.			trans	14.7	80.7	169.6	-77.9	-179.5	175.7	173.7	0	112.8	A459	A459-K461 PolarHBondContact O-N 3.31Å
462	D	40.7	Very low	55.6	Low	76 Å²	76	87.7 Å²	87.7	41%	0.406	47%	0.465	S	S	.	.			trans	-53.2	132.2	-164	-87	-44.5	0	0	0	112.8	S460 H464 E465	S460-D462 WeakPolarHBondContact O-CA 3.27Å; S460-D462 PolarHBondContact O-N 3.35Å; D462-H464 HydrophobicContact CB-CB 4.21Å; D462-H464 PolarHBondContact O-N 2.99Å; D462-H464 IonicContact OD1-CD2 3.64Å; D462-E465 HydrophobicContact CB-CG 4.48Å; D462-E465 PolarHBondContact O-N 3.11Å
463	P	45.2	Very low	57.7	Low	81 Å²	81	80.9 Å²	80.9	53%	0.526	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-63.7	-4.6	168.2	25.3	-31.2	0	0	0	113.2	E465	P463-E465 VanDerWaalsContact C-N 3.29Å; P463-E465 PolarHBondContact O-N 3.35Å
464	H	50.2	Low	59.8	Low	46 Å²	46	77.1 Å²	77.1	21%	0.213	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-78.9	-0.3	178.4	-59.7	-39.1	0	0	0	115.2	M444 D462	M444-H464 WeakPolarHBondContact CB-CE1 3.34Å; M444-H464 WeakPolarHBondContact CE-CE1 3.3Å; M444-H464 WeakPolarHBondContact CE-ND1 3.45Å; M444-H464 PolarHBondContact SD-CE1 3.03Å; D462-H464 HydrophobicContact CB-CB 4.21Å; D462-H464 PolarHBondContact O-N 2.99Å; D462-H464 IonicContact OD1-CD2 3.64Å
465	E	64.1	Low	62.2	Low	67 Å²	67	73.8 Å²	73.8	31%	0.313	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-100.5	-6.5	-169.3	-70.8	-168.1	-179.5	0	0	115.5	D462 P463 F467 Q468 R469	D462-E465 HydrophobicContact CB-CG 4.48Å; D462-E465 PolarHBondContact O-N 3.11Å; P463-E465 VanDerWaalsContact C-N 3.29Å; P463-E465 PolarHBondContact O-N 3.35Å; E465-F467 PolarHBondContact O-N 2.89Å; E465-Q468 PolarHBondContact O-N 3.15Å; E465-R469 WeakPolarHBondContact O-CG 3.27Å; E465-R469 PolarHBondContact O-N 2.9Å; E465-R469 IonicContact OE2-CZ 3.01Å; E465-R469 IonicContact OE2-NE 3.98Å; E465-R469 PolarHBondContact OE2-NE 3.09Å; E465-R469 IonicContact OE2-NH2 2.63Å; E465-R469 PolarHBondContact OE2-NH2 3.04Å
466	F	72.5	Confident	64.8	Low	42 Å²	42	68.8 Å²	68.8	18%	0.184	35%	0.349	C	S	.	.	H	α-helix	trans	-57.7	-55.3	-168.9	-176.5	-94.5	0	0	0	112.1	V437 R469 R470 L514	V437-F466 HydrophobicContact CG1-CD1 4.45Å; F466-R469 WeakPolarHBondContact O-CB 3.49Å; F466-R469 PolarHBondContact O-N 3.23Å; F466-R469 VanDerWaalsContact O-N 3.14Å; F466-R470 HydrophobicContact CE1-CB 4.19Å; F466-R470 HydrophobicContact CE1-CG 4.16Å; F466-R470 HydrophobicContact CE2-CG 4.29Å; F466-R470 HydrophobicContact CZ-CB 4.44Å; F466-R470 HydrophobicContact CZ-CG 3.92Å; F466-R470 PolarHBondContact O-N 3.21Å; F466-L514 HydrophobicContact CE1-CD2 3.89Å; F466-L514 HydrophobicContact CE2-CD2 4.49Å; F466-L514 HydrophobicContact CZ-CD2 3.49Å; F466-L514 VanDerWaalsContact CZ-CD2 3.49Å; F466-L514 HydrophobicContact CZ-CG 4.3Å
467	F	74.3	Confident	67.4	Low	3 Å²	3	56.8 Å²	56.8	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-77.8	-19.2	178.5	-79.5	-68.9	0	0	0	114.3	C434 V437 I438 E465 R469 R470 V471 L473 A474	C434-F467 HydrophobicContact CB-CE1 4.48Å; C434-F467 HydrophobicContact CB-CZ 3.76Å; V437-F467 HydrophobicContact CB-CE2 3.78Å; V437-F467 HydrophobicContact CG1-CD2 3.89Å; V437-F467 HydrophobicContact CG1-CE2 3.55Å; I438-F467 HydrophobicContact CB-CD2 4.42Å; I438-F467 HydrophobicContact CB-CE2 4.5Å; I438-F467 HydrophobicContact CD1-CD1 4.3Å; I438-F467 HydrophobicContact CD1-CD2 4.14Å; I438-F467 HydrophobicContact CD1-CE1 4.21Å; I438-F467 HydrophobicContact CD1-CE2 4.05Å; I438-F467 HydrophobicContact CD1-CG 4.24Å; I438-F467 HydrophobicContact CD1-CZ 4.08Å; I438-F467 HydrophobicContact CG1-CD1 4.28Å; I438-F467 HydrophobicContact CG1-CD2 3.27Å; I438-F467 HydrophobicContact CG1-CE1 4.33Å; I438-F467 HydrophobicContact CG1-CE2 3.35Å; I438-F467 HydrophobicContact CG1-CG 3.77Å; I438-F467 HydrophobicContact CG1-CZ 3.9Å; E465-F467 PolarHBondContact O-N 2.89Å; F467-R469 PolarHBondContact O-N 3.24Å; F467-R470 HydrophobicContact CD1-CB 4.45Å; F467-R470 CarbonylContact O-C 3.55Å; F467-R470 PolarHBondContact O-N 2.9Å; F467-V471 WeakPolarHBondContact O-CA 3.28Å; F467-V471 VanDerWaalsContact O-CG2 3.27Å; F467-V471 WeakPolarHBondContact O-CG2 3.49Å; F467-V471 PolarHBondContact O-N 2.96Å; F467-V471 VanDerWaalsContact O-N 3.07Å; F467-L473 HydrophobicContact CE1-CB 4.42Å; F467-L473 HydrophobicContact CE1-CD2 4.22Å; F467-L473 HydrophobicContact CE1-CG 4.28Å; F467-A474 HydrophobicContact CD1-CB 3.69Å; F467-A474 HydrophobicContact CE1-CB 4.2Å; F467-A474 HydrophobicContact CG-CB 4.46Å
468	Q	70.6	Confident	70.3	Confident	98 Å²	98	50.9 Å²	50.9	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-65.6	-28.2	166.8	-63.7	-173.7	4	0	0	111.5	E465 V471	E465-Q468 PolarHBondContact O-N 3.15Å; Q468-V471 WeakPolarHBondContact O-CG2 3.34Å
469	R	79.1	Confident	73.3	Confident	142 Å²	142	46.7 Å²	46.7	54%	0.536	24%	0.243	S	C	.	.	H	α-helix	trans	-86.7	-28.4	172.8	-65.5	173.6	-176.2	-174.5	3	112.8	E465 F466 F467	E465-R469 WeakPolarHBondContact O-CG 3.27Å; E465-R469 PolarHBondContact O-N 2.9Å; E465-R469 IonicContact OE2-CZ 3.01Å; E465-R469 IonicContact OE2-NE 3.98Å; E465-R469 PolarHBondContact OE2-NE 3.09Å; E465-R469 IonicContact OE2-NH2 2.63Å; E465-R469 PolarHBondContact OE2-NH2 3.04Å; F466-R469 WeakPolarHBondContact O-CB 3.49Å; F466-R469 PolarHBondContact O-N 3.23Å; F466-R469 VanDerWaalsContact O-N 3.14Å; F467-R469 PolarHBondContact O-N 3.24Å
470	R	87.3	Confident	76.4	Confident	20 Å²	20	41.9 Å²	41.9	8%	0.075	20%	0.204	C	C	.	.			trans	-115.9	46.4	-175.9	-61.2	-59.8	-59.8	-79.3	-7.5	113.2	L185 F466 F467 D472 L473 A474 D511	L185-R470 PolarHBondContact O-NH2 3.34Å; F466-R470 HydrophobicContact CE1-CB 4.19Å; F466-R470 HydrophobicContact CE1-CG 4.16Å; F466-R470 HydrophobicContact CE2-CG 4.29Å; F466-R470 HydrophobicContact CZ-CB 4.44Å; F466-R470 HydrophobicContact CZ-CG 3.92Å; F466-R470 PolarHBondContact O-N 3.21Å; F467-R470 HydrophobicContact CD1-CB 4.45Å; F467-R470 CarbonylContact O-C 3.55Å; F467-R470 PolarHBondContact O-N 2.9Å; R470-D472 WeakPolarHBondContact CA-OD1 3.21Å; R470-D472 IonicContact NE-OD1 3.69Å; R470-D472 IonicContact NE-OD2 2.99Å; R470-D472 PolarHBondContact O-N 2.71Å; R470-L473 HydrophobicContact CB-CB 4.26Å; R470-L473 PolarHBondContact O-N 3.16Å; R470-L473 VanDerWaalsContact O-N 3.08Å; R470-A474 PolarHBondContact O-N 3.11Å; R470-A474 VanDerWaalsContact O-N 3.14Å; R470-D511 IonicContact CZ-OD2 3.09Å; R470-D511 VanDerWaalsContact NH1-CG 3.34Å; R470-D511 IonicContact NH1-OD1 3.11Å; R470-D511 PolarHBondContact NH1-OD1 2.94Å; R470-D511 IonicContact NH1-OD2 2.96Å; R470-D511 PolarHBondContact NH1-OD2 2.84Å; R470-D511 IonicContact NH2-OD2 2.6Å; R470-D511 PolarHBondContact NH2-OD2 3.38Å
471	V	90.5	Very high	79.5	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.03	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-32.1	-179.4	-173.7	0	0	0	0	112.1	L235 L285 V286 F467 Q468 A474 F475	L235-V471 HydrophobicContact CB-CG1 4.36Å; L235-V471 HydrophobicContact CD1-CG1 4.49Å; L285-V471 WeakPolarHBondContact O-CG2 3.47Å; V286-V471 HydrophobicContact CB-CG1 3.64Å; V286-V471 HydrophobicContact CG2-CG1 3.66Å; F467-V471 WeakPolarHBondContact O-CA 3.28Å; F467-V471 VanDerWaalsContact O-CG2 3.27Å; F467-V471 WeakPolarHBondContact O-CG2 3.49Å; F467-V471 PolarHBondContact O-N 2.96Å; F467-V471 VanDerWaalsContact O-N 3.07Å; Q468-V471 WeakPolarHBondContact O-CG2 3.34Å; V471-A474 PolarHBondContact O-N 2.74Å; V471-F475 VanDerWaalsContact O-CB 3.29Å; V471-F475 WeakPolarHBondContact O-CB 3.4Å; V471-F475 PolarHBondContact O-N 2.84Å
472	D	92.8	Very high	82.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-45	171.1	57	-31.2	0	0	0	113	L185 C232 R236 R470 F475 L476	L185-D472 HydrophobicContact CD2-CB 4.13Å; C232-D472 HydrophobicContact CB-CB 4.06Å; R236-D472 IonicContact CZ-OD2 2.68Å; R236-D472 IonicContact NE-OD2 3.16Å; R236-D472 PolarHBondContact NE-OD2 2.95Å; R236-D472 IonicContact NH2-OD2 3.67Å; R236-D472 PolarHBondContact NH2-OD2 2.99Å; R470-D472 WeakPolarHBondContact CA-OD1 3.21Å; R470-D472 IonicContact NE-OD1 3.69Å; R470-D472 IonicContact NE-OD2 2.99Å; R470-D472 PolarHBondContact O-N 2.71Å; D472-F475 WeakPolarHBondContact O-CB 3.33Å; D472-F475 PolarHBondContact O-N 3.27Å; D472-L476 PolarHBondContact O-N 3.12Å; D472-L476 VanDerWaalsContact O-N 3.14Å
473	L	93.7	Very high	84.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-69.7	-43.5	177.1	-177.3	62.4	0	0	0	110.9	M430 F467 R470 F475 L476 V477 L504 L514	M430-L473 HydrophobicContact CE-CD1 4.21Å; M430-L473 HydrophobicContact SD-CD1 4.35Å; F467-L473 HydrophobicContact CE1-CB 4.42Å; F467-L473 HydrophobicContact CE1-CD2 4.22Å; F467-L473 HydrophobicContact CE1-CG 4.28Å; R470-L473 HydrophobicContact CB-CB 4.26Å; R470-L473 PolarHBondContact O-N 3.16Å; R470-L473 VanDerWaalsContact O-N 3.08Å; L473-F475 VanDerWaalsContact C-N 3.26Å; L473-F475 PolarHBondContact O-N 2.97Å; L473-L476 PolarHBondContact O-N 3.38Å; L473-V477 HydrophobicContact CD1-CG2 4.15Å; L473-V477 HydrophobicContact CG-CG2 4.31Å; L473-V477 WeakPolarHBondContact O-CB 3.28Å; L473-V477 VanDerWaalsContact O-CG2 3.23Å; L473-V477 WeakPolarHBondContact O-CG2 3.33Å; L473-V477 PolarHBondContact O-N 3.13Å; L473-L504 HydrophobicContact CD1-CD2 3.82Å; L473-L514 HydrophobicContact CD2-CD1 4.1Å; L473-L514 HydrophobicContact CD2-CD2 4.12Å; L473-L514 HydrophobicContact CD2-CG 4.44Å
474	A	93.3	Very high	87.3	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-56.8	-43.3	174.2	0	0	0	0	0	111.3	L280 I438 F467 R470 V471 V477 F478	L280-A474 HydrophobicContact CD2-CB 4.01Å; I438-A474 HydrophobicContact CD1-CB 4.2Å; F467-A474 HydrophobicContact CD1-CB 3.69Å; F467-A474 HydrophobicContact CE1-CB 4.2Å; F467-A474 HydrophobicContact CG-CB 4.46Å; R470-A474 PolarHBondContact O-N 3.11Å; R470-A474 VanDerWaalsContact O-N 3.14Å; V471-A474 PolarHBondContact O-N 2.74Å; A474-V477 PolarHBondContact O-N 3.27Å; A474-F478 VanDerWaalsContact O-CD2 3.31Å; A474-F478 WeakPolarHBondContact O-CD2 3.1Å; A474-F478 PolarHBondContact O-N 2.61Å
475	F	96.2	Very high	89.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-57.6	-52.2	177.2	169.4	-101.3	0	0	0	112.8	V231 L235 Q273 V276 L277 L280 V471 D472 L473 V477 F478 Q479	V231-F475 HydrophobicContact CB-CE1 4.25Å; V231-F475 HydrophobicContact CB-CZ 4.39Å; V231-F475 HydrophobicContact CG1-CD1 4.1Å; V231-F475 HydrophobicContact CG1-CD2 4.46Å; V231-F475 HydrophobicContact CG1-CE1 3.65Å; V231-F475 HydrophobicContact CG1-CE2 4.06Å; V231-F475 HydrophobicContact CG1-CG 4.48Å; V231-F475 HydrophobicContact CG1-CZ 3.62Å; L235-F475 HydrophobicContact CD1-CB 3.83Å; L235-F475 HydrophobicContact CD1-CD1 4.38Å; L235-F475 HydrophobicContact CD1-CD2 4.08Å; L235-F475 HydrophobicContact CD1-CG 3.82Å; Q273-F475 HydrophobicContact CG-CE2 3.82Å; Q273-F475 HydrophobicContact CG-CZ 3.73Å; V276-F475 HydrophobicContact CG1-CD2 3.8Å; V276-F475 HydrophobicContact CG1-CE2 4.11Å; L277-F475 HydrophobicContact CD2-CD2 3.78Å; L277-F475 HydrophobicContact CD2-CE2 3.87Å; L277-F475 HydrophobicContact CG-CD2 4.33Å; L277-F475 HydrophobicContact CG-CE2 4.04Å; L280-F475 HydrophobicContact CD1-CB 3.96Å; L280-F475 HydrophobicContact CD1-CD2 4.21Å; V471-F475 VanDerWaalsContact O-CB 3.29Å; V471-F475 WeakPolarHBondContact O-CB 3.4Å; V471-F475 PolarHBondContact O-N 2.84Å; D472-F475 WeakPolarHBondContact O-CB 3.33Å; D472-F475 PolarHBondContact O-N 3.27Å; L473-F475 VanDerWaalsContact C-N 3.26Å; L473-F475 PolarHBondContact O-N 2.97Å; F475-V477 PolarHBondContact O-N 3.12Å; F475-F478 PolarHBondContact O-N 3Å; F475-Q479 WeakPolarHBondContact O-CB 3.19Å; F475-Q479 PolarHBondContact O-N 2.7Å
476	L	96.8	Very high	90.6	Very high	6 Å²	6	28.3 Å²	28.3	3%	0.031	13%	0.133	C	C	.	.	H	α-helix	trans	-68.3	-35	-179.8	-69.9	173.7	0	0	0	113.2	L181 L185 D472 L473 Q479 S480 L504	L181-L476 HydrophobicContact CD1-CD1 4.17Å; L181-L476 HydrophobicContact CD2-CD1 4.4Å; L181-L476 HydrophobicContact CD2-CD2 4.46Å; L181-L476 HydrophobicContact CG-CD1 4.45Å; L185-L476 HydrophobicContact CD1-CD1 3.21Å; L185-L476 HydrophobicContact CD2-CD1 3.8Å; L185-L476 HydrophobicContact CG-CD1 4.07Å; D472-L476 PolarHBondContact O-N 3.12Å; D472-L476 VanDerWaalsContact O-N 3.14Å; L473-L476 PolarHBondContact O-N 3.38Å; L476-Q479 PolarHBondContact O-N 3.46Å; L476-S480 WeakPolarHBondContact O-CB 3.31Å; L476-S480 PolarHBondContact O-N 3.49Å; L476-L504 HydrophobicContact CB-CD2 4.09Å
477	V	96.5	Very high	91.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-46.8	176.6	168.6	0	0	0	0	110.6	M430 L431 C434 F435 L473 A474 F475 S480 A481 L504	M430-V477 HydrophobicContact CG-CG2 4.44Å; L431-V477 HydrophobicContact CD1-CG1 3.98Å; C434-V477 HydrophobicContact CB-CB 4.42Å; C434-V477 HydrophobicContact CB-CG1 3.86Å; C434-V477 HydrophobicContact CB-CG2 3.94Å; F435-V477 HydrophobicContact CD2-CG1 4.36Å; F435-V477 HydrophobicContact CE2-CG1 4.04Å; F435-V477 HydrophobicContact CZ-CG1 4.11Å; L473-V477 HydrophobicContact CD1-CG2 4.15Å; L473-V477 HydrophobicContact CG-CG2 4.31Å; L473-V477 WeakPolarHBondContact O-CB 3.28Å; L473-V477 VanDerWaalsContact O-CG2 3.23Å; L473-V477 WeakPolarHBondContact O-CG2 3.33Å; L473-V477 PolarHBondContact O-N 3.13Å; A474-V477 PolarHBondContact O-N 3.27Å; F475-V477 PolarHBondContact O-N 3.12Å; V477-S480 PolarHBondContact O-N 2.91Å; V477-A481 WeakPolarHBondContact O-CB 3.25Å; V477-A481 PolarHBondContact O-N 3.38Å; V477-L504 HydrophobicContact CG2-CD1 4.42Å; V477-L504 HydrophobicContact CG2-CD2 3.95Å
478	F	97	Very high	92.3	Very high	20 Å²	20	29.9 Å²	29.9	9%	0.088	14%	0.143	C	C	.	.	H	α-helix	trans	-65.4	-43	175.7	-88.9	-102.1	0	0	0	111.8	V276 C279 L280 L283 F435 I438 A474 F475 S480 A481 F482	V276-F478 HydrophobicContact CB-CB 4.47Å; V276-F478 HydrophobicContact CG1-CB 3.61Å; V276-F478 HydrophobicContact CG2-CB 4.24Å; C279-F478 HydrophobicContact CB-CD1 4.46Å; C279-F478 HydrophobicContact CB-CE1 4.39Å; L280-F478 HydrophobicContact CD2-CD2 3.82Å; L280-F478 HydrophobicContact CD2-CE2 3.96Å; L280-F478 HydrophobicContact CD2-CG 4.25Å; L283-F478 HydrophobicContact CD1-CE1 4.44Å; L283-F478 HydrophobicContact CD1-CZ 4.04Å; F435-F478 HydrophobicContact CD1-CE2 4.27Å; F435-F478 HydrophobicContact CD1-CZ 4.39Å; F435-F478 HydrophobicContact CE1-CD1 4.36Å; F435-F478 AromaticContact CE1-CD2 3.96Å; F435-F478 HydrophobicContact CE1-CD2 3.96Å; F435-F478 HydrophobicContact CE1-CE1 4.08Å; F435-F478 AromaticContact CE1-CE2 3.66Å; F435-F478 HydrophobicContact CE1-CE2 3.66Å; F435-F478 HydrophobicContact CE1-CG 4.32Å; F435-F478 AromaticContact CE1-CZ 3.74Å; F435-F478 HydrophobicContact CE1-CZ 3.74Å; I438-F478 HydrophobicContact CD1-CD2 4.44Å; I438-F478 HydrophobicContact CD1-CE2 3.76Å; A474-F478 VanDerWaalsContact O-CD2 3.31Å; A474-F478 WeakPolarHBondContact O-CD2 3.1Å; A474-F478 PolarHBondContact O-N 2.61Å; F475-F478 PolarHBondContact O-N 3Å; F478-S480 VanDerWaalsContact C-N 3.34Å; F478-S480 PolarHBondContact O-N 3.31Å; F478-A481 PolarHBondContact O-N 2.87Å; F478-F482 HydrophobicContact CD1-CE1 4.39Å; F478-F482 WeakPolarHBondContact O-CB 3.36Å; F478-F482 WeakPolarHBondContact O-CD1 3.45Å; F478-F482 PolarHBondContact O-N 3.24Å
479	Q	97.5	Very high	93	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.009	14%	0.14	C	C	.	.	H	α-helix	trans	-61.7	-42.5	177.3	-168.5	-179.9	-79.6	0	0	112.1	N228 Q273 V276 F475 L476 F482 S483	N228-Q479 PolarHBondContact OD1-NE2 3Å; N228-Q479 PolarHBondContact OD1-OE1 2.91Å; N228-Q479 VanDerWaalsContact OD1-OE1 3.09Å; Q273-Q479 VanDerWaalsContact NE2-OE1 3.16Å; V276-Q479 HydrophobicContact CG1-CB 4.49Å; V276-Q479 HydrophobicContact CG2-CB 4.29Å; F475-Q479 WeakPolarHBondContact O-CB 3.19Å; F475-Q479 PolarHBondContact O-N 2.7Å; L476-Q479 PolarHBondContact O-N 3.46Å; Q479-F482 PolarHBondContact O-N 3.45Å; Q479-S483 WeakPolarHBondContact O-CB 3.3Å; Q479-S483 PolarHBondContact O-N 2.94Å; Q479-S483 PolarHBondContact O-OG 3.06Å
480	S	97.7	Very high	93.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.6	-39.8	177.2	-174.4	0	0	0	0	111.8	Y427 L476 V477 F478 F482 S483 G484 W497 Q500 L504	Y427-S480 WeakPolarHBondContact CE2-OG 3.26Å; Y427-S480 PolarHBondContact OH-OG 3.23Å; L476-S480 WeakPolarHBondContact O-CB 3.31Å; L476-S480 PolarHBondContact O-N 3.49Å; V477-S480 PolarHBondContact O-N 2.91Å; F478-S480 VanDerWaalsContact C-N 3.34Å; F478-S480 PolarHBondContact O-N 3.31Å; S480-F482 PolarHBondContact O-N 3.39Å; S480-S483 PolarHBondContact O-N 3.36Å; S480-G484 PolarHBondContact O-N 3.48Å; S480-W497 PolarHBondContact O-NE1 2.85Å; S480-W497 PolarHBondContact OG-NE1 3.41Å; S480-Q500 VanDerWaalsContact N-OE1 3.16Å; S480-L504 VanDerWaalsContact CB-CD1 3.48Å
481	A	97.1	Very high	93.4	Very high	17 Å²	17	22.6 Å²	22.6	14%	0.14	12%	0.121	C	C	.	.	H	α-helix	trans	-60.3	-46.3	175.1	0	0	0	0	0	111.6	L431 F435 V477 F478 G484 L485	L431-A481 HydrophobicContact CD1-CB 4.07Å; F435-A481 HydrophobicContact CE2-CB 3.94Å; F435-A481 HydrophobicContact CZ-CB 3.8Å; V477-A481 WeakPolarHBondContact O-CB 3.25Å; V477-A481 PolarHBondContact O-N 3.38Å; F478-A481 PolarHBondContact O-N 2.87Å; A481-G484 PolarHBondContact O-N 3.41Å; A481-L485 WeakPolarHBondContact O-CG 3.25Å; A481-L485 PolarHBondContact O-N 2.86Å
482	F	95.5	Very high	93.2	Very high	53 Å²	53	25.7 Å²	25.7	23%	0.232	13%	0.132	C	C	.	.	H	α-helix	trans	-67	-39.1	179.5	-83.9	37.6	0	0	0	111.4	L272 L275 V276 F478 Q479 S480 G484 L485 L486	L272-F482 HydrophobicContact CD1-CB 3.7Å; L272-F482 HydrophobicContact CD1-CD2 3.98Å; L272-F482 HydrophobicContact CD1-CG 4.34Å; L272-F482 HydrophobicContact CD2-CB 4.16Å; L272-F482 HydrophobicContact CG-CB 3.88Å; L272-F482 HydrophobicContact CG-CD2 4.4Å; L275-F482 HydrophobicContact CB-CD2 4.48Å; L275-F482 HydrophobicContact CB-CE2 4.01Å; V276-F482 HydrophobicContact CG2-CB 4.36Å; V276-F482 HydrophobicContact CG2-CD2 3.79Å; V276-F482 HydrophobicContact CG2-CE2 4.22Å; V276-F482 HydrophobicContact CG2-CG 4.02Å; F478-F482 HydrophobicContact CD1-CE1 4.39Å; F478-F482 WeakPolarHBondContact O-CB 3.36Å; F478-F482 WeakPolarHBondContact O-CD1 3.45Å; F478-F482 PolarHBondContact O-N 3.24Å; Q479-F482 PolarHBondContact O-N 3.45Å; S480-F482 PolarHBondContact O-N 3.39Å; F482-G484 VanDerWaalsContact C-N 3.34Å; F482-L485 PolarHBondContact O-N 3.29Å; F482-L486 PolarHBondContact O-N 2.89Å; F482-L486 VanDerWaalsContact O-N 3.12Å
483	S	95.6	Very high	93.1	Very high	2 Å²	2	28 Å²	28	1%	0.014	14%	0.143	C	C	.	.	H	α-helix	trans	-65.2	-38.3	174.2	-54.9	0	0	0	0	111.5	L272 Q479 S480 L486 C487 Q500	L272-S483 WeakPolarHBondContact CD2-OG 3.19Å; Q479-S483 WeakPolarHBondContact O-CB 3.3Å; Q479-S483 PolarHBondContact O-N 2.94Å; Q479-S483 PolarHBondContact O-OG 3.06Å; S480-S483 PolarHBondContact O-N 3.36Å; S483-L486 PolarHBondContact O-N 2.9Å; S483-C487 WeakPolarHBondContact O-CB 3.29Å; S483-C487 PolarHBondContact O-N 3.08Å; S483-Q500 PolarHBondContact OG-NE2 3.23Å
484	G	95.6	Very high	93.1	Very high	5 Å²	5	28.4 Å²	28.4	5%	0.052	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-45.3	175.5	0	0	0	0	0	112.6	S480 A481 F482 L486 C487 M488 W497	S480-G484 PolarHBondContact O-N 3.48Å; A481-G484 PolarHBondContact O-N 3.41Å; F482-G484 VanDerWaalsContact C-N 3.34Å; G484-L486 VanDerWaalsContact C-N 3.3Å; G484-L486 PolarHBondContact O-N 3.05Å; G484-C487 WeakPolarHBondContact O-CB 3.37Å; G484-C487 PolarHBondContact O-N 3.24Å; G484-C487 VanDerWaalsContact O-N 3.14Å; G484-M488 WeakPolarHBondContact O-CG 3.45Å; G484-M488 PolarHBondContact O-N 2.94Å; G484-W497 VanDerWaalsContact CA-CD2 3.44Å; G484-W497 VanDerWaalsContact CA-CE2 3.45Å
485	L	92.9	Very high	93.1	Very high	120 Å²	120	30.7 Å²	30.7	63%	0.628	16%	0.155	S	C	*	.	H	α-helix	trans	-58.6	-42.7	174.4	-69.9	172.7	0	0	0	111.8	A481 F482 M488 M489	A481-L485 WeakPolarHBondContact O-CG 3.25Å; A481-L485 PolarHBondContact O-N 2.86Å; F482-L485 PolarHBondContact O-N 3.29Å; L485-M488 PolarHBondContact O-N 3.08Å; L485-M489 PolarHBondContact O-N 3.14Å
486	L	89.8	Confident	93.1	Very high	59 Å²	59	31 Å²	31	31%	0.309	16%	0.156	S	C	.	.	H	α-helix	trans	-64.2	-41.4	175.5	-177.5	66.2	0	0	0	111.8	F482 S483 G484 M489 A490 M493	F482-L486 PolarHBondContact O-N 2.89Å; F482-L486 VanDerWaalsContact O-N 3.12Å; S483-L486 PolarHBondContact O-N 2.9Å; G484-L486 VanDerWaalsContact C-N 3.3Å; G484-L486 PolarHBondContact O-N 3.05Å; L486-M489 PolarHBondContact O-N 2.64Å; L486-A490 PolarHBondContact O-N 3.42Å; L486-M493 HydrophobicContact CD2-CB 4.24Å; L486-M493 HydrophobicContact CD2-CG 3.94Å; L486-M493 HydrophobicContact CD2-SD 4.16Å; L486-M493 HydrophobicContact CG-CB 4.13Å; L486-M493 HydrophobicContact CG-CG 3.87Å
487	C	92.5	Very high	93.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-36.7	177.6	-171.8	0	0	0	0	112.9	S483 G484 M489 A490 M493 V494 W497	S483-C487 WeakPolarHBondContact O-CB 3.29Å; S483-C487 PolarHBondContact O-N 3.08Å; G484-C487 WeakPolarHBondContact O-CB 3.37Å; G484-C487 PolarHBondContact O-N 3.24Å; G484-C487 VanDerWaalsContact O-N 3.14Å; C487-M489 PolarHBondContact O-N 3.38Å; C487-A490 CarbonylContact O-C 3.47Å; C487-A490 VanDerWaalsContact O-C 3.27Å; C487-A490 PolarHBondContact O-N 3.02Å; C487-M493 HydrophobicContact CB-CB 4.46Å; C487-V494 WeakPolarHBondContact SG-CA 3.44Å; C487-V494 PolarHBondContact SG-N 3.44Å; C487-W497 HydrophobicContact CB-CB 4.26Å; C487-W497 HydrophobicContact CB-CD2 4.34Å; C487-W497 HydrophobicContact CB-CE3 3.69Å; C487-W497 HydrophobicContact CB-CZ3 4.38Å
488	M	90.8	Very high	93.1	Very high	79 Å²	79	31.1 Å²	31.1	39%	0.389	16%	0.156	S	C	.	.	H	α-helix	trans	-59.2	-38.4	173.3	-68.7	-52.9	-69.5	0	0	111.3	F409 L410 F415 G484 L485	F409-M488 VanDerWaalsContact CD1-O 3.3Å; F409-M488 WeakPolarHBondContact CD1-O 3.49Å; L410-M488 HydrophobicContact CB-SD 4.36Å; L410-M488 HydrophobicContact CD2-SD 4.01Å; L410-M488 PolarHBondContact N-O 2.97Å; F415-M488 HydrophobicContact CE2-CE 4.12Å; F415-M488 HydrophobicContact CE2-SD 4.12Å; F415-M488 HydrophobicContact CZ-CE 4Å; F415-M488 HydrophobicContact CZ-SD 3.53Å; F415-M488 VanDerWaalsContact CZ-SD 3.53Å; G484-M488 WeakPolarHBondContact O-CG 3.45Å; G484-M488 PolarHBondContact O-N 2.94Å; L485-M488 PolarHBondContact O-N 3.08Å
489	M	84.8	Confident	93.1	Very high	81 Å²	81	30.2 Å²	30.2	40%	0.399	15%	0.152	S	C	.	.	H	α-helix	trans	-74.9	-43.4	177	-63.2	-178.7	73.1	0	0	112	K387 L485 L486 C487	K387-M489 WeakPolarHBondContact CE-O 3.39Å; K387-M489 PolarHBondContact NZ-O 2.86Å; L485-M489 PolarHBondContact O-N 3.14Å; L486-M489 PolarHBondContact O-N 2.64Å; C487-M489 PolarHBondContact O-N 3.38Å
490	A	86.2	Confident	93.1	Very high	7 Å²	7	30.5 Å²	30.5	6%	0.058	15%	0.153	C	C	.	.			trans	-132.4	110	-177.1	0	0	0	0	0	111.4	S408 L486 C487 R492 M493	S408-A490 WeakPolarHBondContact O-CA 3.01Å; L486-A490 PolarHBondContact O-N 3.42Å; C487-A490 CarbonylContact O-C 3.47Å; C487-A490 VanDerWaalsContact O-C 3.27Å; C487-A490 PolarHBondContact O-N 3.02Å; A490-R492 PolarHBondContact O-N 2.94Å; A490-R492 VanDerWaalsContact O-N 3.11Å; A490-M493 HydrophobicContact CB-CG 4.08Å; A490-M493 WeakPolarHBondContact O-CB 3.16Å; A490-M493 PolarHBondContact O-N 2.99Å
491	A	88.3	Confident	93.2	Very high	19 Å²	19	30.5 Å²	30.5	16%	0.157	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-54.8	-33.2	-175.8	0	0	0	0	0	113.8	G406 S408 L410 M493 V494	G406-A491 PolarHBondContact O-N 2.9Å; S408-A491 PolarHBondContact O-N 3.28Å; L410-A491 HydrophobicContact CD1-CB 4.3Å; A491-M493 PolarHBondContact O-N 3.36Å; A491-M493 VanDerWaalsContact O-N 3.08Å; A491-V494 VanDerWaalsContact O-CB 3.3Å; A491-V494 WeakPolarHBondContact O-CB 3.39Å; A491-V494 VanDerWaalsContact O-CG1 3.32Å; A491-V494 WeakPolarHBondContact O-CG1 3.45Å; A491-V494 PolarHBondContact O-N 3.45Å
492	R	87.4	Confident	93.2	Very high	70 Å²	70	29.7 Å²	29.7	26%	0.264	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-61.8	-17.8	177.5	-171.4	170.7	-178.4	178.3	-1.7	113.2	R208 E217 G406 A490 V494 Y495	R208-R492 VanDerWaalsContact NH1-NH2 3.12Å; E217-R492 IonicContact OE1-NH2 3.2Å; E217-R492 PolarHBondContact OE1-NH2 3.33Å; G406-R492 WeakPolarHBondContact O-CB 3.12Å; G406-R492 PolarHBondContact O-N 3.25Å; A490-R492 PolarHBondContact O-N 2.94Å; A490-R492 VanDerWaalsContact O-N 3.11Å; R492-V494 PolarHBondContact O-N 2.63Å; R492-Y495 HydrophobicContact CG-CE2 4.46Å; R492-Y495 WeakPolarHBondContact O-CD2 3.47Å
493	M	89.8	Confident	93.3	Very high	49 Å²	49	27.3 Å²	27.3	24%	0.241	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-80.8	1.1	177.9	-56.2	-65.5	170.9	0	0	112.8	L486 C487 A490 A491 Y495 I496 W497	L486-M493 HydrophobicContact CD2-CB 4.24Å; L486-M493 HydrophobicContact CD2-CG 3.94Å; L486-M493 HydrophobicContact CD2-SD 4.16Å; L486-M493 HydrophobicContact CG-CB 4.13Å; L486-M493 HydrophobicContact CG-CG 3.87Å; C487-M493 HydrophobicContact CB-CB 4.46Å; A490-M493 HydrophobicContact CB-CG 4.08Å; A490-M493 WeakPolarHBondContact O-CB 3.16Å; A490-M493 PolarHBondContact O-N 2.99Å; A491-M493 PolarHBondContact O-N 3.36Å; A491-M493 VanDerWaalsContact O-N 3.08Å; M493-Y495 PolarHBondContact O-N 3.32Å; M493-I496 HydrophobicContact CB-CD1 4.28Å; M493-I496 WeakPolarHBondContact O-CB 3.4Å; M493-I496 PolarHBondContact O-N 3.02Å; M493-I496 HydrophobicContact SD-CD1 3.58Å; M493-I496 VanDerWaalsContact SD-CD1 3.58Å; M493-W497 PolarHBondContact O-N 3.28Å
494	V	94.3	Very high	93.5	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-56.2	-35.8	176.3	71.6	0	0	0	0	112.7	Y205 F414 C487 A491 R492 I496 W497 M498	Y205-V494 HydrophobicContact CD1-CG2 4.29Å; Y205-V494 HydrophobicContact CG-CG2 4.42Å; Y205-V494 CarbonylContact O-C 3.54Å; F414-V494 HydrophobicContact CD2-CG2 3.95Å; F414-V494 HydrophobicContact CE2-CG2 3.43Å; F414-V494 VanDerWaalsContact CE2-CG2 3.43Å; F414-V494 HydrophobicContact CZ-CG2 4.12Å; C487-V494 WeakPolarHBondContact SG-CA 3.44Å; C487-V494 PolarHBondContact SG-N 3.44Å; A491-V494 VanDerWaalsContact O-CB 3.3Å; A491-V494 WeakPolarHBondContact O-CB 3.39Å; A491-V494 VanDerWaalsContact O-CG1 3.32Å; A491-V494 WeakPolarHBondContact O-CG1 3.45Å; A491-V494 PolarHBondContact O-N 3.45Å; R492-V494 PolarHBondContact O-N 2.63Å; V494-I496 PolarHBondContact O-N 3.4Å; V494-I496 VanDerWaalsContact O-N 3.11Å; V494-W497 PolarHBondContact O-N 2.99Å; V494-M498 HydrophobicContact CG2-CB 4.25Å; V494-M498 VanDerWaalsContact O-CB 3.23Å; V494-M498 WeakPolarHBondContact O-CB 3.32Å; V494-M498 PolarHBondContact O-N 3.2Å
495	Y	93.3	Very high	93.6	Very high	49 Å²	49	27 Å²	27	19%	0.192	13%	0.134	C	C	.	.	H	α-helix	trans	-64.1	-18.3	178.6	-51.3	-65	0	0	0	113.8	M204 Y205 R208 R492 M493 P499	M204-Y495 VanDerWaalsContact O-CE1 3.29Å; M204-Y495 WeakPolarHBondContact O-CE1 3.36Å; Y205-Y495 WeakPolarHBondContact O-CA 3.48Å; Y205-Y495 VanDerWaalsContact O-CD1 3.28Å; Y205-Y495 WeakPolarHBondContact O-CD1 3.35Å; R208-Y495 VanDerWaalsContact CD-CE2 3.5Å; R208-Y495 HydrophobicContact CG-CD1 3.95Å; R208-Y495 HydrophobicContact CG-CD2 3.99Å; R208-Y495 HydrophobicContact CG-CE1 3.48Å; R208-Y495 VanDerWaalsContact CG-CE1 3.48Å; R208-Y495 HydrophobicContact CG-CE2 3.55Å; R208-Y495 HydrophobicContact CG-CG 4.19Å; R492-Y495 HydrophobicContact CG-CE2 4.46Å; R492-Y495 WeakPolarHBondContact O-CD2 3.47Å; M493-Y495 PolarHBondContact O-N 3.32Å; Y495-P499 WeakPolarHBondContact O-CD 3.36Å; Y495-P499 WeakPolarHBondContact O-CG 3.38Å
496	I	94.8	Very high	93.8	Very high	6 Å²	6	21.3 Å²	21.3	3%	0.031	10%	0.104	C	C	.	.	H	α-helix	trans	-88.9	-39.4	174.2	-63.9	148.4	0	0	0	110.2	L221 W225 L269 M493 V494 Q500	L221-I496 HydrophobicContact CD2-CG1 4.14Å; W225-I496 WeakPolarHBondContact CH2-O 3.46Å; L269-I496 HydrophobicContact CD1-CD1 4.23Å; L269-I496 HydrophobicContact CD1-CG1 4.11Å; L269-I496 HydrophobicContact CD2-CB 4.47Å; L269-I496 HydrophobicContact CD2-CD1 3.74Å; L269-I496 HydrophobicContact CD2-CG1 4.02Å; L269-I496 HydrophobicContact CD2-CG2 3.65Å; L269-I496 HydrophobicContact CG-CD1 4.36Å; M493-I496 HydrophobicContact CB-CD1 4.28Å; M493-I496 WeakPolarHBondContact O-CB 3.4Å; M493-I496 PolarHBondContact O-N 3.02Å; M493-I496 HydrophobicContact SD-CD1 3.58Å; M493-I496 VanDerWaalsContact SD-CD1 3.58Å; V494-I496 PolarHBondContact O-N 3.4Å; V494-I496 VanDerWaalsContact O-N 3.11Å; I496-Q500 PolarHBondContact O-NE2 2.8Å
497	W	97	Very high	94.1	Very high	9 Å²	9	18.5 Å²	18.5	3%	0.034	9%	0.089	C	C	.	.	H	α-helix	trans	-81	-44.4	-174.7	-176.6	31.2	0	0	0	112.7	L410 F414 F415 F424 Y427 S480 G484 C487 M493 V494 Q500 M501	L410-W497 HydrophobicContact CD2-CZ3 3.96Å; F414-W497 HydrophobicContact CE1-CE3 4.23Å; F414-W497 HydrophobicContact CE1-CH2 4.26Å; F414-W497 AromaticContact CE1-CZ3 3.67Å; F414-W497 HydrophobicContact CE1-CZ3 3.67Å; F414-W497 HydrophobicContact CZ-CE3 4.22Å; F414-W497 HydrophobicContact CZ-CZ3 4.12Å; F415-W497 HydrophobicContact CE1-CH2 4.14Å; F415-W497 HydrophobicContact CE1-CZ3 4.5Å; F424-W497 HydrophobicContact CE2-CH2 4.32Å; Y427-W497 AromaticContact CE1-CZ2 3.82Å; Y427-W497 HydrophobicContact CE1-CZ2 3.82Å; Y427-W497 AromaticContact CE1-NE1 3.94Å; Y427-W497 AromaticContact CZ-NE1 3.59Å; Y427-W497 PolarHBondContact OH-NE1 3.29Å; S480-W497 PolarHBondContact O-NE1 2.85Å; S480-W497 PolarHBondContact OG-NE1 3.41Å; G484-W497 VanDerWaalsContact CA-CD2 3.44Å; G484-W497 VanDerWaalsContact CA-CE2 3.45Å; C487-W497 HydrophobicContact CB-CB 4.26Å; C487-W497 HydrophobicContact CB-CD2 4.34Å; C487-W497 HydrophobicContact CB-CE3 3.69Å; C487-W497 HydrophobicContact CB-CZ3 4.38Å; M493-W497 PolarHBondContact O-N 3.28Å; V494-W497 PolarHBondContact O-N 2.99Å; W497-Q500 WeakPolarHBondContact O-CA 3.3Å; W497-Q500 WeakPolarHBondContact O-CB 3.2Å; W497-Q500 PolarHBondContact O-N 3.03Å; W497-M501 HydrophobicContact CD2-CG 4.37Å; W497-M501 HydrophobicContact CD2-SD 3.71Å; W497-M501 VanDerWaalsContact CE2-SD 3.51Å; W497-M501 HydrophobicContact CE3-SD 4.13Å; W497-M501 HydrophobicContact CG-CG 4.37Å; W497-M501 HydrophobicContact CG-SD 4.19Å; W497-M501 HydrophobicContact CH2-SD 4.25Å; W497-M501 HydrophobicContact CZ2-SD 3.82Å; W497-M501 HydrophobicContact CZ3-SD 4.38Å; W497-M501 PolarHBondContact O-N 3.05Å
498	M	97	Very high	94.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-45.7	-172.2	-176.9	64	-176.3	0	0	113.4	H202 Y205 A206 F414 T418 L423 V494 Q500 M501 C502	H202-M498 HydrophobicContact CB-CE 3.14Å; Y205-M498 WeakPolarHBondContact O-CB 3.29Å; A206-M498 HydrophobicContact CB-CG 4.12Å; F414-M498 HydrophobicContact CE2-SD 4.14Å; F414-M498 HydrophobicContact CZ-SD 4.17Å; T418-M498 HydrophobicContact CG2-CE 4.18Å; T418-M498 HydrophobicContact CG2-SD 4.19Å; L423-M498 HydrophobicContact CD2-CE 3.03Å; L423-M498 HydrophobicContact CD2-SD 3.69Å; V494-M498 HydrophobicContact CG2-CB 4.25Å; V494-M498 VanDerWaalsContact O-CB 3.23Å; V494-M498 WeakPolarHBondContact O-CB 3.32Å; V494-M498 PolarHBondContact O-N 3.2Å; M498-Q500 VanDerWaalsContact C-N 3.25Å; M498-Q500 PolarHBondContact O-N 2.87Å; M498-M501 WeakPolarHBondContact O-CB 3.48Å; M498-M501 PolarHBondContact O-N 3.34Å; M498-M501 VanDerWaalsContact O-N 3.09Å; M498-M501 HydrophobicContact SD-CE 4.34Å; M498-M501 HydrophobicContact SD-SD 4.25Å; M498-C502 PolarHBondContact O-N 2.61Å; M498-C502 PolarHBondContact O-SG 2.98Å; M498-C502 VanDerWaalsContact O-SG 3.37Å
499	P	97.7	Very high	94.3	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.1	-34.2	173.7	-28.9	39.9	0	0	0	114	L178 F199 W225 Y495 C502 V503	L178-P499 HydrophobicContact CD1-CB 3.77Å; L178-P499 HydrophobicContact CD2-CB 3.92Å; F199-P499 HydrophobicContact CE2-CG 4.21Å; W225-P499 HydrophobicContact CH2-CB 3.99Å; W225-P499 HydrophobicContact CH2-CG 4.28Å; W225-P499 HydrophobicContact CZ2-CB 3.63Å; W225-P499 HydrophobicContact CZ2-CG 3.63Å; Y495-P499 WeakPolarHBondContact O-CD 3.36Å; Y495-P499 WeakPolarHBondContact O-CG 3.38Å; P499-C502 PolarHBondContact O-N 3.48Å; P499-V503 WeakPolarHBondContact O-CG2 3.47Å; P499-V503 PolarHBondContact O-N 3.02Å
500	Q	97.9	Very high	94.7	Very high	8 Å²	8	12.9 Å²	12.9	4%	0.037	6%	0.064	C	C	.	.	H	α-helix	trans	-70.2	-37.2	176.1	-61.2	178.7	66.5	0	0	111.4	W225 S480 S483 I496 W497 M498 V503 L504	W225-Q500 HydrophobicContact CH2-CG 4.2Å; W225-Q500 HydrophobicContact CZ3-CG 3.86Å; S480-Q500 VanDerWaalsContact N-OE1 3.16Å; S483-Q500 PolarHBondContact OG-NE2 3.23Å; I496-Q500 PolarHBondContact O-NE2 2.8Å; W497-Q500 WeakPolarHBondContact O-CA 3.3Å; W497-Q500 WeakPolarHBondContact O-CB 3.2Å; W497-Q500 PolarHBondContact O-N 3.03Å; M498-Q500 VanDerWaalsContact C-N 3.25Å; M498-Q500 PolarHBondContact O-N 2.87Å; Q500-V503 PolarHBondContact O-N 2.88Å; Q500-L504 WeakPolarHBondContact O-CB 3.14Å; Q500-L504 WeakPolarHBondContact O-CG 3.36Å; Q500-L504 PolarHBondContact O-N 3.15Å
501	M	98.1	Very high	94.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.1	-46	171.8	-67.5	173.9	52.4	0	0	111.2	F414 L423 F424 Y427 W497 M498 V503 L504 A505	F414-M501 HydrophobicContact CE1-SD 4.49Å; F414-M501 HydrophobicContact CZ-CE 4.31Å; F414-M501 HydrophobicContact CZ-SD 4.05Å; L423-M501 HydrophobicContact CD1-CB 4.49Å; L423-M501 HydrophobicContact CD2-CE 4.24Å; L423-M501 HydrophobicContact CG-CE 4.27Å; F424-M501 HydrophobicContact CB-CE 4.22Å; F424-M501 HydrophobicContact CD2-CE 3.78Å; Y427-M501 HydrophobicContact CD1-CE 4.28Å; Y427-M501 HydrophobicContact CD1-CG 4.05Å; Y427-M501 HydrophobicContact CD2-CB 4.11Å; Y427-M501 HydrophobicContact CD2-CG 3.83Å; Y427-M501 HydrophobicContact CE1-CG 4.19Å; Y427-M501 HydrophobicContact CE2-CG 3.98Å; Y427-M501 HydrophobicContact CG-CB 4.21Å; Y427-M501 HydrophobicContact CG-CE 4.43Å; Y427-M501 HydrophobicContact CG-CG 3.86Å; W497-M501 HydrophobicContact CD2-CG 4.37Å; W497-M501 HydrophobicContact CD2-SD 3.71Å; W497-M501 VanDerWaalsContact CE2-SD 3.51Å; W497-M501 HydrophobicContact CE3-SD 4.13Å; W497-M501 HydrophobicContact CG-CG 4.37Å; W497-M501 HydrophobicContact CG-SD 4.19Å; W497-M501 HydrophobicContact CH2-SD 4.25Å; W497-M501 HydrophobicContact CZ2-SD 3.82Å; W497-M501 HydrophobicContact CZ3-SD 4.38Å; W497-M501 PolarHBondContact O-N 3.05Å; M498-M501 WeakPolarHBondContact O-CB 3.48Å; M498-M501 PolarHBondContact O-N 3.34Å; M498-M501 VanDerWaalsContact O-N 3.09Å; M498-M501 HydrophobicContact SD-CE 4.34Å; M498-M501 HydrophobicContact SD-SD 4.25Å; M501-V503 VanDerWaalsContact C-N 3.33Å; M501-V503 PolarHBondContact O-N 3.13Å; M501-L504 PolarHBondContact O-N 2.9Å; M501-A505 WeakPolarHBondContact O-CB 3.27Å; M501-A505 PolarHBondContact O-N 2.94Å
502	C	98.3	Very high	94.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-57.2	-45.3	177.9	-63.6	0	0	0	0	112.1	F198 M498 P499 S506	F198-C502 HydrophobicContact CB-CB 4.14Å; M498-C502 PolarHBondContact O-N 2.61Å; M498-C502 PolarHBondContact O-SG 2.98Å; M498-C502 VanDerWaalsContact O-SG 3.37Å; P499-C502 PolarHBondContact O-N 3.48Å; C502-S506 VanDerWaalsContact O-CB 3.28Å; C502-S506 WeakPolarHBondContact O-CB 3.49Å; C502-S506 PolarHBondContact O-N 3.03Å; C502-S506 PolarHBondContact O-OG 3.48Å
503	V	98.2	Very high	94.4	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.018	7%	0.07	C	C	.	.	H	α-helix	trans	-63.8	-51.1	177.6	173.1	0	0	0	0	110.9	L178 L181 L185 P499 Q500 M501 S506 C507	L178-V503 HydrophobicContact CB-CG2 4.35Å; L178-V503 HydrophobicContact CD2-CG2 3.8Å; L181-V503 HydrophobicContact CD2-CG1 4.26Å; L181-V503 HydrophobicContact CD2-CG2 4.26Å; L181-V503 HydrophobicContact CG-CG1 4.14Å; L185-V503 HydrophobicContact CD1-CG1 3.51Å; P499-V503 WeakPolarHBondContact O-CG2 3.47Å; P499-V503 PolarHBondContact O-N 3.02Å; Q500-V503 PolarHBondContact O-N 2.88Å; M501-V503 VanDerWaalsContact C-N 3.33Å; M501-V503 PolarHBondContact O-N 3.13Å; V503-S506 PolarHBondContact O-N 3.34Å; V503-C507 PolarHBondContact O-N 3.47Å; V503-C507 PolarHBondContact O-SG 3.29Å
504	L	97.9	Very high	94.1	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-69.1	-43.3	-174.8	-73.1	173	0	0	0	112.5	Y427 M430 L473 L476 V477 S480 Q500 M501 S506 C507 V508	Y427-L504 HydrophobicContact CD2-CB 4.08Å; Y427-L504 HydrophobicContact CD2-CD1 4.28Å; Y427-L504 HydrophobicContact CE2-CB 4.46Å; Y427-L504 HydrophobicContact CE2-CD1 3.81Å; M430-L504 WeakPolarHBondContact CE-O 3.45Å; M430-L504 HydrophobicContact CG-CB 4.17Å; M430-L504 HydrophobicContact CG-CD2 4.22Å; L473-L504 HydrophobicContact CD1-CD2 3.82Å; L476-L504 HydrophobicContact CB-CD2 4.09Å; V477-L504 HydrophobicContact CG2-CD1 4.42Å; V477-L504 HydrophobicContact CG2-CD2 3.95Å; S480-L504 VanDerWaalsContact CB-CD1 3.48Å; Q500-L504 WeakPolarHBondContact O-CB 3.14Å; Q500-L504 WeakPolarHBondContact O-CG 3.36Å; Q500-L504 PolarHBondContact O-N 3.15Å; M501-L504 PolarHBondContact O-N 2.9Å; L504-S506 VanDerWaalsContact C-N 3.31Å; L504-S506 PolarHBondContact O-N 3.26Å; L504-C507 WeakPolarHBondContact O-CB 3.46Å; L504-C507 PolarHBondContact O-N 2.85Å; L504-C507 VanDerWaalsContact O-N 3.15Å; L504-V508 PolarHBondContact O-N 2.87Å
505	A	97.9	Very high	93.6	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.4	-41.7	175.4	0	0	0	0	0	111.7	F198 L423 L426 M501 C507 V508	F198-A505 HydrophobicContact CD2-CB 4.47Å; F198-A505 HydrophobicContact CE2-CB 4.02Å; L423-A505 HydrophobicContact CD1-CB 3.52Å; L426-A505 HydrophobicContact CB-CB 3.85Å; M501-A505 WeakPolarHBondContact O-CB 3.27Å; M501-A505 PolarHBondContact O-N 2.94Å; A505-C507 VanDerWaalsContact C-N 3.31Å; A505-C507 PolarHBondContact O-N 3.31Å; A505-V508 WeakPolarHBondContact O-CB 3.47Å; A505-V508 PolarHBondContact O-N 2.86Å
506	S	97.8	Very high	92.9	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-65	-35.6	175.9	-57.4	0	0	0	0	112.4	A191 C195 C502 V503 L504 V508 L509 G510	A191-S506 VanDerWaalsContact O-CB 3.3Å; A191-S506 WeakPolarHBondContact O-CB 3.47Å; C195-S506 WeakPolarHBondContact CA-OG 3.43Å; C195-S506 PolarHBondContact N-OG 3.49Å; C502-S506 VanDerWaalsContact O-CB 3.28Å; C502-S506 WeakPolarHBondContact O-CB 3.49Å; C502-S506 PolarHBondContact O-N 3.03Å; C502-S506 PolarHBondContact O-OG 3.48Å; V503-S506 PolarHBondContact O-N 3.34Å; L504-S506 VanDerWaalsContact C-N 3.31Å; L504-S506 PolarHBondContact O-N 3.26Å; S506-V508 VanDerWaalsContact C-N 3.33Å; S506-V508 PolarHBondContact O-N 3.27Å; S506-L509 PolarHBondContact O-N 2.9Å; S506-G510 PolarHBondContact O-N 2.93Å
507	C	95.9	Very high	91.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.4	-30.9	176.4	-70.2	0	0	0	0	112.9	M430 V503 L504 A505 L509 G510 D511	M430-C507 HydrophobicContact CE-CB 3.5Å; V503-C507 PolarHBondContact O-N 3.47Å; V503-C507 PolarHBondContact O-SG 3.29Å; L504-C507 WeakPolarHBondContact O-CB 3.46Å; L504-C507 PolarHBondContact O-N 2.85Å; L504-C507 VanDerWaalsContact O-N 3.15Å; A505-C507 VanDerWaalsContact C-N 3.31Å; A505-C507 PolarHBondContact O-N 3.31Å; C507-L509 VanDerWaalsContact C-N 3.27Å; C507-L509 PolarHBondContact O-N 3.36Å; C507-G510 PolarHBondContact O-N 3.25Å; C507-D511 WeakPolarHBondContact O-CB 3.43Å; C507-D511 PolarHBondContact O-N 2.82Å
508	V	94.2	Very high	90.9	Very high	22 Å²	22	24.3 Å²	24.3	13%	0.133	13%	0.13	C	C	.	.	H	α-helix	trans	-58.2	-42.7	177.3	175.4	0	0	0	0	111.1	L426 V429 M430 L504 A505 S506 W515	L426-V508 WeakPolarHBondContact O-CG2 3.22Å; V429-V508 HydrophobicContact CG1-CG1 4.19Å; M430-V508 HydrophobicContact CB-CG2 3.33Å; M430-V508 HydrophobicContact CE-CB 4.25Å; M430-V508 HydrophobicContact CE-CG2 3.48Å; M430-V508 VanDerWaalsContact CE-CG2 3.48Å; M430-V508 VanDerWaalsContact CE-N 3.3Å; M430-V508 HydrophobicContact CG-CG2 3.89Å; M430-V508 HydrophobicContact SD-CG2 3.78Å; L504-V508 PolarHBondContact O-N 2.87Å; A505-V508 WeakPolarHBondContact O-CB 3.47Å; A505-V508 PolarHBondContact O-N 2.86Å; S506-V508 VanDerWaalsContact C-N 3.33Å; S506-V508 PolarHBondContact O-N 3.27Å; V508-W515 PolarHBondContact O-NE1 3.04Å
509	L	93.5	Very high	89.7	Confident	19 Å²	19	25.2 Å²	25.2	10%	0.099	14%	0.135	C	C	.	.	H	α-helix	trans	-82.5	-33.6	179.5	-60.1	-176.1	0	0	0	111.9	L194 L426 S506 C507 Q534 L538 A541	L194-L509 HydrophobicContact CD2-CD1 3.83Å; L426-L509 HydrophobicContact CD1-CD1 3.96Å; L426-L509 HydrophobicContact CD1-CG 4.43Å; L426-L509 HydrophobicContact CD2-CD1 4.44Å; L426-L509 HydrophobicContact CD2-CD2 4.04Å; L426-L509 HydrophobicContact CD2-CG 4.24Å; S506-L509 PolarHBondContact O-N 2.9Å; C507-L509 VanDerWaalsContact C-N 3.27Å; C507-L509 PolarHBondContact O-N 3.36Å; L509-Q534 WeakPolarHBondContact O-CG 3.34Å; L509-Q534 PolarHBondContact O-NE2 2.87Å; L509-Q534 VanDerWaalsContact O-NE2 3.07Å; L509-L538 HydrophobicContact CB-CD2 3.53Å; L509-L538 HydrophobicContact CB-CG 4.1Å; L509-L538 HydrophobicContact CD1-CD2 4.42Å; L509-A541 HydrophobicContact CD1-CB 4.2Å
510	G	92.4	Very high	88.2	Confident	2 Å²	2	27.6 Å²	27.6	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-85.2	-29.5	-173.2	0	0	0	0	0	117	S506 C507 T512 Q534	S506-G510 PolarHBondContact O-N 2.93Å; C507-G510 PolarHBondContact O-N 3.25Å; G510-T512 PolarHBondContact O-N 2.87Å; G510-Q534 PolarHBondContact O-NE2 3.08Å
511	D	90.8	Very high	86.7	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.016	20%	0.196	C	C	.	.			trans	-80.7	106.9	-168.1	-172.9	-33.5	0	0	0	112.1	R470 C507 D513 L514 W515 Q534	R470-D511 IonicContact CZ-OD2 3.09Å; R470-D511 VanDerWaalsContact NH1-CG 3.34Å; R470-D511 IonicContact NH1-OD1 3.11Å; R470-D511 PolarHBondContact NH1-OD1 2.94Å; R470-D511 IonicContact NH1-OD2 2.96Å; R470-D511 PolarHBondContact NH1-OD2 2.84Å; R470-D511 IonicContact NH2-OD2 2.6Å; R470-D511 PolarHBondContact NH2-OD2 3.38Å; C507-D511 WeakPolarHBondContact O-CB 3.43Å; C507-D511 PolarHBondContact O-N 2.82Å; D511-D513 VanDerWaalsContact C-N 3.27Å; D511-D513 PolarHBondContact O-N 2.77Å; D511-D513 WeakPolarHBondContact OD1-CA 3.15Å; D511-D513 PolarHBondContact OD1-N 2.94Å; D511-L514 HydrophobicContact CB-CB 4.11Å; D511-L514 HydrophobicContact CB-CD1 3.79Å; D511-L514 HydrophobicContact CB-CG 4Å; D511-L514 PolarHBondContact O-N 3.4Å; D511-L514 PolarHBondContact OD1-N 3.42Å; D511-L514 VanDerWaalsContact OD1-N 3.11Å; D511-W515 VanDerWaalsContact O-CD1 3.27Å; D511-W515 PolarHBondContact O-N 2.93Å; D511-Q534 PolarHBondContact O-NE2 2.98Å
512	T	84.4	Confident	85.2	Confident	30 Å²	30	37.6 Å²	37.6	18%	0.184	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-30.1	-178.4	-50.4	0	0	0	0	113	G510 W515 K516 V530 Q534	G510-T512 PolarHBondContact O-N 2.87Å; T512-W515 PolarHBondContact O-N 3.48Å; T512-K516 HydrophobicContact CG2-CD 4.38Å; T512-K516 HydrophobicContact CG2-CG 4.45Å; T512-K516 WeakPolarHBondContact O-CB 3.42Å; T512-K516 VanDerWaalsContact O-CG 3.28Å; T512-K516 WeakPolarHBondContact O-CG 3.28Å; T512-K516 PolarHBondContact O-N 2.58Å; T512-V530 HydrophobicContact CG2-CG1 4.43Å; T512-Q534 PolarHBondContact OG1-OE1 3.32Å
513	D	81.6	Confident	83.8	Confident	76 Å²	76	47.6 Å²	47.6	41%	0.406	26%	0.258	S	S	.	.	H	α-helix	trans	-76.9	-32.3	-177.8	-70.4	-20.1	0	0	0	111.8	D511 K516 S517	D511-D513 VanDerWaalsContact C-N 3.27Å; D511-D513 PolarHBondContact O-N 2.77Å; D511-D513 WeakPolarHBondContact OD1-CA 3.15Å; D511-D513 PolarHBondContact OD1-N 2.94Å; D513-K516 IonicContact OD1-NZ 3.92Å; D513-K516 PolarHBondContact OD1-NZ 2.82Å; D513-S517 WeakPolarHBondContact O-CB 3.34Å; D513-S517 PolarHBondContact O-N 3.21Å; D513-S517 VanDerWaalsContact O-N 3.1Å; D513-S517 PolarHBondContact O-OG 3.36Å
514	L	84	Confident	82.3	Confident	28 Å²	28	52.2 Å²	52.2	15%	0.147	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-50	166.7	-72.4	176.9	0	0	0	110.9	M430 F466 L473 D511 K516 S517 V518	M430-L514 HydrophobicContact CE-CD1 3.49Å; M430-L514 VanDerWaalsContact CE-CD1 3.49Å; M430-L514 HydrophobicContact SD-CD1 3.83Å; F466-L514 HydrophobicContact CE1-CD2 3.89Å; F466-L514 HydrophobicContact CE2-CD2 4.49Å; F466-L514 HydrophobicContact CZ-CD2 3.49Å; F466-L514 VanDerWaalsContact CZ-CD2 3.49Å; F466-L514 HydrophobicContact CZ-CG 4.3Å; L473-L514 HydrophobicContact CD2-CD1 4.1Å; L473-L514 HydrophobicContact CD2-CD2 4.12Å; L473-L514 HydrophobicContact CD2-CG 4.44Å; D511-L514 HydrophobicContact CB-CB 4.11Å; D511-L514 HydrophobicContact CB-CD1 3.79Å; D511-L514 HydrophobicContact CB-CG 4Å; D511-L514 PolarHBondContact O-N 3.4Å; D511-L514 PolarHBondContact OD1-N 3.42Å; D511-L514 VanDerWaalsContact OD1-N 3.11Å; L514-K516 PolarHBondContact O-N 2.6Å; L514-S517 WeakPolarHBondContact O-CB 3.5Å; L514-S517 PolarHBondContact O-N 2.91Å; L514-V518 WeakPolarHBondContact O-CG2 3.35Å; L514-V518 PolarHBondContact O-N 3.4Å
515	W	82.4	Confident	80.7	Confident	52 Å²	52	61.7 Å²	61.7	20%	0.197	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-40	-179.8	-83.1	67.5	0	0	0	113.3	V508 D511 T512 S517 V518 I519 V530 T533 Q534 L537	V508-W515 PolarHBondContact O-NE1 3.04Å; D511-W515 VanDerWaalsContact O-CD1 3.27Å; D511-W515 PolarHBondContact O-N 2.93Å; T512-W515 PolarHBondContact O-N 3.48Å; W515-S517 VanDerWaalsContact C-N 3.27Å; W515-S517 PolarHBondContact O-N 3.18Å; W515-V518 PolarHBondContact O-N 3.42Å; W515-I519 HydrophobicContact CE3-CD1 3.82Å; W515-I519 HydrophobicContact CZ3-CD1 4.45Å; W515-I519 VanDerWaalsContact O-CB 3.28Å; W515-I519 WeakPolarHBondContact O-CB 3.47Å; W515-I519 WeakPolarHBondContact O-CG1 3.37Å; W515-I519 PolarHBondContact O-N 3.02Å; W515-V530 HydrophobicContact CB-CG1 3.57Å; W515-V530 HydrophobicContact CD2-CG1 4.36Å; W515-V530 HydrophobicContact CE3-CG1 4.17Å; W515-V530 HydrophobicContact CG-CG1 4.17Å; W515-T533 HydrophobicContact CH2-CG2 4.28Å; W515-T533 HydrophobicContact CZ3-CG2 4.12Å; W515-Q534 HydrophobicContact CD2-CG 3.97Å; W515-Q534 HydrophobicContact CE3-CG 4.44Å; W515-Q534 HydrophobicContact CG-CG 4.19Å; W515-Q534 HydrophobicContact CZ2-CG 4.49Å; W515-L537 HydrophobicContact CH2-CD1 3.49Å; W515-L537 VanDerWaalsContact CH2-CD1 3.49Å; W515-L537 HydrophobicContact CZ2-CD1 3.8Å
516	K	78.5	Confident	79.1	Confident	117 Å²	117	72.2 Å²	72.2	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-62.7	-36	173.6	-75.3	169.3	-171.3	150.7	0	112.1	T512 D513 L514 G520	T512-K516 HydrophobicContact CG2-CD 4.38Å; T512-K516 HydrophobicContact CG2-CG 4.45Å; T512-K516 WeakPolarHBondContact O-CB 3.42Å; T512-K516 VanDerWaalsContact O-CG 3.28Å; T512-K516 WeakPolarHBondContact O-CG 3.28Å; T512-K516 PolarHBondContact O-N 2.58Å; D513-K516 IonicContact OD1-NZ 3.92Å; D513-K516 PolarHBondContact OD1-NZ 2.82Å; L514-K516 PolarHBondContact O-N 2.6Å; K516-G520 WeakPolarHBondContact O-CA 3.22Å; K516-G520 PolarHBondContact O-N 3.33Å
517	S	74.6	Confident	77.7	Confident	58 Å²	58	81.3 Å²	81.3	41%	0.406	39%	0.393	S	S	.	.	H	α-helix	trans	-70.3	-42.9	179.1	-57.3	0	0	0	0	110.9	D513 L514 W515	D513-S517 WeakPolarHBondContact O-CB 3.34Å; D513-S517 PolarHBondContact O-N 3.21Å; D513-S517 VanDerWaalsContact O-N 3.1Å; D513-S517 PolarHBondContact O-OG 3.36Å; L514-S517 WeakPolarHBondContact O-CB 3.5Å; L514-S517 PolarHBondContact O-N 2.91Å; W515-S517 VanDerWaalsContact C-N 3.27Å; W515-S517 PolarHBondContact O-N 3.18Å
518	V	75.3	Confident	76.7	Confident	92 Å²	92	83.5 Å²	83.5	56%	0.558	41%	0.406	S	S	*	.	H	α-helix	trans	-69.4	-50.7	177	176.2	0	0	0	0	111.7	L514 W515 G520 L521	L514-V518 WeakPolarHBondContact O-CG2 3.35Å; L514-V518 PolarHBondContact O-N 3.4Å; W515-V518 PolarHBondContact O-N 3.42Å; V518-G520 PolarHBondContact O-N 3.37Å; V518-L521 VanDerWaalsContact O-CB 3.27Å; V518-L521 WeakPolarHBondContact O-CB 3.34Å; V518-L521 PolarHBondContact O-N 3.01Å
519	I	73.2	Confident	76.1	Confident	19 Å²	19	87.8 Å²	87.8	10%	0.097	43%	0.428	C	S	.	.	H	α-helix	trans	-65.6	-30	179.2	-68	170.9	0	0	0	110.9	W515 L521 T522 R525 V530	W515-I519 HydrophobicContact CE3-CD1 3.82Å; W515-I519 HydrophobicContact CZ3-CD1 4.45Å; W515-I519 VanDerWaalsContact O-CB 3.28Å; W515-I519 WeakPolarHBondContact O-CB 3.47Å; W515-I519 WeakPolarHBondContact O-CG1 3.37Å; W515-I519 PolarHBondContact O-N 3.02Å; I519-L521 PolarHBondContact O-N 2.96Å; I519-L521 VanDerWaalsContact O-N 3.14Å; I519-T522 CarbonylContact O-C 3.05Å; I519-T522 WeakPolarHBondContact O-CA 3.04Å; I519-T522 PolarHBondContact O-N 2.98Å; I519-T522 PolarHBondContact O-OG1 3.12Å; I519-R525 HydrophobicContact CG2-CB 3.98Å; I519-R525 HydrophobicContact CG2-CG 4.45Å; I519-V530 HydrophobicContact CD1-CG1 4.45Å; I519-V530 HydrophobicContact CD1-CG2 3.57Å
520	G	64.4	Low	75.7	Confident	49 Å²	49	88 Å²	88	51%	0.505	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.1	172.3	0	0	0	0	0	114	K516 V518 T522	K516-G520 WeakPolarHBondContact O-CA 3.22Å; K516-G520 PolarHBondContact O-N 3.33Å; V518-G520 PolarHBondContact O-N 3.37Å; G520-T522 VanDerWaalsContact C-N 3.31Å
521	L	66.5	Low	75.4	Confident	154 Å²	154	94.8 Å²	94.8	81%	0.806	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-11	173.9	-57.8	169.1	0	0	0	113	V518 I519	V518-L521 VanDerWaalsContact O-CB 3.27Å; V518-L521 WeakPolarHBondContact O-CB 3.34Å; V518-L521 PolarHBondContact O-N 3.01Å; I519-L521 PolarHBondContact O-N 2.96Å; I519-L521 VanDerWaalsContact O-N 3.14Å
522	T	68.3	Low	75.3	Confident	65 Å²	65	96.9 Å²	96.9	40%	0.399	48%	0.477	S	S	.	.	S	Bend	trans	-116.8	147.9	-175.1	67.6	0	0	0	0	111.6	I519 G520 L524	I519-T522 CarbonylContact O-C 3.05Å; I519-T522 WeakPolarHBondContact O-CA 3.04Å; I519-T522 PolarHBondContact O-N 2.98Å; I519-T522 PolarHBondContact O-OG1 3.12Å; G520-T522 VanDerWaalsContact C-N 3.31Å; T522-L524 PolarHBondContact O-N 3.47Å; T522-L524 VanDerWaalsContact O-N 3.08Å
523	K	68.7	Low	75.6	Confident	209 Å²	209	97.8 Å²	97.8	91%	0.909	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-67	-5	173.3	-66.8	-177.3	-179.2	176.8	0	113.2	R525	K523-R525 PolarHBondContact O-N 3.2Å
524	L	66.8	Low	76	Confident	101 Å²	101	94.5 Å²	94.5	53%	0.529	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-72.3	-9.1	-177.1	-94.3	79.4	0	0	0	114.9	T522 R526 Y527 V528	T522-L524 PolarHBondContact O-N 3.47Å; T522-L524 VanDerWaalsContact O-N 3.08Å; L524-R526 PolarHBondContact O-N 3.09Å; L524-Y527 PolarHBondContact O-N 3.43Å; L524-V528 HydrophobicContact CB-CG2 4.4Å; L524-V528 HydrophobicContact CD2-CG2 4.15Å; L524-V528 PolarHBondContact O-N 2.95Å
525	R	64.3	Low	76.5	Confident	200 Å²	200	94.8 Å²	94.8	76%	0.755	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-49.6	-30.3	-175.6	-174.5	177.3	177.7	-171.1	-0.2	114.7	I519 K523	I519-R525 HydrophobicContact CG2-CB 3.98Å; I519-R525 HydrophobicContact CG2-CG 4.45Å; K523-R525 PolarHBondContact O-N 3.2Å
526	R	63.3	Low	77.1	Confident	220 Å²	220	97 Å²	97	83%	0.83	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-80.3	-19.9	-176.4	-161.3	177.8	-76.3	172	-4.2	113.6	L524	L524-R526 PolarHBondContact O-N 3.09Å
527	Y	67.6	Low	77.9	Confident	192 Å²	192	94.7 Å²	94.7	75%	0.753	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-21.7	-170.3	-58.9	-72.5	0	0	0	114.1	L524	L524-Y527 PolarHBondContact O-N 3.43Å
528	V	74.8	Confident	79	Confident	45 Å²	45	92 Å²	92	27%	0.273	46%	0.464	S	S	.	.			trans	-102.6	116.8	-172.9	-176.8	0	0	0	0	110.9	L524 V530 T533	L524-V528 HydrophobicContact CB-CG2 4.4Å; L524-V528 HydrophobicContact CD2-CG2 4.15Å; L524-V528 PolarHBondContact O-N 2.95Å; V528-V530 VanDerWaalsContact C-N 3.35Å; V528-V530 PolarHBondContact O-N 2.89Å; V528-T533 WeakPolarHBondContact CG1-OG1 3.11Å
529	N	83.5	Confident	80	Confident	112 Å²	112	92 Å²	92	60%	0.599	46%	0.46	S	S	*	.			trans	-75.6	89.9	165.8	-175.4	-9.9	0	0	0	109.4	K531 A532 T533	N529-K531 PolarHBondContact O-N 2.83Å; N529-K531 VanDerWaalsContact O-N 3.11Å; N529-K531 PolarHBondContact OD1-N 3.41Å; N529-A532 HydrophobicContact CB-CB 4.02Å; N529-A532 PolarHBondContact O-N 3.33Å; N529-T533 PolarHBondContact O-N 2.62Å; N529-T533 PolarHBondContact O-OG1 3.37Å
530	V	84.8	Confident	81.1	Confident	25 Å²	25	93.8 Å²	93.8	15%	0.152	48%	0.478	C	S	.	.	H	α-helix	trans	-45.9	-46.5	-175.2	-178.2	0	0	0	0	112.7	T512 W515 I519 V528 A532 T533 Q534	T512-V530 HydrophobicContact CG2-CG1 4.43Å; W515-V530 HydrophobicContact CB-CG1 3.57Å; W515-V530 HydrophobicContact CD2-CG1 4.36Å; W515-V530 HydrophobicContact CE3-CG1 4.17Å; W515-V530 HydrophobicContact CG-CG1 4.17Å; I519-V530 HydrophobicContact CD1-CG1 4.45Å; I519-V530 HydrophobicContact CD1-CG2 3.57Å; V528-V530 VanDerWaalsContact C-N 3.35Å; V528-V530 PolarHBondContact O-N 2.89Å; V530-A532 PolarHBondContact O-N 3.35Å; V530-T533 PolarHBondContact O-N 3.11Å; V530-Q534 HydrophobicContact CG1-CG 4.26Å; V530-Q534 WeakPolarHBondContact O-CB 3.41Å; V530-Q534 VanDerWaalsContact O-CG 3.23Å; V530-Q534 WeakPolarHBondContact O-CG 3.23Å; V530-Q534 PolarHBondContact O-N 3.45Å
531	K	85.9	Confident	82.7	Confident	144 Å²	144	92.1 Å²	92.1	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-67.2	-38.8	-177.6	-71.4	-169	174	-170.6	0	112.8	N529 A535	N529-K531 PolarHBondContact O-N 2.83Å; N529-K531 VanDerWaalsContact O-N 3.11Å; N529-K531 PolarHBondContact OD1-N 3.41Å; K531-A535 WeakPolarHBondContact O-CB 3.22Å; K531-A535 PolarHBondContact O-N 2.95Å
532	A	88.5	Confident	84.2	Confident	46 Å²	46	85.7 Å²	85.7	38%	0.38	43%	0.426	S	S	.	.	H	α-helix	trans	-67.2	-44.2	177	0	0	0	0	0	110.5	N529 V530 A535 V536	N529-A532 HydrophobicContact CB-CB 4.02Å; N529-A532 PolarHBondContact O-N 3.33Å; V530-A532 PolarHBondContact O-N 3.35Å; A532-A535 PolarHBondContact O-N 3.2Å; A532-V536 WeakPolarHBondContact O-CG2 3.48Å; A532-V536 PolarHBondContact O-N 3.24Å
533	T	89.7	Confident	85.6	Confident	49 Å²	49	87.1 Å²	87.1	30%	0.301	44%	0.435	S	S	.	.	H	α-helix	trans	-61.1	-46.3	175.4	-53.3	0	0	0	0	111.8	W515 V528 N529 V530 A535 V536 L537	W515-T533 HydrophobicContact CH2-CG2 4.28Å; W515-T533 HydrophobicContact CZ3-CG2 4.12Å; V528-T533 WeakPolarHBondContact CG1-OG1 3.11Å; N529-T533 PolarHBondContact O-N 2.62Å; N529-T533 PolarHBondContact O-OG1 3.37Å; V530-T533 PolarHBondContact O-N 3.11Å; T533-A535 VanDerWaalsContact C-N 3.33Å; T533-A535 PolarHBondContact O-N 3.02Å; T533-V536 PolarHBondContact O-N 3.38Å; T533-L537 HydrophobicContact CG2-CD1 4.07Å; T533-L537 HydrophobicContact CG2-CG 4.45Å; T533-L537 WeakPolarHBondContact O-CG 3.28Å; T533-L537 PolarHBondContact O-N 3.2Å
534	Q	91.9	Very high	86.9	Confident	8 Å²	8	82.4 Å²	82.4	4%	0.037	41%	0.412	C	S	.	.	H	α-helix	trans	-58.6	-44.8	175.3	-73.7	-176.6	-55.4	0	0	111.5	L509 G510 D511 T512 W515 V530 V536 L537 L538	L509-Q534 WeakPolarHBondContact O-CG 3.34Å; L509-Q534 PolarHBondContact O-NE2 2.87Å; L509-Q534 VanDerWaalsContact O-NE2 3.07Å; G510-Q534 PolarHBondContact O-NE2 3.08Å; D511-Q534 PolarHBondContact O-NE2 2.98Å; T512-Q534 PolarHBondContact OG1-OE1 3.32Å; W515-Q534 HydrophobicContact CD2-CG 3.97Å; W515-Q534 HydrophobicContact CE3-CG 4.44Å; W515-Q534 HydrophobicContact CG-CG 4.19Å; W515-Q534 HydrophobicContact CZ2-CG 4.49Å; V530-Q534 HydrophobicContact CG1-CG 4.26Å; V530-Q534 WeakPolarHBondContact O-CB 3.41Å; V530-Q534 VanDerWaalsContact O-CG 3.23Å; V530-Q534 WeakPolarHBondContact O-CG 3.23Å; V530-Q534 PolarHBondContact O-N 3.45Å; Q534-V536 PolarHBondContact O-N 3.32Å; Q534-L537 PolarHBondContact O-N 2.8Å; Q534-L538 VanDerWaalsContact O-CB 3.29Å; Q534-L538 WeakPolarHBondContact O-CB 3.17Å; Q534-L538 WeakPolarHBondContact O-CD1 3.32Å; Q534-L538 WeakPolarHBondContact O-CG 3.42Å; Q534-L538 PolarHBondContact O-N 3.17Å
535	A	93.5	Very high	88.4	Confident	33 Å²	33	77.6 Å²	77.6	27%	0.273	39%	0.387	S	S	.	.	H	α-helix	trans	-61.6	-44.4	178.4	0	0	0	0	0	112.1	L190 K531 A532 T533 L538 L539	L190-A535 HydrophobicContact CD1-CB 4.02Å; K531-A535 WeakPolarHBondContact O-CB 3.22Å; K531-A535 PolarHBondContact O-N 2.95Å; A532-A535 PolarHBondContact O-N 3.2Å; T533-A535 VanDerWaalsContact C-N 3.33Å; T533-A535 PolarHBondContact O-N 3.02Å; A535-L538 PolarHBondContact O-N 3.5Å; A535-L539 WeakPolarHBondContact O-CB 3.47Å; A535-L539 VanDerWaalsContact O-CG 3.25Å; A535-L539 WeakPolarHBondContact O-CG 3.43Å; A535-L539 PolarHBondContact O-N 3.43Å
536	V	95	Very high	89.9	Confident	99 Å²	99	71.8 Å²	71.8	60%	0.6	37%	0.37	S	S	*	.	H	α-helix	trans	-62.7	-46.8	177	172.5	0	0	0	0	111.3	A532 T533 Q534 L539 A540	A532-V536 WeakPolarHBondContact O-CG2 3.48Å; A532-V536 PolarHBondContact O-N 3.24Å; T533-V536 PolarHBondContact O-N 3.38Å; Q534-V536 PolarHBondContact O-N 3.32Å; V536-L539 PolarHBondContact O-N 2.92Å; V536-A540 WeakPolarHBondContact O-CB 3.48Å; V536-A540 PolarHBondContact O-N 3.47Å
537	L	95.2	Very high	91.5	Very high	69 Å²	69	64.3 Å²	64.3	36%	0.361	36%	0.356	S	S	.	.	H	α-helix	trans	-64.8	-42.2	179.3	-69.9	175.3	0	0	0	112.3	W515 T533 Q534 A540 A541	W515-L537 HydrophobicContact CH2-CD1 3.49Å; W515-L537 VanDerWaalsContact CH2-CD1 3.49Å; W515-L537 HydrophobicContact CZ2-CD1 3.8Å; T533-L537 HydrophobicContact CG2-CD1 4.07Å; T533-L537 HydrophobicContact CG2-CG 4.45Å; T533-L537 WeakPolarHBondContact O-CG 3.28Å; T533-L537 PolarHBondContact O-N 3.2Å; Q534-L537 PolarHBondContact O-N 2.8Å; L537-A540 PolarHBondContact O-N 3.25Å; L537-A541 VanDerWaalsContact O-CB 3.29Å; L537-A541 WeakPolarHBondContact O-CB 3.3Å; L537-A541 PolarHBondContact O-N 2.99Å
538	L	97	Very high	92.9	Very high	2 Å²	2	58 Å²	58	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-64.6	-45.8	176.8	-72.4	166.4	0	0	0	111.2	L190 A191 L194 L509 Q534 A535 A541 I542	L190-L538 HydrophobicContact CB-CB 3.89Å; L190-L538 HydrophobicContact CB-CD1 3.7Å; L190-L538 HydrophobicContact CB-CG 4.35Å; L190-L538 HydrophobicContact CD1-CB 4.33Å; L190-L538 HydrophobicContact CD1-CD1 4.49Å; A191-L538 HydrophobicContact CB-CD2 4.27Å; L194-L538 HydrophobicContact CB-CD2 4.33Å; L194-L538 HydrophobicContact CD2-CD2 3.6Å; L509-L538 HydrophobicContact CB-CD2 3.53Å; L509-L538 HydrophobicContact CB-CG 4.1Å; L509-L538 HydrophobicContact CD1-CD2 4.42Å; Q534-L538 VanDerWaalsContact O-CB 3.29Å; Q534-L538 WeakPolarHBondContact O-CB 3.17Å; Q534-L538 WeakPolarHBondContact O-CD1 3.32Å; Q534-L538 WeakPolarHBondContact O-CG 3.42Å; Q534-L538 PolarHBondContact O-N 3.17Å; A535-L538 PolarHBondContact O-N 3.5Å; L538-A541 PolarHBondContact O-N 3.26Å; L538-I542 WeakPolarHBondContact O-CB 3.5Å; L538-I542 WeakPolarHBondContact O-CD1 3.13Å; L538-I542 WeakPolarHBondContact O-CG1 3.11Å; L538-I542 PolarHBondContact O-N 2.7Å
539	L	97.1	Very high	93.8	Very high	90 Å²	90	56.6 Å²	56.6	47%	0.471	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-44.5	177.1	-74	170.3	0	0	0	111.5	L190 A535 V536 A541 I542 T543	L190-L539 HydrophobicContact CD1-CG 4.23Å; L190-L539 HydrophobicContact CD2-CD2 3.79Å; L190-L539 HydrophobicContact CD2-CG 4.35Å; A535-L539 WeakPolarHBondContact O-CB 3.47Å; A535-L539 VanDerWaalsContact O-CG 3.25Å; A535-L539 WeakPolarHBondContact O-CG 3.43Å; A535-L539 PolarHBondContact O-N 3.43Å; V536-L539 PolarHBondContact O-N 2.92Å; L539-A541 PolarHBondContact O-N 2.85Å; L539-I542 PolarHBondContact O-N 3.4Å; L539-T543 WeakPolarHBondContact O-CB 3.5Å; L539-T543 PolarHBondContact O-N 3.44Å; L539-T543 PolarHBondContact O-OG1 3.32Å
540	A	97.2	Very high	94.4	Very high	58 Å²	58	58.1 Å²	58.1	48%	0.479	32%	0.323	S	S	.	.	H	α-helix	trans	-60.5	-45	175.9	0	0	0	0	0	111.9	V536 L537 T543 Y544	V536-A540 WeakPolarHBondContact O-CB 3.48Å; V536-A540 PolarHBondContact O-N 3.47Å; L537-A540 PolarHBondContact O-N 3.25Å; A540-T543 PolarHBondContact O-N 2.76Å; A540-Y544 VanDerWaalsContact O-CB 3.3Å; A540-Y544 WeakPolarHBondContact O-CB 3.28Å; A540-Y544 PolarHBondContact O-N 3.11Å
541	A	97.5	Very high	95	Very high	14 Å²	14	59.9 Å²	59.9	12%	0.116	34%	0.335	C	S	.	.	H	α-helix	trans	-65.5	-40.8	178.2	0	0	0	0	0	112.4	L194 L509 L537 L538 L539 N545	L194-A541 HydrophobicContact CD1-CB 3.73Å; L194-A541 HydrophobicContact CD2-CB 4.11Å; L509-A541 HydrophobicContact CD1-CB 4.2Å; L537-A541 VanDerWaalsContact O-CB 3.29Å; L537-A541 WeakPolarHBondContact O-CB 3.3Å; L537-A541 PolarHBondContact O-N 2.99Å; L538-A541 PolarHBondContact O-N 3.26Å; L539-A541 PolarHBondContact O-N 2.85Å; A541-N545 WeakPolarHBondContact O-CB 3.31Å; A541-N545 PolarHBondContact O-N 3.22Å; A541-N545 PolarHBondContact O-ND2 2.94Å
542	I	97.7	Very high	95.3	Very high	19 Å²	19	57.4 Å²	57.4	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-52.8	175.3	-68.6	160.4	0	0	0	109.7	L190 L193 L194 L538 L539 Y544 N545 L546	L190-I542 HydrophobicContact CB-CD1 4.45Å; L190-I542 HydrophobicContact CD2-CD1 4.26Å; L190-I542 WeakPolarHBondContact O-CD1 3.38Å; L193-I542 HydrophobicContact CB-CD1 3.89Å; L194-I542 HydrophobicContact CB-CD1 4.37Å; L194-I542 HydrophobicContact CB-CG1 3.82Å; L194-I542 HydrophobicContact CD1-CG1 4.06Å; L538-I542 WeakPolarHBondContact O-CB 3.5Å; L538-I542 WeakPolarHBondContact O-CD1 3.13Å; L538-I542 WeakPolarHBondContact O-CG1 3.11Å; L538-I542 PolarHBondContact O-N 2.7Å; L539-I542 PolarHBondContact O-N 3.4Å; I542-Y544 VanDerWaalsContact C-N 3.3Å; I542-Y544 PolarHBondContact O-N 3.11Å; I542-N545 PolarHBondContact O-N 3.38Å; I542-L546 HydrophobicContact CG2-CD1 3.78Å; I542-L546 HydrophobicContact CG2-CG 4.26Å; I542-L546 WeakPolarHBondContact O-CB 3.3Å; I542-L546 WeakPolarHBondContact O-CG 3.42Å; I542-L546 PolarHBondContact O-N 3.2Å
543	T	97.1	Very high	95.5	Very high	95 Å²	95	57.6 Å²	57.6	58%	0.583	32%	0.32	S	S	*	.	H	α-helix	trans	-59.6	-42.2	-179.2	-57.5	0	0	0	0	111.6	L539 A540 L546 A547	L539-T543 WeakPolarHBondContact O-CB 3.5Å; L539-T543 PolarHBondContact O-N 3.44Å; L539-T543 PolarHBondContact O-OG1 3.32Å; A540-T543 PolarHBondContact O-N 2.76Å; T543-L546 PolarHBondContact O-N 3.43Å; T543-A547 WeakPolarHBondContact O-CB 3.3Å; T543-A547 PolarHBondContact O-N 3.48Å
544	Y	97.7	Very high	95.8	Very high	109 Å²	109	59.4 Å²	59.4	43%	0.427	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-47.5	176.6	179.3	-111.9	0	0	0	112.3	K420 T422 A540 I542 L546 A547 L548	K420-Y544 WeakPolarHBondContact O-CE1 3.42Å; K420-Y544 PolarHBondContact O-OH 3.14Å; K420-Y544 VanDerWaalsContact O-OH 3.11Å; T422-Y544 HydrophobicContact CG2-CE1 4.31Å; A540-Y544 VanDerWaalsContact O-CB 3.3Å; A540-Y544 WeakPolarHBondContact O-CB 3.28Å; A540-Y544 PolarHBondContact O-N 3.11Å; I542-Y544 VanDerWaalsContact C-N 3.3Å; I542-Y544 PolarHBondContact O-N 3.11Å; Y544-L546 PolarHBondContact O-N 3.25Å; Y544-A547 PolarHBondContact O-N 3.37Å; Y544-L548 HydrophobicContact CD1-CD1 4.08Å; Y544-L548 HydrophobicContact CE1-CD1 3.5Å; Y544-L548 HydrophobicContact CE1-CG 4.29Å; Y544-L548 HydrophobicContact CE2-CD1 4.36Å; Y544-L548 HydrophobicContact CE2-CG 4.34Å; Y544-L548 WeakPolarHBondContact O-CG 3.4Å; Y544-L548 PolarHBondContact O-N 3.43Å
545	N	97.3	Very high	95.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-69	-33.7	179.8	-80.7	-89.4	0	0	0	112.9	F198 N201 S421 A541 I542 L548 F549	F198-N545 VanDerWaalsContact CD1-OD1 3.27Å; F198-N545 WeakPolarHBondContact CD1-OD1 3.4Å; F198-N545 VanDerWaalsContact CE1-ND2 3.31Å; F198-N545 WeakPolarHBondContact CE1-ND2 3.46Å; F198-N545 WeakPolarHBondContact CE1-OD1 3.28Å; N201-N545 PolarHBondContact OD1-O 3.37Å; S421-N545 WeakPolarHBondContact CB-OD1 3.44Å; S421-N545 PolarHBondContact O-ND2 3.2Å; S421-N545 PolarHBondContact O-OD1 2.92Å; A541-N545 WeakPolarHBondContact O-CB 3.31Å; A541-N545 PolarHBondContact O-N 3.22Å; A541-N545 PolarHBondContact O-ND2 2.94Å; I542-N545 PolarHBondContact O-N 3.38Å; N545-L548 PolarHBondContact O-N 3.18Å; N545-F549 WeakPolarHBondContact O-CB 3.22Å; N545-F549 PolarHBondContact O-N 3Å
546	L	96	Very high	95.8	Very high	78 Å²	78	63.6 Å²	63.6	41%	0.408	34%	0.343	S	S	.	.	H	α-helix	trans	-67.8	-37.7	172.5	-69.1	176.8	0	0	0	111.8	I542 T543 Y544 L548 F549 Y550	I542-L546 HydrophobicContact CG2-CD1 3.78Å; I542-L546 HydrophobicContact CG2-CG 4.26Å; I542-L546 WeakPolarHBondContact O-CB 3.3Å; I542-L546 WeakPolarHBondContact O-CG 3.42Å; I542-L546 PolarHBondContact O-N 3.2Å; T543-L546 PolarHBondContact O-N 3.43Å; Y544-L546 PolarHBondContact O-N 3.25Å; L546-L548 VanDerWaalsContact C-N 3.33Å; L546-F549 PolarHBondContact O-N 2.89Å; L546-Y550 WeakPolarHBondContact O-CB 3.41Å; L546-Y550 PolarHBondContact O-N 2.95Å
547	A	97	Very high	95.7	Very high	64 Å²	64	60.5 Å²	60.5	53%	0.529	32%	0.323	S	S	.	.	H	α-helix	trans	-67.1	-33	175.1	0	0	0	0	0	112.6	T543 Y544 P551	T543-A547 WeakPolarHBondContact O-CB 3.3Å; T543-A547 PolarHBondContact O-N 3.48Å; Y544-A547 PolarHBondContact O-N 3.37Å; A547-P551 VanDerWaalsContact O-CD 3.23Å; A547-P551 WeakPolarHBondContact O-CD 3.39Å
548	L	96.2	Very high	95.6	Very high	59 Å²	59	63 Å²	63	31%	0.309	33%	0.333	S	S	.	.	H	α-helix	trans	-71.4	-38.6	172.4	-72.3	179.5	0	0	0	112.7	N201 Y544 N545 L546 P551	N201-L548 VanDerWaalsContact OD1-CB 3.31Å; N201-L548 WeakPolarHBondContact OD1-CB 3.43Å; Y544-L548 HydrophobicContact CD1-CD1 4.08Å; Y544-L548 HydrophobicContact CE1-CD1 3.5Å; Y544-L548 HydrophobicContact CE1-CG 4.29Å; Y544-L548 HydrophobicContact CE2-CD1 4.36Å; Y544-L548 HydrophobicContact CE2-CG 4.34Å; Y544-L548 WeakPolarHBondContact O-CG 3.4Å; Y544-L548 PolarHBondContact O-N 3.43Å; N545-L548 PolarHBondContact O-N 3.18Å; L546-L548 VanDerWaalsContact C-N 3.33Å; L548-P551 WeakPolarHBondContact O-CD 3.32Å
549	F	95.2	Very high	95.3	Very high	15 Å²	15	66.7 Å²	66.7	7%	0.066	35%	0.35	C	S	.	.	H	α-helix	trans	-74.1	-30.4	-180	172.6	-112.3	0	0	0	113.2	F64 Y68 L200 N201 N545 L546 D552 Y553	F64-F549 AromaticContact CE1-CE1 3.97Å; F64-F549 HydrophobicContact CE1-CE1 3.97Å; F64-F549 HydrophobicContact CE1-CZ 4.28Å; F64-F549 HydrophobicContact CZ-CE1 4.07Å; Y68-F549 HydrophobicContact CD2-CZ 4.19Å; Y68-F549 HydrophobicContact CE2-CE2 4.45Å; Y68-F549 HydrophobicContact CE2-CZ 4.03Å; L200-F549 HydrophobicContact CB-CD2 4.39Å; L200-F549 HydrophobicContact CB-CE1 4.4Å; L200-F549 HydrophobicContact CB-CE2 4.24Å; L200-F549 HydrophobicContact CB-CZ 4.24Å; L200-F549 WeakPolarHBondContact O-CD2 3.49Å; L200-F549 WeakPolarHBondContact O-CE2 3.28Å; N201-F549 HydrophobicContact CB-CB 4.27Å; N201-F549 PolarHBondContact OD1-N 3.32Å; N545-F549 WeakPolarHBondContact O-CB 3.22Å; N545-F549 PolarHBondContact O-N 3Å; L546-F549 PolarHBondContact O-N 2.89Å; F549-D552 PolarHBondContact O-N 3.02Å; F549-Y553 AromaticContact CE1-CD2 3.93Å; F549-Y553 HydrophobicContact CE1-CD2 3.93Å; F549-Y553 HydrophobicContact CE1-CG 4.14Å; F549-Y553 AromaticContact CZ-CD2 3.95Å; F549-Y553 HydrophobicContact CZ-CD2 3.95Å; F549-Y553 HydrophobicContact CZ-CG 4.35Å; F549-Y553 WeakPolarHBondContact O-CB 3.39Å; F549-Y553 PolarHBondContact O-N 2.94Å
550	Y	95.9	Very high	95	Very high	144 Å²	144	68.7 Å²	68.7	57%	0.565	36%	0.36	S	S	*	.	H	α-helix	trans	-60.2	-42.3	-171.1	-178.2	-99.7	0	0	0	115.1	L546 Y553 K554	L546-Y550 WeakPolarHBondContact O-CB 3.41Å; L546-Y550 PolarHBondContact O-N 2.95Å; Y550-Y553 PolarHBondContact O-N 3.2Å; Y550-K554 WeakPolarHBondContact O-CB 3.49Å; Y550-K554 PolarHBondContact O-N 3.05Å
551	P	95.7	Very high	94.6	Very high	62 Å²	62	72.7 Å²	72.7	40%	0.403	36%	0.363	S	S	.	.	H	α-helix	trans	-57.9	-52.3	174.7	-24.8	34.8	0	0	0	112.5	A547 L548 Y553 K554 D555	A547-P551 VanDerWaalsContact O-CD 3.23Å; A547-P551 WeakPolarHBondContact O-CD 3.39Å; L548-P551 WeakPolarHBondContact O-CD 3.32Å; P551-Y553 VanDerWaalsContact C-N 3.3Å; P551-Y553 PolarHBondContact O-N 3.46Å; P551-K554 WeakPolarHBondContact O-CB 3.4Å; P551-K554 PolarHBondContact O-N 2.81Å; P551-D555 PolarHBondContact O-N 3.1Å
552	D	92.3	Very high	94	Very high	93 Å²	93	77.4 Å²	77.4	50%	0.497	38%	0.382	S	S	.	.	H	α-helix	trans	-61.8	-39.6	179.7	-64.8	-15	0	0	0	111.7	F549 T556	F549-D552 PolarHBondContact O-N 3.02Å; D552-T556 WeakPolarHBondContact O-CB 3.05Å; D552-T556 PolarHBondContact O-N 2.94Å; D552-T556 PolarHBondContact O-OG1 2.63Å
553	Y	93.9	Very high	93.6	Very high	50 Å²	50	77.6 Å²	77.6	20%	0.196	38%	0.383	C	S	.	.	H	α-helix	trans	-58.4	-49.8	172.4	169.8	-90	0	0	0	111.1	F64 Y68 F549 Y550 P551 T556 M557	F64-Y553 HydrophobicContact CE2-CE2 4.29Å; F64-Y553 HydrophobicContact CZ-CD2 4.16Å; F64-Y553 AromaticContact CZ-CE2 3.88Å; F64-Y553 HydrophobicContact CZ-CE2 3.88Å; Y68-Y553 AromaticContact CD2-CD2 3.55Å; Y68-Y553 HydrophobicContact CD2-CD2 3.55Å; Y68-Y553 AromaticContact CD2-CE2 3.85Å; Y68-Y553 HydrophobicContact CD2-CE2 3.85Å; Y68-Y553 AromaticContact CE2-CD2 3.67Å; Y68-Y553 HydrophobicContact CE2-CD2 3.67Å; Y68-Y553 HydrophobicContact CE2-CE2 4.35Å; F549-Y553 AromaticContact CE1-CD2 3.93Å; F549-Y553 HydrophobicContact CE1-CD2 3.93Å; F549-Y553 HydrophobicContact CE1-CG 4.14Å; F549-Y553 AromaticContact CZ-CD2 3.95Å; F549-Y553 HydrophobicContact CZ-CD2 3.95Å; F549-Y553 HydrophobicContact CZ-CG 4.35Å; F549-Y553 WeakPolarHBondContact O-CB 3.39Å; F549-Y553 PolarHBondContact O-N 2.94Å; Y550-Y553 PolarHBondContact O-N 3.2Å; P551-Y553 VanDerWaalsContact C-N 3.3Å; P551-Y553 PolarHBondContact O-N 3.46Å; Y553-T556 PolarHBondContact O-N 2.88Å; Y553-M557 HydrophobicContact CD1-CG 4.32Å; Y553-M557 HydrophobicContact CD2-CE 4.19Å; Y553-M557 HydrophobicContact CD2-CG 4.25Å; Y553-M557 HydrophobicContact CE1-CG 3.97Å; Y553-M557 HydrophobicContact CE2-CE 3.8Å; Y553-M557 HydrophobicContact CE2-CG 3.9Å; Y553-M557 HydrophobicContact CE2-SD 4.35Å; Y553-M557 HydrophobicContact CG-CG 4.44Å; Y553-M557 WeakPolarHBondContact O-CB 3.49Å; Y553-M557 WeakPolarHBondContact O-CG 3.1Å; Y553-M557 PolarHBondContact O-N 3.19Å
554	K	95.8	Very high	93.3	Very high	87 Å²	87	81.9 Å²	81.9	38%	0.378	39%	0.39	S	S	.	.	H	α-helix	trans	-61.8	-48.9	-178.6	-175.7	-170.8	170.1	-164.1	0	110.7	Y550 P551 T556 M557 E558	Y550-K554 WeakPolarHBondContact O-CB 3.49Å; Y550-K554 PolarHBondContact O-N 3.05Å; P551-K554 WeakPolarHBondContact O-CB 3.4Å; P551-K554 PolarHBondContact O-N 2.81Å; K554-T556 VanDerWaalsContact C-N 3.34Å; K554-T556 PolarHBondContact O-N 3.15Å; K554-M557 PolarHBondContact O-N 2.95Å; K554-M557 VanDerWaalsContact O-N 3.08Å; K554-E558 WeakPolarHBondContact CE-OE1 3.32Å; K554-E558 WeakPolarHBondContact CE-OE2 3.32Å; K554-E558 HydrophobicContact CG-CG 4.41Å; K554-E558 IonicContact NZ-OE1 2.66Å; K554-E558 WeakPolarHBondContact O-CG 3.34Å; K554-E558 PolarHBondContact O-N 3.4Å
555	D	93.8	Very high	93.1	Very high	97 Å²	97	78 Å²	78	52%	0.519	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-43.1	-179.4	-67.9	-8.6	0	0	0	111.1	P551 M557 E558 E559	P551-D555 PolarHBondContact O-N 3.1Å; D555-M557 VanDerWaalsContact C-N 3.3Å; D555-M557 PolarHBondContact O-N 3.28Å; D555-E558 PolarHBondContact O-N 3.07Å; D555-E559 VanDerWaalsContact O-CB 3.23Å; D555-E559 WeakPolarHBondContact O-CB 3.3Å; D555-E559 PolarHBondContact O-N 3.17Å
556	T	91.3	Very high	93	Very high	32 Å²	32	80.8 Å²	80.8	20%	0.196	39%	0.394	C	S	.	.	H	α-helix	trans	-63.9	-34.9	175.6	-53.6	0	0	0	0	112.4	N75 D552 Y553 K554	N75-T556 PolarHBondContact ND2-O 2.89Å; D552-T556 WeakPolarHBondContact O-CB 3.05Å; D552-T556 PolarHBondContact O-N 2.94Å; D552-T556 PolarHBondContact O-OG1 2.63Å; Y553-T556 PolarHBondContact O-N 2.88Å; K554-T556 VanDerWaalsContact C-N 3.34Å; K554-T556 PolarHBondContact O-N 3.15Å
557	M	93	Very high	93	Very high	33 Å²	33	78.6 Å²	78.6	16%	0.163	38%	0.383	C	S	.	.	H	α-helix	trans	-80.2	-25.1	-178.9	-66.7	-67.1	150.5	0	0	112.7	Y68 M71 N75 Y553 K554 D555	Y68-M557 HydrophobicContact CD2-CE 3.33Å; Y68-M557 HydrophobicContact CE2-CE 3.61Å; Y68-M557 HydrophobicContact CG-CE 4.08Å; M71-M557 HydrophobicContact CB-CE 4.16Å; M71-M557 HydrophobicContact CB-SD 3.89Å; M71-M557 HydrophobicContact CG-CE 4.38Å; M71-M557 HydrophobicContact CG-SD 3.46Å; M71-M557 WeakPolarHBondContact CG-SD 3.38Å; N75-M557 WeakPolarHBondContact ND2-CA 3.5Å; N75-M557 PolarHBondContact ND2-O 3.2Å; Y553-M557 HydrophobicContact CD1-CG 4.32Å; Y553-M557 HydrophobicContact CD2-CE 4.19Å; Y553-M557 HydrophobicContact CD2-CG 4.25Å; Y553-M557 HydrophobicContact CE1-CG 3.97Å; Y553-M557 HydrophobicContact CE2-CE 3.8Å; Y553-M557 HydrophobicContact CE2-CG 3.9Å; Y553-M557 HydrophobicContact CE2-SD 4.35Å; Y553-M557 HydrophobicContact CG-CG 4.44Å; Y553-M557 WeakPolarHBondContact O-CB 3.49Å; Y553-M557 WeakPolarHBondContact O-CG 3.1Å; Y553-M557 PolarHBondContact O-N 3.19Å; K554-M557 PolarHBondContact O-N 2.95Å; K554-M557 VanDerWaalsContact O-N 3.08Å; D555-M557 VanDerWaalsContact C-N 3.3Å; D555-M557 PolarHBondContact O-N 3.28Å
558	E	93.2	Very high	92.9	Very high	122 Å²	122	76.1 Å²	76.1	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-88.4	-25.5	175.5	-71	-179.4	173.3	0	0	112.7	K554 D555 L560	K554-E558 WeakPolarHBondContact CE-OE1 3.32Å; K554-E558 WeakPolarHBondContact CE-OE2 3.32Å; K554-E558 HydrophobicContact CG-CG 4.41Å; K554-E558 IonicContact NZ-OE1 2.66Å; K554-E558 WeakPolarHBondContact O-CG 3.34Å; K554-E558 PolarHBondContact O-N 3.4Å; D555-E558 PolarHBondContact O-N 3.07Å; E558-L560 PolarHBondContact O-N 3.47Å; E558-L560 VanDerWaalsContact O-N 3.11Å
559	E	90	Very high	92.9	Very high	79 Å²	79	74.2 Å²	74.2	37%	0.369	35%	0.352	S	S	.	.			trans	-72.5	101.2	177.8	178.2	158.6	-128.3	0	0	111.8	N75 D555 R561	N75-E559 WeakPolarHBondContact CB-O 3.16Å; D555-E559 VanDerWaalsContact O-CB 3.23Å; D555-E559 WeakPolarHBondContact O-CB 3.3Å; D555-E559 PolarHBondContact O-N 3.17Å; E559-R561 VanDerWaalsContact CD-NH2 3.28Å; E559-R561 HydrophobicContact CG-CG 4.02Å; E559-R561 IonicContact OE1-CZ 3.58Å; E559-R561 IonicContact OE1-NE 2.67Å; E559-R561 PolarHBondContact OE1-NE 2.85Å; E559-R561 IonicContact OE1-NH2 3.97Å; E559-R561 PolarHBondContact OE1-NH2 3.16Å; E559-R561 IonicContact OE2-CZ 3.13Å; E559-R561 IonicContact OE2-NE 2.82Å; E559-R561 IonicContact OE2-NH2 3.54Å; E559-R561 PolarHBondContact OE2-NH2 3.09Å
560	L	90.9	Very high	92.9	Very high	133 Å²	133	77.2 Å²	77.2	70%	0.696	37%	0.369	S	S	*	.			trans	-98.6	122.8	173.7	-60.2	174.8	0	0	0	110.1	N75 E558	N75-L560 HydrophobicContact CB-CD2 4.18Å; N75-L560 WeakPolarHBondContact OD1-CD2 3.44Å; E558-L560 PolarHBondContact O-N 3.47Å; E558-L560 VanDerWaalsContact O-N 3.11Å
561	R	88.8	Confident	93	Very high	141 Å²	141	70.3 Å²	70.3	53%	0.532	34%	0.342	S	S	.	.			trans	-131.8	153.9	176.6	-62	-178.1	-178.7	-179.5	3.2	109.5	N75 L76 E559	N75-R561 PolarHBondContact O-N 3.27Å; L76-R561 CarbonylContact C-O 3.58Å; L76-R561 WeakPolarHBondContact O-CB 3.33Å; E559-R561 VanDerWaalsContact CD-NH2 3.28Å; E559-R561 HydrophobicContact CG-CG 4.02Å; E559-R561 IonicContact OE1-CZ 3.58Å; E559-R561 IonicContact OE1-NE 2.67Å; E559-R561 PolarHBondContact OE1-NE 2.85Å; E559-R561 IonicContact OE1-NH2 3.97Å; E559-R561 PolarHBondContact OE1-NH2 3.16Å; E559-R561 IonicContact OE2-CZ 3.13Å; E559-R561 IonicContact OE2-NE 2.82Å; E559-R561 IonicContact OE2-NH2 3.54Å; E559-R561 PolarHBondContact OE2-NH2 3.09Å
562	E	86	Confident	93.1	Very high	113 Å²	113	67.6 Å²	67.6	53%	0.528	32%	0.324	S	S	.	.			trans	-111.7	139.4	172.6	-175.5	175.4	179.9	0	0	109.2	W78 Y564	W78-E562 HydrophobicContact CB-CG 4.43Å; W78-E562 HydrophobicContact CE3-CB 4.1Å; W78-E562 HydrophobicContact CE3-CG 3.93Å; E562-Y564 PolarHBondContact O-N 3.01Å
563	F	89.2	Confident	93.3	Very high	24 Å²	24	67.2 Å²	67.2	11%	0.105	32%	0.316	C	S	.	.			trans	-65.8	118.4	171.2	178.2	-99.7	0	0	0	109.9	L77 L82 E86 I89 D565	L77-F563 HydrophobicContact CB-CB 4.28Å; L77-F563 HydrophobicContact CD2-CB 4.09Å; L77-F563 HydrophobicContact CD2-CD2 3.97Å; L77-F563 HydrophobicContact CD2-CG 4.45Å; L77-F563 WeakPolarHBondContact O-CB 3.39Å; L77-F563 PolarHBondContact O-N 2.89Å; L82-F563 HydrophobicContact CD1-CB 3.67Å; L82-F563 HydrophobicContact CD1-CD1 4.22Å; L82-F563 HydrophobicContact CD1-CG 4.23Å; L82-F563 HydrophobicContact CD2-CB 4.16Å; E86-F563 HydrophobicContact CB-CD1 4.4Å; I89-F563 HydrophobicContact CB-CE1 4.27Å; I89-F563 HydrophobicContact CB-CZ 4.29Å; I89-F563 HydrophobicContact CG2-CE1 4.05Å; I89-F563 HydrophobicContact CG2-CZ 3.7Å; F563-D565 HydrophobicContact CE1-CB 3.8Å; F563-D565 HydrophobicContact CE2-CB 4.28Å; F563-D565 HydrophobicContact CZ-CB 3.48Å; F563-D565 VanDerWaalsContact CZ-CB 3.48Å
564	Y	90.3	Very high	93.5	Very high	185 Å²	185	66.8 Å²	66.8	73%	0.725	31%	0.314	S	S	*	.			trans	-131.3	106.1	-177.3	-171.3	-101.9	0	0	0	111.3	E562 P566	E562-Y564 PolarHBondContact O-N 3.01Å; Y564-P566 HydrophobicContact CD1-CG 4.29Å; Y564-P566 HydrophobicContact CE1-CG 3.64Å; Y564-P566 HydrophobicContact CE2-CG 4.29Å
565	D	93.1	Very high	93.6	Very high	28 Å²	28	62.7 Å²	62.7	15%	0.15	30%	0.296	C	S	.	.			trans	-145.1	63.7	179.1	-161.9	-24.1	0	0	0	110.7	R92 F563 D567 T568 V569	R92-D565 IonicContact CZ-OD2 3.29Å; R92-D565 IonicContact NH2-OD2 3.52Å; R92-D565 PolarHBondContact NH2-OD2 3.15Å; F563-D565 HydrophobicContact CE1-CB 3.8Å; F563-D565 HydrophobicContact CE2-CB 4.28Å; F563-D565 HydrophobicContact CZ-CB 3.48Å; F563-D565 VanDerWaalsContact CZ-CB 3.48Å; D565-D567 VanDerWaalsContact C-N 3.28Å; D565-D567 PolarHBondContact O-N 3.37Å; D565-T568 PolarHBondContact O-N 2.61Å; D565-T568 WeakPolarHBondContact OD1-CB 3.22Å; D565-T568 PolarHBondContact OD1-N 2.61Å; D565-T568 PolarHBondContact OD1-OG1 3.46Å; D565-T568 PolarHBondContact OD2-OG1 2.93Å; D565-V569 VanDerWaalsContact O-CG2 3.3Å; D565-V569 WeakPolarHBondContact O-CG2 3.46Å; D565-V569 PolarHBondContact O-N 3.43Å
566	P	94.6	Very high	93.7	Very high	58 Å²	58	59.3 Å²	59.3	38%	0.377	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-32.8	-171.5	27.2	-37.4	0	0	0	112.8	Y564 V569 D570	Y564-P566 HydrophobicContact CD1-CG 4.29Å; Y564-P566 HydrophobicContact CE1-CG 3.64Å; Y564-P566 HydrophobicContact CE2-CG 4.29Å; P566-V569 PolarHBondContact O-N 3.05Å; P566-D570 VanDerWaalsContact O-CB 3.31Å; P566-D570 WeakPolarHBondContact O-CB 3.15Å; P566-D570 PolarHBondContact O-N 3.34Å
567	D	96	Very high	93.9	Very high	32 Å²	32	64.2 Å²	64.2	17%	0.171	31%	0.309	C	S	.	.	H	α-helix	trans	-66.5	-39.4	178.9	-74.3	-11.9	0	0	0	111.5	D565 L571 N714 K715 T716 F717	D565-D567 VanDerWaalsContact C-N 3.28Å; D565-D567 PolarHBondContact O-N 3.37Å; D567-L571 WeakPolarHBondContact O-CB 3.27Å; D567-L571 PolarHBondContact O-N 2.91Å; D567-N714 WeakPolarHBondContact CA-ND2 3.27Å; D567-N714 PolarHBondContact O-ND2 3.09Å; D567-K715 WeakPolarHBondContact OD2-CB 3.5Å; D567-T716 WeakPolarHBondContact OD2-CB 3.48Å; D567-T716 PolarHBondContact OD2-N 3.5Å; D567-T716 PolarHBondContact OD2-OG1 3.19Å; D567-F717 HydrophobicContact CB-CD2 4.18Å; D567-F717 HydrophobicContact CB-CE2 4.03Å
568	T	95.9	Very high	94.1	Very high	11 Å²	11	66 Å²	66	7%	0.067	33%	0.325	C	S	.	.	H	α-helix	trans	-72.8	-38.8	177	-53.2	0	0	0	0	110.4	I89 D565 D570 L571 M572 L591 F717	I89-T568 HydrophobicContact CD1-CG2 4.14Å; I89-T568 HydrophobicContact CG1-CG2 4.17Å; I89-T568 HydrophobicContact CG2-CG2 3.6Å; D565-T568 PolarHBondContact O-N 2.61Å; D565-T568 WeakPolarHBondContact OD1-CB 3.22Å; D565-T568 PolarHBondContact OD1-N 2.61Å; D565-T568 PolarHBondContact OD1-OG1 3.46Å; D565-T568 PolarHBondContact OD2-OG1 2.93Å; T568-D570 PolarHBondContact O-N 2.86Å; T568-L571 PolarHBondContact O-N 3.33Å; T568-M572 HydrophobicContact CG2-CE 3.76Å; T568-M572 HydrophobicContact CG2-CG 4.31Å; T568-M572 VanDerWaalsContact O-CG 3.26Å; T568-M572 WeakPolarHBondContact O-CG 3.37Å; T568-M572 PolarHBondContact O-N 2.9Å; T568-L591 HydrophobicContact CG2-CD1 4.46Å; T568-F717 WeakPolarHBondContact OG1-CE2 3.12Å; T568-F717 WeakPolarHBondContact OG1-CZ 3.25Å
569	V	95.4	Very high	94.3	Very high	19 Å²	19	60.8 Å²	60.8	12%	0.115	30%	0.301	C	S	.	.	H	α-helix	trans	-58	-49.3	174.6	172.5	0	0	0	0	111	E86 I89 D565 P566 L571 M572 Y573	E86-V569 HydrophobicContact CG-CG2 3.85Å; I89-V569 HydrophobicContact CD1-CB 4.18Å; I89-V569 HydrophobicContact CD1-CG2 3.55Å; D565-V569 VanDerWaalsContact O-CG2 3.3Å; D565-V569 WeakPolarHBondContact O-CG2 3.46Å; D565-V569 PolarHBondContact O-N 3.43Å; P566-V569 PolarHBondContact O-N 3.05Å; V569-L571 PolarHBondContact O-N 3.49Å; V569-M572 PolarHBondContact O-N 2.92Å; V569-Y573 HydrophobicContact CG1-CD2 3.57Å; V569-Y573 HydrophobicContact CG1-CE2 3.36Å; V569-Y573 VanDerWaalsContact O-CD2 3.22Å; V569-Y573 WeakPolarHBondContact O-CD2 3.16Å; V569-Y573 PolarHBondContact O-N 3.49Å
570	D	96.4	Very high	94.6	Very high	78 Å²	78	60 Å²	60	42%	0.417	31%	0.308	S	S	.	.	H	α-helix	trans	-60.5	-44.6	177.3	-174.6	31.8	0	0	0	111.7	P566 T568 M572 Y573 W574 F712	P566-D570 VanDerWaalsContact O-CB 3.31Å; P566-D570 WeakPolarHBondContact O-CB 3.15Å; P566-D570 PolarHBondContact O-N 3.34Å; T568-D570 PolarHBondContact O-N 2.86Å; D570-M572 PolarHBondContact O-N 3.47Å; D570-Y573 PolarHBondContact O-N 2.88Å; D570-W574 WeakPolarHBondContact O-CB 3.22Å; D570-W574 PolarHBondContact O-N 3.43Å; D570-F712 HydrophobicContact CB-CZ 4.32Å; D570-F712 WeakPolarHBondContact OD2-CZ 3.45Å
571	L	97.5	Very high	94.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.7	-48.6	174.2	175.8	67.1	0	0	0	111.9	D567 T568 V569 W574 I575 L591 I646 F712 F717 V719	D567-L571 WeakPolarHBondContact O-CB 3.27Å; D567-L571 PolarHBondContact O-N 2.91Å; T568-L571 PolarHBondContact O-N 3.33Å; V569-L571 PolarHBondContact O-N 3.49Å; L571-W574 PolarHBondContact O-N 3.25Å; L571-I575 HydrophobicContact CD1-CD1 3.95Å; L571-I575 HydrophobicContact CD1-CG1 4.22Å; L571-I575 HydrophobicContact CG-CD1 3.97Å; L571-I575 VanDerWaalsContact O-CG1 3.31Å; L571-I575 WeakPolarHBondContact O-CG1 3.5Å; L571-I575 PolarHBondContact O-N 3.27Å; L571-L591 HydrophobicContact CD2-CD1 4.23Å; L571-L591 HydrophobicContact CD2-CD2 4.11Å; L571-I646 HydrophobicContact CD2-CG2 4.35Å; L571-F712 HydrophobicContact CB-CE1 4.11Å; L571-F712 HydrophobicContact CB-CZ 4.36Å; L571-F712 HydrophobicContact CD1-CD1 3.88Å; L571-F712 HydrophobicContact CD1-CE1 3.85Å; L571-F717 HydrophobicContact CB-CD2 4.13Å; L571-F717 HydrophobicContact CD1-CB 4.43Å; L571-F717 HydrophobicContact CD2-CB 4.12Å; L571-F717 HydrophobicContact CD2-CD1 3.93Å; L571-F717 HydrophobicContact CD2-CD2 3.84Å; L571-F717 HydrophobicContact CD2-CE1 4.3Å; L571-F717 HydrophobicContact CD2-CE2 4.23Å; L571-F717 HydrophobicContact CD2-CG 3.68Å; L571-F717 HydrophobicContact CD2-CZ 4.44Å; L571-V719 HydrophobicContact CD1-CG2 3.51Å
572	M	97.1	Very high	95.1	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.025	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-40.4	-177.5	-64.5	-54.6	164.9	0	0	111.9	V85 I89 T568 V569 D570 I575 G576 L591 V595 C598 T599	V85-M572 HydrophobicContact CG1-CB 4.27Å; I89-M572 HydrophobicContact CD1-CB 4.44Å; I89-M572 HydrophobicContact CD1-CG 3.99Å; I89-M572 HydrophobicContact CG1-CG 4.11Å; T568-M572 HydrophobicContact CG2-CE 3.76Å; T568-M572 HydrophobicContact CG2-CG 4.31Å; T568-M572 VanDerWaalsContact O-CG 3.26Å; T568-M572 WeakPolarHBondContact O-CG 3.37Å; T568-M572 PolarHBondContact O-N 2.9Å; V569-M572 PolarHBondContact O-N 2.92Å; D570-M572 PolarHBondContact O-N 3.47Å; M572-I575 PolarHBondContact O-N 3.49Å; M572-G576 PolarHBondContact O-N 2.91Å; M572-L591 HydrophobicContact CE-CD1 3.88Å; M572-V595 HydrophobicContact CE-CG2 3.9Å; M572-V595 HydrophobicContact SD-CB 4.47Å; M572-V595 HydrophobicContact SD-CG2 4.08Å; M572-C598 HydrophobicContact CB-CB 4.09Å; M572-C598 HydrophobicContact CG-CB 3.93Å; M572-C598 HydrophobicContact SD-CB 4.01Å; M572-T599 HydrophobicContact CB-CG2 4.31Å; M572-T599 WeakPolarHBondContact O-CG2 3.35Å; M572-T599 HydrophobicContact SD-CG2 4.18Å
573	Y	96.5	Very high	95.6	Very high	85 Å²	85	52.2 Å²	52.2	33%	0.333	28%	0.282	S	S	.	.	H	α-helix	trans	-63.7	-43.3	173.4	-80.7	-58.6	0	0	0	111.8	V85 V569 D570 G576 N577	V85-Y573 HydrophobicContact CG2-CE1 4.22Å; V569-Y573 HydrophobicContact CG1-CD2 3.57Å; V569-Y573 HydrophobicContact CG1-CE2 3.36Å; V569-Y573 VanDerWaalsContact O-CD2 3.22Å; V569-Y573 WeakPolarHBondContact O-CD2 3.16Å; V569-Y573 PolarHBondContact O-N 3.49Å; D570-Y573 PolarHBondContact O-N 2.88Å; Y573-G576 PolarHBondContact O-N 3.32Å; Y573-N577 VanDerWaalsContact O-CB 3.3Å; Y573-N577 WeakPolarHBondContact O-CB 3.3Å; Y573-N577 PolarHBondContact O-N 3.04Å; Y573-N577 PolarHBondContact O-ND2 3.5Å
574	W	97.7	Very high	96	Very high	41 Å²	41	51.1 Å²	51.1	16%	0.155	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-46.8	177.1	177.6	84.4	0	0	0	111.5	D570 L571 G576 N577 S578 T579 Y644 M711 F712 V719	D570-W574 WeakPolarHBondContact O-CB 3.22Å; D570-W574 PolarHBondContact O-N 3.43Å; L571-W574 PolarHBondContact O-N 3.25Å; W574-G576 PolarHBondContact O-N 2.97Å; W574-N577 PolarHBondContact O-N 3.39Å; W574-S578 WeakPolarHBondContact O-CA 3.49Å; W574-S578 WeakPolarHBondContact O-CB 3.36Å; W574-S578 PolarHBondContact O-N 3.3Å; W574-S578 PolarHBondContact O-OG 3.45Å; W574-S578 VanDerWaalsContact O-OG 3.05Å; W574-T579 HydrophobicContact CH2-CG2 3.96Å; W574-T579 HydrophobicContact CZ3-CG2 4.04Å; W574-Y644 HydrophobicContact CH2-CD1 4.43Å; W574-Y644 HydrophobicContact CH2-CE1 4.34Å; W574-M711 HydrophobicContact CH2-CB 3.82Å; W574-M711 HydrophobicContact CZ2-CB 3.66Å; W574-F712 HydrophobicContact CB-CD2 3.71Å; W574-F712 HydrophobicContact CB-CE2 3.76Å; W574-F712 HydrophobicContact CB-CG 4.5Å; W574-F712 AromaticContact CD1-CD2 3.62Å; W574-F712 HydrophobicContact CD2-CB 3.64Å; W574-F712 AromaticContact CD2-CD2 3.73Å; W574-F712 HydrophobicContact CD2-CD2 3.73Å; W574-F712 AromaticContact CD2-CG 3.87Å; W574-F712 HydrophobicContact CD2-CG 3.87Å; W574-F712 HydrophobicContact CE3-CB 3.83Å; W574-F712 HydrophobicContact CE3-CD2 4.36Å; W574-F712 HydrophobicContact CE3-CG 4.1Å; W574-F712 HydrophobicContact CG-CB 4.22Å; W574-F712 AromaticContact CG-CD2 3.37Å; W574-F712 HydrophobicContact CG-CD2 3.37Å; W574-F712 AromaticContact CG-CE2 3.95Å; W574-F712 HydrophobicContact CG-CE2 3.95Å; W574-F712 HydrophobicContact CG-CG 4.01Å; W574-F712 HydrophobicContact CH2-CB 4.13Å; W574-F712 HydrophobicContact CZ2-CB 3.94Å; W574-F712 HydrophobicContact CZ3-CB 4.08Å; W574-V719 HydrophobicContact CE3-CG2 4.4Å; W574-V719 HydrophobicContact CH2-CB 4.23Å; W574-V719 HydrophobicContact CH2-CG1 3.97Å; W574-V719 HydrophobicContact CZ3-CB 3.97Å; W574-V719 HydrophobicContact CZ3-CG1 3.78Å; W574-V719 HydrophobicContact CZ3-CG2 3.98Å
575	I	97.9	Very high	96.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.9	-49.5	176	-70	173.7	0	0	0	110.3	L571 M572 N577 T579 F585 V595 T599 R601 I646	L571-I575 HydrophobicContact CD1-CD1 3.95Å; L571-I575 HydrophobicContact CD1-CG1 4.22Å; L571-I575 HydrophobicContact CG-CD1 3.97Å; L571-I575 VanDerWaalsContact O-CG1 3.31Å; L571-I575 WeakPolarHBondContact O-CG1 3.5Å; L571-I575 PolarHBondContact O-N 3.27Å; M572-I575 PolarHBondContact O-N 3.49Å; I575-N577 PolarHBondContact O-N 3.05Å; I575-T579 PolarHBondContact O-N 3.23Å; I575-T579 PolarHBondContact O-OG1 2.8Å; I575-F585 HydrophobicContact CB-CZ 4.26Å; I575-F585 HydrophobicContact CD1-CD1 4.29Å; I575-F585 HydrophobicContact CD1-CE1 3.85Å; I575-F585 HydrophobicContact CD1-CZ 4.19Å; I575-F585 HydrophobicContact CG1-CE1 3.81Å; I575-F585 HydrophobicContact CG1-CZ 3.85Å; I575-F585 HydrophobicContact CG2-CE1 4.33Å; I575-F585 HydrophobicContact CG2-CE2 3.82Å; I575-F585 HydrophobicContact CG2-CZ 3.59Å; I575-V595 HydrophobicContact CD1-CG1 4.11Å; I575-V595 HydrophobicContact CD1-CG2 3.99Å; I575-V595 HydrophobicContact CG2-CG1 4.41Å; I575-T599 HydrophobicContact CB-CG2 4.05Å; I575-T599 HydrophobicContact CG2-CG2 3.76Å; I575-R601 HydrophobicContact CG2-CB 4.44Å; I575-R601 HydrophobicContact CG2-CG 3.66Å; I575-I646 HydrophobicContact CD1-CD1 4.01Å
576	G	96.2	Very high	96.5	Very high	26 Å²	26	41 Å²	41	27%	0.268	24%	0.236	S	C	.	.	H	α-helix	trans	-61.5	-40.5	-177.5	0	0	0	0	0	113.6	M572 Y573 W574 R601	M572-G576 PolarHBondContact O-N 2.91Å; Y573-G576 PolarHBondContact O-N 3.32Å; W574-G576 PolarHBondContact O-N 2.97Å; G576-R601 PolarHBondContact O-NH2 3.17Å
577	N	96.7	Very high	96.6	Very high	135 Å²	135	38.2 Å²	38.2	72%	0.722	22%	0.218	S	C	*	.	H	α-helix	trans	-93.4	-28.2	-172.9	-66.9	-17.4	0	0	0	114.2	Y573 W574 I575	Y573-N577 VanDerWaalsContact O-CB 3.3Å; Y573-N577 WeakPolarHBondContact O-CB 3.3Å; Y573-N577 PolarHBondContact O-N 3.04Å; Y573-N577 PolarHBondContact O-ND2 3.5Å; W574-N577 PolarHBondContact O-N 3.39Å; I575-N577 PolarHBondContact O-N 3.05Å
578	S	96.8	Very high	96.5	Very high	72 Å²	72	36.9 Å²	36.9	50%	0.503	21%	0.211	S	C	.	.	H	α-helix	trans	-109	-8	-168.2	-44.2	0	0	0	0	114.2	W574	W574-S578 WeakPolarHBondContact O-CA 3.49Å; W574-S578 WeakPolarHBondContact O-CB 3.36Å; W574-S578 PolarHBondContact O-N 3.3Å; W574-S578 PolarHBondContact O-OG 3.45Å; W574-S578 VanDerWaalsContact O-OG 3.05Å
579	T	97.2	Very high	96.4	Very high	11 Å²	11	37.9 Å²	37.9	7%	0.067	22%	0.216	C	C	.	.	S	Bend	trans	-117.6	150.7	-177.3	73.7	0	0	0	0	112.4	W574 I575 F585 R601 Y644	W574-T579 HydrophobicContact CH2-CG2 3.96Å; W574-T579 HydrophobicContact CZ3-CG2 4.04Å; I575-T579 PolarHBondContact O-N 3.23Å; I575-T579 PolarHBondContact O-OG1 2.8Å; T579-F585 HydrophobicContact CG2-CZ 3.97Å; T579-R601 PolarHBondContact O-NH2 2.81Å; T579-R601 PolarHBondContact OG1-NE 2.83Å; T579-R601 VanDerWaalsContact OG1-NE 3.15Å; T579-Y644 HydrophobicContact CG2-CE2 4.02Å
580	A	96.7	Very high	96.2	Very high	62 Å²	62	42.3 Å²	42.3	51%	0.512	24%	0.235	S	C	.	.			trans	-61.2	147.7	177.8	0	0	0	0	0	111.7	H582 A583 R601	A580-H582 PolarHBondContact O-N 2.83Å; A580-H582 VanDerWaalsContact O-N 3.1Å; A580-A583 WeakPolarHBondContact O-CB 3.13Å; A580-A583 PolarHBondContact O-N 3.25Å; A580-R601 WeakPolarHBondContact O-CD 3.46Å; A580-R601 PolarHBondContact O-NE 2.66Å
581	P	94.5	Very high	96.2	Very high	84 Å²	84	39.4 Å²	39.4	55%	0.545	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31	-179.1	-28.7	36	0	0	0	115.1	R601	P581-R601 WeakPolarHBondContact O-CD 3.31Å
582	H	94.9	Very high	96.1	Very high	137 Å²	137	39.4 Å²	39.4	63%	0.634	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	9.2	180	-53.8	-55.5	0	0	0	113.5	A580 S584 H602	A580-H582 PolarHBondContact O-N 2.83Å; A580-H582 VanDerWaalsContact O-N 3.1Å; H582-S584 PolarHBondContact O-N 2.88Å; H582-H602 AromaticContact ND1-CE1 3.94Å; H582-H602 AromaticContact ND1-NE2 3.67Å
583	A	96.5	Very high	96	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.033	22%	0.218	C	C	.	.			trans	-62.6	134.9	175.1	0	0	0	0	0	110.2	A580 F585 H602 Y644	A580-A583 WeakPolarHBondContact O-CB 3.13Å; A580-A583 PolarHBondContact O-N 3.25Å; A583-F585 HydrophobicContact CB-CE2 4.08Å; A583-H602 PolarHBondContact O-N 3.14Å; A583-Y644 HydrophobicContact CB-CD2 4.03Å; A583-Y644 HydrophobicContact CB-CE2 3.78Å
584	S	97.1	Very high	95.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	141.1	-179.4	64	0	0	0	0	111.8	H126 H582 H602 D641 T642 H643 Y644	H126-S584 WeakPolarHBondContact CD2-CB 3.27Å; H582-S584 PolarHBondContact O-N 2.88Å; S584-H602 CarbonylContact C-O 3.58Å; S584-H602 VanDerWaalsContact CA-O 3.27Å; S584-H602 WeakPolarHBondContact CA-O 3.38Å; S584-D641 PolarHBondContact OG-O 3.42Å; S584-T642 VanDerWaalsContact OG-CA 3.31Å; S584-T642 WeakPolarHBondContact OG-CA 3.26Å; S584-H643 PolarHBondContact N-ND1 3.22Å; S584-H643 PolarHBondContact O-N 3.31Å; S584-H643 VanDerWaalsContact O-N 3.1Å; S584-H643 PolarHBondContact OG-N 2.94Å; S584-H643 PolarHBondContact OG-ND1 2.78Å; S584-Y644 PolarHBondContact O-N 3.09Å
585	F	98.2	Very high	95.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.2	-176.2	-70.9	-98.4	0	0	0	111.6	I575 T579 A583 L592 V595 R601 H602 T604 Y644 I646 V719	I575-F585 HydrophobicContact CB-CZ 4.26Å; I575-F585 HydrophobicContact CD1-CD1 4.29Å; I575-F585 HydrophobicContact CD1-CE1 3.85Å; I575-F585 HydrophobicContact CD1-CZ 4.19Å; I575-F585 HydrophobicContact CG1-CE1 3.81Å; I575-F585 HydrophobicContact CG1-CZ 3.85Å; I575-F585 HydrophobicContact CG2-CE1 4.33Å; I575-F585 HydrophobicContact CG2-CE2 3.82Å; I575-F585 HydrophobicContact CG2-CZ 3.59Å; T579-F585 HydrophobicContact CG2-CZ 3.97Å; A583-F585 HydrophobicContact CB-CE2 4.08Å; F585-L592 HydrophobicContact CB-CD2 3.75Å; F585-V595 HydrophobicContact CD2-CG1 4.3Å; F585-V595 HydrophobicContact CG-CG1 4.33Å; F585-R601 HydrophobicContact CD2-CB 3.89Å; F585-R601 HydrophobicContact CD2-CG 4.48Å; F585-R601 HydrophobicContact CE2-CB 3.86Å; F585-R601 HydrophobicContact CE2-CG 3.94Å; F585-H602 PolarHBondContact N-O 3.22Å; F585-T604 PolarHBondContact O-N 2.63Å; F585-T604 VanDerWaalsContact O-N 3.09Å; F585-T604 PolarHBondContact O-OG1 2.94Å; F585-T604 VanDerWaalsContact O-OG1 3.12Å; F585-Y644 WeakPolarHBondContact CA-O 3.44Å; F585-Y644 HydrophobicContact CD1-CG 4.43Å; F585-Y644 VanDerWaalsContact CE1-CB 3.47Å; F585-Y644 HydrophobicContact CE1-CD2 4.1Å; F585-Y644 AromaticContact CE1-CG 3.9Å; F585-Y644 HydrophobicContact CE1-CG 3.9Å; F585-Y644 HydrophobicContact CE2-CD2 4.22Å; F585-Y644 AromaticContact CZ-CD2 3.84Å; F585-Y644 HydrophobicContact CZ-CD2 3.84Å; F585-Y644 HydrophobicContact CZ-CG 4.1Å; F585-I646 HydrophobicContact CD1-CD1 3.74Å; F585-I646 HydrophobicContact CD1-CG1 3.84Å; F585-I646 HydrophobicContact CE1-CD1 4.43Å; F585-I646 HydrophobicContact CG-CD1 4.49Å; F585-V719 HydrophobicContact CE1-CG1 4.35Å
586	A	97.7	Very high	95.8	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151	167	0	0	0	0	0	110.4	T604 I621 L637 T642 Y644 L645 I646	A586-T604 WeakPolarHBondContact CA-OG1 3.45Å; A586-T604 HydrophobicContact CB-CG2 4.49Å; A586-T604 WeakPolarHBondContact CB-OG1 3.36Å; A586-I621 HydrophobicContact CB-CG2 4.14Å; A586-L637 HydrophobicContact CB-CD2 3.76Å; A586-T642 HydrophobicContact CB-CG2 3.56Å; A586-Y644 PolarHBondContact N-O 2.9Å; A586-L645 HydrophobicContact CB-CD1 4.43Å; A586-I646 PolarHBondContact O-N 3.43Å
587	G	96	Very high	95.8	Very high	1 Å²	1	33 Å²	33	1%	0.01	19%	0.19	C	C	.	.	S	Bend	trans	165.4	-161.4	-175.2	0	0	0	0	0	111.6	N605	G587-N605 PolarHBondContact O-ND2 3.27Å; G587-N605 PolarHBondContact O-OD1 2.85Å
588	S	94.4	Very high	95.7	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.028	16%	0.162	C	C	.	.			trans	-65.4	142.1	174.3	84.4	0	0	0	0	110.7	Q590 L591 L592 E648	S588-Q590 PolarHBondContact O-N 3.07Å; S588-Q590 VanDerWaalsContact O-N 3.17Å; S588-L591 PolarHBondContact O-N 3.38Å; S588-L591 WeakPolarHBondContact OG-CB 3.38Å; S588-L591 PolarHBondContact OG-N 2.97Å; S588-L592 WeakPolarHBondContact O-CG 3.33Å; S588-L592 PolarHBondContact O-N 2.88Å; S588-L592 VanDerWaalsContact O-N 3.07Å; S588-E648 WeakPolarHBondContact CB-OE1 3.47Å; S588-E648 PolarHBondContact OG-OE1 3.05Å
589	M	92.6	Very high	95.7	Very high	32 Å²	32	24.9 Å²	24.9	16%	0.158	14%	0.143	C	C	.	.	H	α-helix	trans	-56.7	-34.2	178.3	68.4	-168.1	172.9	0	0	112.3	A593 P607 Y622	M589-A593 PolarHBondContact O-N 3.4Å; M589-P607 HydrophobicContact CB-CG 4.35Å; M589-P607 HydrophobicContact CG-CB 4.42Å; M589-P607 HydrophobicContact CG-CG 4.34Å; M589-P607 WeakPolarHBondContact O-CD 3.48Å; M589-P607 VanDerWaalsContact O-CG 3.22Å; M589-P607 WeakPolarHBondContact O-CG 3.24Å; M589-Y622 WeakPolarHBondContact CB-OH 3.34Å; M589-Y622 WeakPolarHBondContact CG-OH 3.39Å; M589-Y622 PolarHBondContact N-OH 3.41Å; M589-Y622 PolarHBondContact SD-OH 2.92Å
590	Q	91.8	Very high	95.6	Very high	112 Å²	112	26.5 Å²	26.5	52%	0.523	16%	0.161	S	C	.	.	H	α-helix	trans	-68	-45.2	-176.8	-65.2	-172.6	-6.2	0	0	111.8	T93 S588	T93-Q590 HydrophobicContact CG2-CB 3.81Å; T93-Q590 HydrophobicContact CG2-CG 3.66Å; S588-Q590 PolarHBondContact O-N 3.07Å; S588-Q590 VanDerWaalsContact O-N 3.17Å
591	L	95.1	Very high	95.6	Very high	16 Å²	16	24.9 Å²	24.9	8%	0.084	14%	0.142	C	C	.	.	H	α-helix	trans	-72.3	-41.5	179.6	-178.6	62.6	0	0	0	111.9	T568 L571 M572 S588 A593 G594 V595 I646 E648 F717	T568-L591 HydrophobicContact CG2-CD1 4.46Å; L571-L591 HydrophobicContact CD2-CD1 4.23Å; L571-L591 HydrophobicContact CD2-CD2 4.11Å; M572-L591 HydrophobicContact CE-CD1 3.88Å; S588-L591 PolarHBondContact O-N 3.38Å; S588-L591 WeakPolarHBondContact OG-CB 3.38Å; S588-L591 PolarHBondContact OG-N 2.97Å; L591-A593 VanDerWaalsContact C-N 3.26Å; L591-A593 PolarHBondContact O-N 3.2Å; L591-G594 CarbonylContact O-C 3.59Å; L591-G594 VanDerWaalsContact O-CA 3.31Å; L591-G594 WeakPolarHBondContact O-CA 3.31Å; L591-G594 PolarHBondContact O-N 3.42Å; L591-V595 HydrophobicContact CG-CG2 4.44Å; L591-V595 PolarHBondContact O-N 3.14Å; L591-I646 HydrophobicContact CD2-CB 4.28Å; L591-I646 HydrophobicContact CD2-CD1 4.26Å; L591-I646 HydrophobicContact CD2-CG2 3.57Å; L591-E648 HydrophobicContact CD2-CG 4.05Å; L591-F717 HydrophobicContact CD1-CE1 3.94Å; L591-F717 HydrophobicContact CD1-CZ 4.17Å; L591-F717 HydrophobicContact CD2-CD1 3.81Å; L591-F717 HydrophobicContact CD2-CE1 3.64Å; L591-F717 HydrophobicContact CG-CE1 4.43Å
592	L	96.7	Very high	95.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.8	-31.8	-177.7	-71.5	-177.8	0	0	0	113.2	F585 S588 G594 V595 K596 I603 N605 I646	F585-L592 HydrophobicContact CB-CD2 3.75Å; S588-L592 WeakPolarHBondContact O-CG 3.33Å; S588-L592 PolarHBondContact O-N 2.88Å; S588-L592 VanDerWaalsContact O-N 3.07Å; L592-G594 PolarHBondContact O-N 2.56Å; L592-V595 HydrophobicContact CD2-CG2 4.32Å; L592-V595 PolarHBondContact O-N 3.23Å; L592-K596 PolarHBondContact O-N 2.92Å; L592-I603 HydrophobicContact CB-CB 4.17Å; L592-I603 HydrophobicContact CB-CD1 4.29Å; L592-I603 HydrophobicContact CB-CG2 4.08Å; L592-I603 HydrophobicContact CD1-CB 4.39Å; L592-I603 HydrophobicContact CD2-CB 4.5Å; L592-I603 HydrophobicContact CD2-CG2 4.1Å; L592-N605 WeakPolarHBondContact CB-O 3.37Å; L592-N605 VanDerWaalsContact CD1-O 3.27Å; L592-N605 WeakPolarHBondContact CD1-O 3.19Å; L592-N605 WeakPolarHBondContact CD1-OD1 3.26Å; L592-I646 HydrophobicContact CD2-CD1 4.44Å
593	A	95	Very high	95.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.8	-39.2	170.2	0	0	0	0	0	112.1	T93 L97 M589 L591 C597 P607	T93-A593 WeakPolarHBondContact O-CB 3.21Å; L97-A593 HydrophobicContact CB-CB 4.05Å; M589-A593 PolarHBondContact O-N 3.4Å; L591-A593 VanDerWaalsContact C-N 3.26Å; L591-A593 PolarHBondContact O-N 3.2Å; A593-C597 VanDerWaalsContact O-CB 3.28Å; A593-C597 WeakPolarHBondContact O-CB 3.4Å; A593-C597 PolarHBondContact O-N 3.39Å; A593-C597 VanDerWaalsContact O-N 3.09Å; A593-P607 HydrophobicContact CB-CG 4.09Å
594	G	95.2	Very high	95.7	Very high	10 Å²	10	15 Å²	15	10%	0.103	9%	0.088	C	C	.	.	H	α-helix	trans	-66.9	-43.2	172.5	0	0	0	0	0	112.5	L591 L592 K596 C597 C598	L591-G594 CarbonylContact O-C 3.59Å; L591-G594 VanDerWaalsContact O-CA 3.31Å; L591-G594 WeakPolarHBondContact O-CA 3.31Å; L591-G594 PolarHBondContact O-N 3.42Å; L592-G594 PolarHBondContact O-N 2.56Å; G594-K596 PolarHBondContact O-N 3.34Å; G594-C597 WeakPolarHBondContact O-CB 3.32Å; G594-C597 PolarHBondContact O-N 2.88Å; G594-C598 WeakPolarHBondContact O-CB 3.3Å; G594-C598 PolarHBondContact O-N 2.78Å; G594-C598 PolarHBondContact O-SG 2.67Å
595	V	96.9	Very high	95.6	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-56.2	-50.5	176.3	175.2	0	0	0	0	110.7	M572 I575 F585 L591 L592 C597 T599 R601 I603 I646	M572-V595 HydrophobicContact CE-CG2 3.9Å; M572-V595 HydrophobicContact SD-CB 4.47Å; M572-V595 HydrophobicContact SD-CG2 4.08Å; I575-V595 HydrophobicContact CD1-CG1 4.11Å; I575-V595 HydrophobicContact CD1-CG2 3.99Å; I575-V595 HydrophobicContact CG2-CG1 4.41Å; F585-V595 HydrophobicContact CD2-CG1 4.3Å; F585-V595 HydrophobicContact CG-CG1 4.33Å; L591-V595 HydrophobicContact CG-CG2 4.44Å; L591-V595 PolarHBondContact O-N 3.14Å; L592-V595 HydrophobicContact CD2-CG2 4.32Å; L592-V595 PolarHBondContact O-N 3.23Å; V595-C597 PolarHBondContact O-N 3.02Å; V595-T599 WeakPolarHBondContact O-CB 3.33Å; V595-T599 PolarHBondContact O-N 3.26Å; V595-T599 PolarHBondContact O-OG1 2.96Å; V595-R601 HydrophobicContact CG1-CB 4.26Å; V595-I603 HydrophobicContact CB-CG2 4.36Å; V595-I603 HydrophobicContact CG1-CG2 4.28Å; V595-I646 HydrophobicContact CG2-CD1 3.87Å
596	K	95.9	Very high	95.4	Very high	9 Å²	9	15 Å²	15	4%	0.039	9%	0.088	C	C	.	.	H	α-helix	trans	-60.8	-45.3	177	175.5	166.8	-176.9	-91	0	112.1	L97 S100 V123 T124 L592 G594 G600 I603	L97-K596 HydrophobicContact CD1-CD 4.01Å; S100-K596 PolarHBondContact OG-NZ 2.86Å; V123-K596 HydrophobicContact CG1-CD 4.36Å; T124-K596 WeakPolarHBondContact OG1-CE 3.28Å; T124-K596 PolarHBondContact OG1-NZ 2.92Å; L592-K596 PolarHBondContact O-N 2.92Å; G594-K596 PolarHBondContact O-N 3.34Å; K596-G600 VanDerWaalsContact O-CA 3.32Å; K596-G600 WeakPolarHBondContact O-CA 3.09Å; K596-G600 PolarHBondContact O-N 3.38Å; K596-I603 HydrophobicContact CB-CD1 3.83Å; K596-I603 HydrophobicContact CB-CG1 4.31Å; K596-I603 HydrophobicContact CB-CG2 4.13Å; K596-I603 HydrophobicContact CD-CD1 3.94Å; K596-I603 HydrophobicContact CD-CG1 4.24Å
597	C	95.7	Very high	94.9	Very high	3 Å²	3	16 Å²	16	2%	0.02	9%	0.094	C	C	.	.	H	α-helix	trans	-59.7	-50.4	-179.8	-173.4	0	0	0	0	112.6	G96 A593 G594 V595	G96-C597 WeakPolarHBondContact O-CB 3.49Å; G96-C597 PolarHBondContact O-SG 3.44Å; A593-C597 VanDerWaalsContact O-CB 3.28Å; A593-C597 WeakPolarHBondContact O-CB 3.4Å; A593-C597 PolarHBondContact O-N 3.39Å; A593-C597 VanDerWaalsContact O-N 3.09Å; G594-C597 WeakPolarHBondContact O-CB 3.32Å; G594-C597 PolarHBondContact O-N 2.88Å; V595-C597 PolarHBondContact O-N 3.02Å
598	C	95.5	Very high	94.3	Very high	20 Å²	20	16.1 Å²	16.1	14%	0.135	10%	0.095	C	C	.	.	H	α-helix	trans	-80.8	-33.9	-171.9	-55.6	0	0	0	0	113.1	E88 M572 G594	E88-C598 WeakPolarHBondContact OE2-CA 3.38Å; M572-C598 HydrophobicContact CB-CB 4.09Å; M572-C598 HydrophobicContact CG-CB 3.93Å; M572-C598 HydrophobicContact SD-CB 4.01Å; G594-C598 WeakPolarHBondContact O-CB 3.3Å; G594-C598 PolarHBondContact O-N 2.78Å; G594-C598 PolarHBondContact O-SG 2.67Å
599	T	95.5	Very high	93.5	Very high	18 Å²	18	16.3 Å²	16.3	11%	0.11	10%	0.095	C	C	.	.	H	α-helix	trans	-120.7	-11.7	-166.5	74	0	0	0	0	114.2	M572 I575 V595 R601	M572-T599 HydrophobicContact CB-CG2 4.31Å; M572-T599 WeakPolarHBondContact O-CG2 3.35Å; M572-T599 HydrophobicContact SD-CG2 4.18Å; I575-T599 HydrophobicContact CB-CG2 4.05Å; I575-T599 HydrophobicContact CG2-CG2 3.76Å; V595-T599 WeakPolarHBondContact O-CB 3.33Å; V595-T599 PolarHBondContact O-N 3.26Å; V595-T599 PolarHBondContact O-OG1 2.96Å; T599-R601 PolarHBondContact O-N 2.82Å; T599-R601 VanDerWaalsContact O-N 3.12Å; T599-R601 PolarHBondContact O-NH1 2.91Å; T599-R601 WeakPolarHBondContact OG1-CB 3.33Å; T599-R601 VanDerWaalsContact OG1-CG 3.25Å; T599-R601 WeakPolarHBondContact OG1-CG 2.97Å; T599-R601 PolarHBondContact OG1-N 3.38Å
600	G	94.9	Very high	92.6	Very high	44 Å²	44	15.7 Å²	15.7	45%	0.454	9%	0.092	S	C	.	.			trans	65.1	7.7	-175.3	0	0	0	0	0	114.6	K596	K596-G600 VanDerWaalsContact O-CA 3.32Å; K596-G600 WeakPolarHBondContact O-CA 3.09Å; K596-G600 PolarHBondContact O-N 3.38Å
601	R	96.7	Very high	92.1	Very high	29 Å²	29	12 Å²	12	11%	0.109	8%	0.075	C	C	.	.			trans	-70.6	155.2	-179.3	-63.9	-59.9	-175.5	-93.9	4.3	111.6	I575 G576 T579 A580 P581 F585 V595 T599	I575-R601 HydrophobicContact CG2-CB 4.44Å; I575-R601 HydrophobicContact CG2-CG 3.66Å; G576-R601 PolarHBondContact O-NH2 3.17Å; T579-R601 PolarHBondContact O-NH2 2.81Å; T579-R601 PolarHBondContact OG1-NE 2.83Å; T579-R601 VanDerWaalsContact OG1-NE 3.15Å; A580-R601 WeakPolarHBondContact O-CD 3.46Å; A580-R601 PolarHBondContact O-NE 2.66Å; P581-R601 WeakPolarHBondContact O-CD 3.31Å; F585-R601 HydrophobicContact CD2-CB 3.89Å; F585-R601 HydrophobicContact CD2-CG 4.48Å; F585-R601 HydrophobicContact CE2-CB 3.86Å; F585-R601 HydrophobicContact CE2-CG 3.94Å; V595-R601 HydrophobicContact CG1-CB 4.26Å; T599-R601 PolarHBondContact O-N 2.82Å; T599-R601 VanDerWaalsContact O-N 3.12Å; T599-R601 PolarHBondContact O-NH1 2.91Å; T599-R601 WeakPolarHBondContact OG1-CB 3.33Å; T599-R601 VanDerWaalsContact OG1-CG 3.25Å; T599-R601 WeakPolarHBondContact OG1-CG 2.97Å; T599-R601 PolarHBondContact OG1-N 3.38Å
602	H	97	Very high	91.5	Very high	18 Å²	18	15 Å²	15	8%	0.083	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	139.7	-178.8	-64.7	-167.1	0	0	0	109.7	V123 H126 H582 A583 S584 F585	V123-H602 WeakPolarHBondContact O-CA 3.41Å; H126-H602 HydrophobicContact CB-CB 3.98Å; H126-H602 AromaticContact CE1-CE1 3.98Å; H126-H602 AromaticContact CE1-ND1 3.18Å; H126-H602 PolarHBondContact CE1-ND1 2.95Å; H126-H602 AromaticContact CG-ND1 3.79Å; H126-H602 AromaticContact ND1-CE1 3.95Å; H126-H602 AromaticContact ND1-CG 3.77Å; H126-H602 AromaticContact ND1-ND1 3Å; H126-H602 PolarHBondContact ND1-ND1 3.43Å; H126-H602 AromaticContact NE2-ND1 3.98Å; H582-H602 AromaticContact ND1-CE1 3.94Å; H582-H602 AromaticContact ND1-NE2 3.67Å; A583-H602 PolarHBondContact O-N 3.14Å; S584-H602 CarbonylContact C-O 3.58Å; S584-H602 VanDerWaalsContact CA-O 3.27Å; S584-H602 WeakPolarHBondContact CA-O 3.38Å; F585-H602 PolarHBondContact N-O 3.22Å
603	I	97.1	Very high	91	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.2	-179.9	62.2	170.2	0	0	0	110.2	V123 T124 H126 L592 V595 K596 H606	V123-I603 PolarHBondContact O-N 3.3Å; T124-I603 CarbonylContact C-O 3.57Å; T124-I603 WeakPolarHBondContact O-CG1 3.44Å; H126-I603 WeakPolarHBondContact CB-O 3.4Å; H126-I603 PolarHBondContact N-O 3.39Å; L592-I603 HydrophobicContact CB-CB 4.17Å; L592-I603 HydrophobicContact CB-CD1 4.29Å; L592-I603 HydrophobicContact CB-CG2 4.08Å; L592-I603 HydrophobicContact CD1-CB 4.39Å; L592-I603 HydrophobicContact CD2-CB 4.5Å; L592-I603 HydrophobicContact CD2-CG2 4.1Å; V595-I603 HydrophobicContact CB-CG2 4.36Å; V595-I603 HydrophobicContact CG1-CG2 4.28Å; K596-I603 HydrophobicContact CB-CD1 3.83Å; K596-I603 HydrophobicContact CB-CG1 4.31Å; K596-I603 HydrophobicContact CB-CG2 4.13Å; K596-I603 HydrophobicContact CD-CD1 3.94Å; K596-I603 HydrophobicContact CD-CG1 4.24Å; I603-H606 HydrophobicContact CD1-CB 4.1Å
604	T	95.2	Very high	90.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-92.5	-32.5	-174.9	52.4	0	0	0	0	113	F585 A586 R617 I621	F585-T604 PolarHBondContact O-N 2.63Å; F585-T604 VanDerWaalsContact O-N 3.09Å; F585-T604 PolarHBondContact O-OG1 2.94Å; F585-T604 VanDerWaalsContact O-OG1 3.12Å; A586-T604 WeakPolarHBondContact CA-OG1 3.45Å; A586-T604 HydrophobicContact CB-CG2 4.49Å; A586-T604 WeakPolarHBondContact CB-OG1 3.36Å; T604-R617 WeakPolarHBondContact O-CD 3.37Å; T604-R617 PolarHBondContact O-NH1 2.8Å; T604-I621 WeakPolarHBondContact OG1-CD1 3.49Å
605	N	94.7	Very high	90.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.118	C	C	.	.			trans	-140.2	160.9	178.5	60	-56.6	0	0	0	112	G587 L592 T618 I621	G587-N605 PolarHBondContact O-ND2 3.27Å; G587-N605 PolarHBondContact O-OD1 2.85Å; L592-N605 WeakPolarHBondContact CB-O 3.37Å; L592-N605 VanDerWaalsContact CD1-O 3.27Å; L592-N605 WeakPolarHBondContact CD1-O 3.19Å; L592-N605 WeakPolarHBondContact CD1-OD1 3.26Å; N605-T618 HydrophobicContact CB-CG2 4.27Å; N605-I621 HydrophobicContact CB-CD1 4.11Å
606	H	93.5	Very high	90.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.			trans	-157.7	168	-176.9	59.9	65.7	0	0	0	112.3	L97 T124 E125 F136 I603 H608 L614	L97-H606 HydrophobicContact CD2-CB 4.09Å; T124-H606 VanDerWaalsContact CG2-CD2 3.48Å; T124-H606 WeakPolarHBondContact CG2-CD2 3.47Å; T124-H606 PolarHBondContact O-CD2 3.4Å; E125-H606 WeakPolarHBondContact CG-NE2 3.42Å; E125-H606 IonicContact OE1-NE2 3.65Å; F136-H606 AromaticContact CE1-CE1 3.41Å; F136-H606 VanDerWaalsContact CE1-CE1 3.41Å; F136-H606 WeakPolarHBondContact CE1-CE1 3.27Å; F136-H606 AromaticContact CE1-NE2 3.95Å; F136-H606 AromaticContact CZ-CE1 3.28Å; F136-H606 WeakPolarHBondContact CZ-CE1 3.49Å; F136-H606 AromaticContact CZ-NE2 3.34Å; F136-H606 VanDerWaalsContact CZ-NE2 3.34Å; F136-H606 WeakPolarHBondContact CZ-NE2 3.42Å; I603-H606 HydrophobicContact CD1-CB 4.1Å; H606-H608 VanDerWaalsContact C-N 3.27Å; H606-H608 PolarHBondContact CE1-O 3.44Å; H606-H608 PolarHBondContact ND1-N 2.95Å; H606-H608 PolarHBondContact ND1-O 3.12Å; H606-H608 PolarHBondContact O-N 3.02Å; H606-L614 WeakPolarHBondContact CE1-CD2 3.27Å
607	P	88.6	Confident	90	Very high	19 Å²	19	27 Å²	27	12%	0.123	14%	0.135	C	C	.	.	S	Bend	trans	-67	-23.1	-168.6	-23.3	35.7	0	0	0	114.9	E94 M589 A593 F609	E94-P607 HydrophobicContact CG-CB 3.84Å; M589-P607 HydrophobicContact CB-CG 4.35Å; M589-P607 HydrophobicContact CG-CB 4.42Å; M589-P607 HydrophobicContact CG-CG 4.34Å; M589-P607 WeakPolarHBondContact O-CD 3.48Å; M589-P607 VanDerWaalsContact O-CG 3.22Å; M589-P607 WeakPolarHBondContact O-CG 3.24Å; A593-P607 HydrophobicContact CB-CG 4.09Å; P607-F609 PolarHBondContact O-N 2.95Å
608	H	82.9	Confident	89.9	Confident	5 Å²	5	26.9 Å²	26.9	2%	0.023	13%	0.134	C	C	.	.			trans	-77.8	82.9	177.5	-164.1	-58.1	0	0	0	111	L97 F136 R216 Q264 H606 E610 L614	L97-H608 HydrophobicContact CD2-CB 4.44Å; F136-H608 HydrophobicContact CD1-CB 3.97Å; F136-H608 AromaticContact CD1-CD2 3.48Å; F136-H608 VanDerWaalsContact CD1-CD2 3.48Å; F136-H608 WeakPolarHBondContact CD1-CD2 3.43Å; F136-H608 AromaticContact CD1-CE1 3.52Å; F136-H608 AromaticContact CD1-CG 3.31Å; F136-H608 AromaticContact CD1-ND1 3.3Å; F136-H608 VanDerWaalsContact CD1-ND1 3.3Å; F136-H608 WeakPolarHBondContact CD1-ND1 3.28Å; F136-H608 AromaticContact CD1-NE2 3.62Å; F136-H608 HydrophobicContact CE1-CB 3.8Å; F136-H608 AromaticContact CE1-CG 3.56Å; F136-H608 AromaticContact CE1-ND1 3.47Å; F136-H608 WeakPolarHBondContact CE1-ND1 3.47Å; R216-H608 VanDerWaalsContact CZ-NE2 3.29Å; R216-H608 PolarHBondContact NH1-NE2 3.09Å; R216-H608 VanDerWaalsContact NH1-NE2 3.11Å; R216-H608 PolarHBondContact NH2-CD2 2.87Å; R216-H608 PolarHBondContact NH2-NE2 2.98Å; Q264-H608 PolarHBondContact NE2-NE2 3.1Å; Q264-H608 PolarHBondContact OE1-CE1 2.87Å; Q264-H608 PolarHBondContact OE1-NE2 3.36Å; Q264-H608 VanDerWaalsContact OE1-NE2 3.16Å; H606-H608 VanDerWaalsContact C-N 3.27Å; H606-H608 PolarHBondContact CE1-O 3.44Å; H606-H608 PolarHBondContact ND1-N 2.95Å; H606-H608 PolarHBondContact ND1-O 3.12Å; H606-H608 PolarHBondContact O-N 3.02Å; H608-E610 WeakPolarHBondContact CA-OE2 3.37Å; H608-E610 IonicContact CE1-OE1 3.88Å; H608-E610 IonicContact CE1-OE2 2.61Å; H608-E610 PolarHBondContact CE1-OE2 3.44Å; H608-E610 IonicContact CG-OE2 3.48Å; H608-E610 VanDerWaalsContact CG-OE2 3.31Å; H608-E610 IonicContact ND1-OE1 3.95Å; H608-E610 IonicContact ND1-OE2 2.94Å; H608-E610 PolarHBondContact ND1-OE2 3.33Å; H608-E610 IonicContact NE2-OE2 2.78Å; H608-L614 WeakPolarHBondContact O-CD2 2.99Å
609	F	76.3	Confident	89.7	Confident	7 Å²	7	28.7 Å²	28.7	3%	0.031	14%	0.14	C	C	.	.			trans	-101.6	29.7	-164	-171.5	-110.8	0	0	0	116.1	F396 L400 P607 L614 R615 T618	F396-F609 HydrophobicContact CE1-CZ 4.11Å; L400-F609 HydrophobicContact CD2-CE1 4.46Å; P607-F609 PolarHBondContact O-N 2.95Å; F609-L614 HydrophobicContact CD2-CG 4.36Å; F609-L614 WeakPolarHBondContact CE2-O 3.36Å; F609-R615 HydrophobicContact CD1-CG 3.56Å; F609-R615 HydrophobicContact CD2-CG 4.02Å; F609-R615 HydrophobicContact CE1-CB 3.86Å; F609-R615 HydrophobicContact CE1-CG 3.29Å; F609-R615 HydrophobicContact CE2-CB 3.92Å; F609-R615 HydrophobicContact CE2-CG 3.78Å; F609-R615 HydrophobicContact CG-CG 3.94Å; F609-R615 HydrophobicContact CZ-CB 3.51Å; F609-R615 HydrophobicContact CZ-CG 3.42Å; F609-R615 VanDerWaalsContact CZ-CG 3.42Å; F609-R615 WeakPolarHBondContact CZ-O 3Å; F609-R615 WeakPolarHBondContact O-CD 3.31Å; F609-R615 WeakPolarHBondContact O-CG 3.5Å; F609-T618 HydrophobicContact CD2-CG2 4.46Å; F609-T618 HydrophobicContact CE2-CG2 3.96Å; F609-T618 WeakPolarHBondContact CE2-OG1 3.34Å
610	E	74.6	Confident	89.7	Confident	20 Å²	20	30.2 Å²	30.2	9%	0.093	15%	0.146	C	C	.	.			trans	-86.1	-15.5	-168	-70.5	79.4	171	0	0	113.9	Q264 F265 H608 R615	Q264-E610 PolarHBondContact NE2-OE1 2.89Å; F265-E610 HydrophobicContact CE1-CG 4.45Å; F265-E610 HydrophobicContact CZ-CG 4.2Å; H608-E610 WeakPolarHBondContact CA-OE2 3.37Å; H608-E610 IonicContact CE1-OE1 3.88Å; H608-E610 IonicContact CE1-OE2 2.61Å; H608-E610 PolarHBondContact CE1-OE2 3.44Å; H608-E610 IonicContact CG-OE2 3.48Å; H608-E610 VanDerWaalsContact CG-OE2 3.31Å; H608-E610 IonicContact ND1-OE1 3.95Å; H608-E610 IonicContact ND1-OE2 2.94Å; H608-E610 PolarHBondContact ND1-OE2 3.33Å; H608-E610 IonicContact NE2-OE2 2.78Å; E610-R615 PolarHBondContact O-NH1 3.11Å
611	D	81.2	Confident	89.7	Confident	33 Å²	33	28.2 Å²	28.2	18%	0.176	12%	0.124	C	C	.	.	S	Bend	trans	-92.4	136.5	178.3	176.8	80.4	0	0	0	112.8	R135 R613 L614 R615	R135-D611 IonicContact CZ-OD1 3.72Å; R135-D611 IonicContact CZ-OD2 3.86Å; R135-D611 IonicContact NH1-OD1 3.31Å; R135-D611 PolarHBondContact NH1-OD1 3.42Å; R135-D611 IonicContact NH1-OD2 3.17Å; R135-D611 PolarHBondContact NH1-OD2 3.48Å; R135-D611 IonicContact NH2-OD1 2.87Å; R135-D611 IonicContact NH2-OD2 3.68Å; R135-D611 PolarHBondContact NH2-OD2 2.92Å; D611-R613 VanDerWaalsContact C-N 3.34Å; D611-R613 PolarHBondContact O-N 3.25Å; D611-R613 WeakPolarHBondContact OD2-CA 3.35Å; D611-R613 VanDerWaalsContact OD2-CB 3.32Å; D611-R613 WeakPolarHBondContact OD2-CB 3.41Å; D611-R613 PolarHBondContact OD2-N 3.32Å; D611-L614 HydrophobicContact CB-CB 4.3Å; D611-L614 PolarHBondContact O-N 3.41Å; D611-L614 PolarHBondContact OD2-N 3.45Å; D611-R615 VanDerWaalsContact O-CG 3.28Å; D611-R615 WeakPolarHBondContact O-CG 2.97Å; D611-R615 PolarHBondContact O-N 3.02Å
612	K	82.8	Confident	89.6	Confident	80 Å²	80	27 Å²	27	35%	0.348	12%	0.12	S	C	.	.	H	α-helix	trans	-55	-43.2	-177.6	-170.4	-173.6	179.4	-167.1	0	113.5	E375 R615 D616	E375-K612 HydrophobicContact CB-CD 4.29Å; E375-K612 IonicContact OE2-NZ 3.34Å; E375-K612 PolarHBondContact OE2-NZ 3.37Å; K612-R615 WeakPolarHBondContact O-CA 3.49Å; K612-R615 VanDerWaalsContact O-CB 3.3Å; K612-R615 WeakPolarHBondContact O-CB 3.48Å; K612-R615 PolarHBondContact O-N 3.08Å; K612-D616 PolarHBondContact O-N 3.45Å
613	R	87.1	Confident	89.6	Confident	191 Å²	191	26.7 Å²	26.7	72%	0.721	12%	0.119	S	C	*	.	H	α-helix	trans	-68.7	-41.8	-177.8	-63.2	-179.1	177	176	-0.4	111.5	D611 R615 D616 R617	D611-R613 VanDerWaalsContact C-N 3.34Å; D611-R613 PolarHBondContact O-N 3.25Å; D611-R613 WeakPolarHBondContact OD2-CA 3.35Å; D611-R613 VanDerWaalsContact OD2-CB 3.32Å; D611-R613 WeakPolarHBondContact OD2-CB 3.41Å; D611-R613 PolarHBondContact OD2-N 3.32Å; R613-R615 PolarHBondContact O-N 2.87Å; R613-D616 PolarHBondContact O-N 3.07Å; R613-R617 WeakPolarHBondContact O-CB 3.27Å; R613-R617 PolarHBondContact O-N 3.29Å
614	L	88.7	Confident	89.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.4	-31.6	172.6	-175.4	63.7	0	0	0	110.8	E125 H606 H608 F609 D611 T618	E125-L614 HydrophobicContact CG-CD1 4.25Å; H606-L614 WeakPolarHBondContact CE1-CD2 3.27Å; H608-L614 WeakPolarHBondContact O-CD2 2.99Å; F609-L614 HydrophobicContact CD2-CG 4.36Å; F609-L614 WeakPolarHBondContact CE2-O 3.36Å; D611-L614 HydrophobicContact CB-CB 4.3Å; D611-L614 PolarHBondContact O-N 3.41Å; D611-L614 PolarHBondContact OD2-N 3.45Å; L614-T618 PolarHBondContact O-N 3.25Å; L614-T618 PolarHBondContact O-OG1 2.89Å
615	R	88.4	Confident	89.5	Confident	5 Å²	5	26.8 Å²	26.8	2%	0.019	12%	0.119	C	C	.	.	H	α-helix	trans	-59.3	-57.5	172.2	-64.4	-154.7	-65	-76.8	-6.3	114.8	H379 E397 F609 E610 D611 K612 R613 R617 T618 K619	H379-R615 PolarHBondContact ND1-NH1 2.66Å; E397-R615 WeakPolarHBondContact OE1-CB 3.25Å; E397-R615 VanDerWaalsContact OE1-CD 3.26Å; E397-R615 WeakPolarHBondContact OE1-CD 3.38Å; E397-R615 IonicContact OE1-CZ 3.05Å; E397-R615 IonicContact OE1-NE 3.08Å; E397-R615 PolarHBondContact OE1-NE 3.46Å; E397-R615 IonicContact OE2-NE 2.61Å; E397-R615 PolarHBondContact OE2-NE 2.51Å; F609-R615 HydrophobicContact CD1-CG 3.56Å; F609-R615 HydrophobicContact CD2-CG 4.02Å; F609-R615 HydrophobicContact CE1-CB 3.86Å; F609-R615 HydrophobicContact CE1-CG 3.29Å; F609-R615 HydrophobicContact CE2-CB 3.92Å; F609-R615 HydrophobicContact CE2-CG 3.78Å; F609-R615 HydrophobicContact CG-CG 3.94Å; F609-R615 HydrophobicContact CZ-CB 3.51Å; F609-R615 HydrophobicContact CZ-CG 3.42Å; F609-R615 VanDerWaalsContact CZ-CG 3.42Å; F609-R615 WeakPolarHBondContact CZ-O 3Å; F609-R615 WeakPolarHBondContact O-CD 3.31Å; F609-R615 WeakPolarHBondContact O-CG 3.5Å; E610-R615 PolarHBondContact O-NH1 3.11Å; D611-R615 VanDerWaalsContact O-CG 3.28Å; D611-R615 WeakPolarHBondContact O-CG 2.97Å; D611-R615 PolarHBondContact O-N 3.02Å; K612-R615 WeakPolarHBondContact O-CA 3.49Å; K612-R615 VanDerWaalsContact O-CB 3.3Å; K612-R615 WeakPolarHBondContact O-CB 3.48Å; K612-R615 PolarHBondContact O-N 3.08Å; R613-R615 PolarHBondContact O-N 2.87Å; R615-R617 VanDerWaalsContact C-N 3.28Å; R615-R617 PolarHBondContact O-N 3.21Å; R615-T618 PolarHBondContact O-N 3.04Å; R615-K619 WeakPolarHBondContact O-CB 3.32Å; R615-K619 PolarHBondContact O-N 3.22Å
616	D	90.4	Very high	89.5	Confident	66 Å²	66	26.8 Å²	26.8	35%	0.353	12%	0.119	S	C	.	.	H	α-helix	trans	-58.8	-43.3	177.2	-62.8	-31.2	0	0	0	110.6	K612 R613 K619 E620	K612-D616 PolarHBondContact O-N 3.45Å; R613-D616 PolarHBondContact O-N 3.07Å; D616-K619 WeakPolarHBondContact O-CB 3.43Å; D616-K619 PolarHBondContact O-N 2.6Å; D616-E620 WeakPolarHBondContact O-CG 3.44Å; D616-E620 PolarHBondContact O-N 3.14Å
617	R	92.6	Very high	89.5	Confident	9 Å²	9	27.9 Å²	27.9	3%	0.034	12%	0.124	C	C	.	.	H	α-helix	trans	-58.8	-53.4	176.3	176.9	-176.1	-59.6	175.5	4.7	112.9	E125 H126 H128 T604 R613 R615 K619 E620 I621 Y640	E125-R617 VanDerWaalsContact C-NH1 3.32Å; E125-R617 PolarHBondContact O-NH1 3.18Å; H126-R617 PolarHBondContact O-NH1 3.43Å; H128-R617 PolarHBondContact CD2-NH2 2.76Å; T604-R617 WeakPolarHBondContact O-CD 3.37Å; T604-R617 PolarHBondContact O-NH1 2.8Å; R613-R617 WeakPolarHBondContact O-CB 3.27Å; R613-R617 PolarHBondContact O-N 3.29Å; R615-R617 VanDerWaalsContact C-N 3.28Å; R615-R617 PolarHBondContact O-N 3.21Å; R617-K619 VanDerWaalsContact C-N 3.27Å; R617-K619 PolarHBondContact O-N 3.41Å; R617-E620 WeakPolarHBondContact O-CB 3.3Å; R617-E620 PolarHBondContact O-N 3.47Å; R617-E620 VanDerWaalsContact O-N 3.14Å; R617-I621 HydrophobicContact CG-CD1 3.65Å; R617-I621 HydrophobicContact CG-CG1 4.31Å; R617-I621 WeakPolarHBondContact O-CG1 3.32Å; R617-I621 PolarHBondContact O-N 2.55Å; R617-Y640 HydrophobicContact CB-CE1 3.98Å; R617-Y640 HydrophobicContact CG-CD1 3.88Å; R617-Y640 HydrophobicContact CG-CD2 4.2Å; R617-Y640 HydrophobicContact CG-CE1 3.61Å; R617-Y640 HydrophobicContact CG-CE2 3.97Å; R617-Y640 HydrophobicContact CG-CG 4.16Å
618	T	93.5	Very high	89.8	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-66	-36.4	-176.7	-49.4	0	0	0	0	110.6	N605 F609 L614 R615 E620 I621 Y622	N605-T618 HydrophobicContact CB-CG2 4.27Å; F609-T618 HydrophobicContact CD2-CG2 4.46Å; F609-T618 HydrophobicContact CE2-CG2 3.96Å; F609-T618 WeakPolarHBondContact CE2-OG1 3.34Å; L614-T618 PolarHBondContact O-N 3.25Å; L614-T618 PolarHBondContact O-OG1 2.89Å; R615-T618 PolarHBondContact O-N 3.04Å; T618-E620 VanDerWaalsContact C-N 3.28Å; T618-E620 PolarHBondContact O-N 2.86Å; T618-I621 PolarHBondContact O-N 3.14Å; T618-Y622 HydrophobicContact CG2-CD1 3.9Å; T618-Y622 HydrophobicContact CG2-CD2 4.04Å; T618-Y622 HydrophobicContact CG2-CE1 3.64Å; T618-Y622 HydrophobicContact CG2-CE2 3.81Å; T618-Y622 HydrophobicContact CG2-CG 4.11Å; T618-Y622 VanDerWaalsContact O-CB 3.29Å; T618-Y622 WeakPolarHBondContact O-CB 3.25Å; T618-Y622 PolarHBondContact O-N 2.85Å
619	K	92.5	Very high	90.3	Very high	57 Å²	57	32.5 Å²	32.5	25%	0.248	14%	0.144	C	C	.	.	H	α-helix	trans	-58.5	-40.9	173.5	179.7	-173.7	178	180	0	111.7	F396 R615 D616 R617 Q623 E669	F396-K619 HydrophobicContact CD1-CB 4.01Å; F396-K619 HydrophobicContact CD1-CD 4.39Å; F396-K619 HydrophobicContact CD1-CG 3.99Å; F396-K619 HydrophobicContact CE1-CB 4.04Å; F396-K619 HydrophobicContact CE1-CG 4.43Å; F396-K619 HydrophobicContact CG-CG 4.17Å; R615-K619 WeakPolarHBondContact O-CB 3.32Å; R615-K619 PolarHBondContact O-N 3.22Å; D616-K619 WeakPolarHBondContact O-CB 3.43Å; D616-K619 PolarHBondContact O-N 2.6Å; R617-K619 VanDerWaalsContact C-N 3.27Å; R617-K619 PolarHBondContact O-N 3.41Å; K619-Q623 PolarHBondContact O-NE2 3.14Å; K619-E669 VanDerWaalsContact CE-CD 3.41Å; K619-E669 WeakPolarHBondContact CE-OE1 3.26Å; K619-E669 IonicContact NZ-OE1 3.8Å; K619-E669 PolarHBondContact NZ-OE1 3.31Å
620	E	94.4	Very high	91.2	Very high	51 Å²	51	32.1 Å²	32.1	24%	0.238	14%	0.143	C	C	.	.	H	α-helix	trans	-69	-44.6	173.9	-74.9	-177.4	-165.3	0	0	112.4	D616 R617 T618 Y622 Q623 L636 K639 Y640	D616-E620 WeakPolarHBondContact O-CG 3.44Å; D616-E620 PolarHBondContact O-N 3.14Å; R617-E620 WeakPolarHBondContact O-CB 3.3Å; R617-E620 PolarHBondContact O-N 3.47Å; R617-E620 VanDerWaalsContact O-N 3.14Å; T618-E620 VanDerWaalsContact C-N 3.28Å; T618-E620 PolarHBondContact O-N 2.86Å; E620-Y622 VanDerWaalsContact C-N 3.34Å; E620-Y622 PolarHBondContact O-N 3.4Å; E620-Q623 WeakPolarHBondContact O-CB 3.04Å; E620-Q623 WeakPolarHBondContact O-CG 3.48Å; E620-Q623 PolarHBondContact O-N 3.35Å; E620-L636 HydrophobicContact CB-CD2 4.28Å; E620-L636 HydrophobicContact CG-CD2 4.34Å; E620-K639 IonicContact OE1-NZ 3.41Å; E620-K639 PolarHBondContact OE1-NZ 3.15Å; E620-K639 IonicContact OE2-NZ 3.57Å; E620-K639 PolarHBondContact OE2-NZ 3.28Å; E620-Y640 HydrophobicContact CB-CE2 4.09Å; E620-Y640 VanDerWaalsContact OE2-CE2 3.26Å; E620-Y640 WeakPolarHBondContact OE2-CE2 3.22Å; E620-Y640 VanDerWaalsContact OE2-CZ 3.26Å; E620-Y640 PolarHBondContact OE2-OH 3.27Å
621	I	95.1	Very high	92.2	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-41.4	178	-69.3	169.6	0	0	0	110.9	A586 T604 N605 R617 T618 Q623 I624 L637 Y640	A586-I621 HydrophobicContact CB-CG2 4.14Å; T604-I621 WeakPolarHBondContact OG1-CD1 3.49Å; N605-I621 HydrophobicContact CB-CD1 4.11Å; R617-I621 HydrophobicContact CG-CD1 3.65Å; R617-I621 HydrophobicContact CG-CG1 4.31Å; R617-I621 WeakPolarHBondContact O-CG1 3.32Å; R617-I621 PolarHBondContact O-N 2.55Å; T618-I621 PolarHBondContact O-N 3.14Å; I621-Q623 PolarHBondContact O-N 3Å; I621-I624 VanDerWaalsContact O-CG1 3.28Å; I621-I624 WeakPolarHBondContact O-CG1 3.46Å; I621-I624 VanDerWaalsContact O-CG2 3.25Å; I621-I624 WeakPolarHBondContact O-CG2 3.41Å; I621-I624 PolarHBondContact O-N 3.41Å; I621-I624 VanDerWaalsContact O-N 3.09Å; I621-L637 HydrophobicContact CG2-CD2 4.4Å; I621-Y640 HydrophobicContact CD1-CD2 4.4Å; I621-Y640 HydrophobicContact CG1-CD2 4.11Å; I621-Y640 HydrophobicContact CG1-CE2 4.4Å
622	Y	95.7	Very high	92.9	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.02	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-67.9	-4.7	179.9	-76.6	6.2	0	0	0	113.8	F396 M589 T618 E620 I624 Y625 L662	F396-Y622 HydrophobicContact CE2-CD2 4.18Å; F396-Y622 AromaticContact CZ-CD2 3.75Å; F396-Y622 HydrophobicContact CZ-CD2 3.75Å; F396-Y622 HydrophobicContact CZ-CE2 4.37Å; M589-Y622 WeakPolarHBondContact CB-OH 3.34Å; M589-Y622 WeakPolarHBondContact CG-OH 3.39Å; M589-Y622 PolarHBondContact N-OH 3.41Å; M589-Y622 PolarHBondContact SD-OH 2.92Å; T618-Y622 HydrophobicContact CG2-CD1 3.9Å; T618-Y622 HydrophobicContact CG2-CD2 4.04Å; T618-Y622 HydrophobicContact CG2-CE1 3.64Å; T618-Y622 HydrophobicContact CG2-CE2 3.81Å; T618-Y622 HydrophobicContact CG2-CG 4.11Å; T618-Y622 VanDerWaalsContact O-CB 3.29Å; T618-Y622 WeakPolarHBondContact O-CB 3.25Å; T618-Y622 PolarHBondContact O-N 2.85Å; E620-Y622 VanDerWaalsContact C-N 3.34Å; E620-Y622 PolarHBondContact O-N 3.4Å; Y622-I624 PolarHBondContact O-N 3Å; Y622-I624 VanDerWaalsContact O-N 3.14Å; Y622-Y625 HydrophobicContact CD1-CD2 4.5Å; Y622-Y625 HydrophobicContact CD1-CE2 4.26Å; Y622-Y625 HydrophobicContact CG-CD2 4.46Å; Y622-Y625 PolarHBondContact O-N 2.95Å; Y622-L662 HydrophobicContact CD2-CD1 3.67Å; Y622-L662 HydrophobicContact CD2-CD2 3.98Å; Y622-L662 HydrophobicContact CD2-CG 4.39Å; Y622-L662 HydrophobicContact CE2-CD1 3.98Å; Y622-L662 HydrophobicContact CE2-CD2 4Å; Y622-L662 HydrophobicContact CG-CD2 4.43Å
623	Q	95.8	Very high	93.6	Very high	11 Å²	11	34.2 Å²	34.2	5%	0.051	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-60.6	-15.7	166	-62.5	-60.9	-48.1	0	0	113	K619 E620 I621 Y625 G626 R628 L636 N670	K619-Q623 PolarHBondContact O-NE2 3.14Å; E620-Q623 WeakPolarHBondContact O-CB 3.04Å; E620-Q623 WeakPolarHBondContact O-CG 3.48Å; E620-Q623 PolarHBondContact O-N 3.35Å; I621-Q623 PolarHBondContact O-N 3Å; Q623-Y625 PolarHBondContact O-N 2.8Å; Q623-G626 PolarHBondContact O-N 3.04Å; Q623-R628 HydrophobicContact CB-CG 4.28Å; Q623-L636 HydrophobicContact CB-CD1 3.86Å; Q623-L636 HydrophobicContact CG-CD1 4.08Å; Q623-N670 PolarHBondContact OE1-ND2 2.94Å; Q623-N670 PolarHBondContact OE1-OD1 3.44Å; Q623-N670 VanDerWaalsContact OE1-OD1 3.08Å
624	I	96	Very high	94	Very high	1 Å²	1	27 Å²	27	1%	0.005	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-55.8	-27.8	166.6	65.1	-176.9	0	0	0	112.3	I621 Y622 V633 L637 L645 L647 F693 C694	I621-I624 VanDerWaalsContact O-CG1 3.28Å; I621-I624 WeakPolarHBondContact O-CG1 3.46Å; I621-I624 VanDerWaalsContact O-CG2 3.25Å; I621-I624 WeakPolarHBondContact O-CG2 3.41Å; I621-I624 PolarHBondContact O-N 3.41Å; I621-I624 VanDerWaalsContact O-N 3.09Å; Y622-I624 PolarHBondContact O-N 3Å; Y622-I624 VanDerWaalsContact O-N 3.14Å; I624-V633 HydrophobicContact CG2-CG1 3.64Å; I624-L637 HydrophobicContact CG2-CD1 4.28Å; I624-L637 HydrophobicContact CG2-CD2 4.31Å; I624-L645 HydrophobicContact CD1-CD1 3.8Å; I624-L645 HydrophobicContact CG2-CD1 3.84Å; I624-L645 HydrophobicContact CG2-CD2 4.18Å; I624-L647 HydrophobicContact CB-CD2 4.31Å; I624-L647 HydrophobicContact CD1-CD2 4.03Å; I624-L647 HydrophobicContact CG1-CD2 4.36Å; I624-F693 HydrophobicContact CB-CD1 4.17Å; I624-F693 HydrophobicContact CB-CE1 4.39Å; I624-F693 HydrophobicContact CG2-CE1 4.42Å; I624-F693 WeakPolarHBondContact O-CB 3.24Å; I624-F693 VanDerWaalsContact O-CD1 3.28Å; I624-F693 WeakPolarHBondContact O-CD1 3.1Å; I624-C694 WeakPolarHBondContact O-CB 3.28Å; I624-C694 PolarHBondContact O-N 3.22Å
625	Y	95.1	Very high	94.4	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-93.2	-1.5	176	-56.8	-65.5	0	0	0	112.9	Y622 Q623 L647 I651 L662 R692 C694	Y622-Y625 HydrophobicContact CD1-CD2 4.5Å; Y622-Y625 HydrophobicContact CD1-CE2 4.26Å; Y622-Y625 HydrophobicContact CG-CD2 4.46Å; Y622-Y625 PolarHBondContact O-N 2.95Å; Q623-Y625 PolarHBondContact O-N 2.8Å; Y625-L647 HydrophobicContact CE1-CD2 4.48Å; Y625-I651 HydrophobicContact CD1-CB 4.36Å; Y625-I651 HydrophobicContact CD1-CG2 3.57Å; Y625-I651 HydrophobicContact CD2-CG2 4.26Å; Y625-I651 HydrophobicContact CE1-CB 3.81Å; Y625-I651 HydrophobicContact CE1-CG2 3.39Å; Y625-I651 HydrophobicContact CE2-CG2 4.09Å; Y625-I651 HydrophobicContact CG-CG2 4.01Å; Y625-L662 HydrophobicContact CD2-CD2 3.49Å; Y625-L662 VanDerWaalsContact CD2-CD2 3.49Å; Y625-L662 HydrophobicContact CD2-CG 4.2Å; Y625-L662 HydrophobicContact CE2-CD2 3.68Å; Y625-L662 HydrophobicContact CG-CD2 4.22Å; Y625-R692 VanDerWaalsContact O-CD 3.31Å; Y625-R692 WeakPolarHBondContact O-CD 3.29Å; Y625-R692 WeakPolarHBondContact O-CG 3.25Å; Y625-R692 PolarHBondContact O-NH1 3.45Å; Y625-C694 HydrophobicContact CD1-CB 4.34Å
626	G	94	Very high	94.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	-89.3	174.4	179	0	0	0	0	0	114	Q623 R628 F693	Q623-G626 PolarHBondContact O-N 3.04Å; G626-R628 PolarHBondContact O-N 3.09Å; G626-R628 VanDerWaalsContact O-N 3.14Å; G626-F693 PolarHBondContact O-N 3.17Å
627	K	94	Very high	95.1	Very high	22 Å²	22	32.1 Å²	32.1	10%	0.096	14%	0.144	C	C	.	.	S	Bend	trans	-81.8	79.1	171.8	-63.2	179.4	-172.3	174.5	0	110.2	D667 V673 E675 T688 V690	K627-D667 WeakPolarHBondContact CE-OD2 3.33Å; K627-D667 IonicContact NZ-OD2 3.56Å; K627-V673 PolarHBondContact NZ-O 3.13Å; K627-V673 VanDerWaalsContact NZ-O 3.13Å; K627-E675 VanDerWaalsContact CE-OE1 3.26Å; K627-E675 WeakPolarHBondContact CE-OE1 3.35Å; K627-E675 IonicContact NZ-OE1 3.87Å; K627-T688 HydrophobicContact CB-CG2 3.6Å; K627-T688 HydrophobicContact CD-CG2 3.28Å; K627-T688 HydrophobicContact CG-CG2 4.04Å; K627-V690 WeakPolarHBondContact CB-O 3.32Å
628	R	94.2	Very high	95.3	Very high	69 Å²	69	36.1 Å²	36.1	26%	0.26	16%	0.162	S	C	.	.			trans	-130	150.6	-172.1	-66.3	-68.8	-172.5	175.5	-2.8	111.4	Q623 G626 V633 N670	Q623-R628 HydrophobicContact CB-CG 4.28Å; G626-R628 PolarHBondContact O-N 3.09Å; G626-R628 VanDerWaalsContact O-N 3.14Å; R628-V633 HydrophobicContact CB-CG2 3.66Å; R628-V633 HydrophobicContact CG-CG2 4.46Å; R628-N670 PolarHBondContact NH2-OD1 3.26Å
629	T	94.4	Very high	95.3	Very high	52 Å²	52	41.8 Å²	41.8	32%	0.319	19%	0.186	S	C	.	.			trans	-77.1	160	176.6	67.5	0	0	0	0	111.6	E631 Q632 V633 V690	T629-E631 VanDerWaalsContact C-N 3.29Å; T629-E631 PolarHBondContact O-N 3.43Å; T629-Q632 PolarHBondContact O-N 2.98Å; T629-Q632 VanDerWaalsContact OG1-CG 3.3Å; T629-Q632 WeakPolarHBondContact OG1-CG 3Å; T629-Q632 PolarHBondContact OG1-N 2.77Å; T629-V633 PolarHBondContact O-N 2.8Å; T629-V690 HydrophobicContact CG2-CG1 4.09Å; T629-V690 HydrophobicContact CG2-CG2 4.47Å
630	A	95.3	Very high	95.4	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-55.2	-44.8	177.5	0	0	0	0	0	112.6	V633 Y634 F704 Y707 F708	A630-V633 PolarHBondContact O-N 3.39Å; A630-Y634 VanDerWaalsContact O-CB 3.32Å; A630-Y634 WeakPolarHBondContact O-CB 3.3Å; A630-Y634 PolarHBondContact O-N 2.87Å; A630-F704 HydrophobicContact CB-CD1 3.57Å; A630-F704 HydrophobicContact CB-CD2 4.32Å; A630-F704 HydrophobicContact CB-CE1 3.73Å; A630-F704 HydrophobicContact CB-CE2 4.43Å; A630-F704 HydrophobicContact CB-CG 3.9Å; A630-F704 HydrophobicContact CB-CZ 4.15Å; A630-Y707 HydrophobicContact CB-CD2 4.03Å; A630-F708 HydrophobicContact CB-CE2 4.34Å
631	E	95.7	Very high	95.5	Very high	92 Å²	92	41.1 Å²	41.1	43%	0.43	19%	0.186	S	C	.	.	H	α-helix	trans	-61.3	-46.3	179	-179.4	177	-165.2	0	0	112.5	T629 V633 Y634 Y635 Y707	T629-E631 VanDerWaalsContact C-N 3.29Å; T629-E631 PolarHBondContact O-N 3.43Å; E631-V633 PolarHBondContact O-N 3.18Å; E631-Y634 PolarHBondContact O-N 2.7Å; E631-Y635 HydrophobicContact CG-CD2 3.69Å; E631-Y635 HydrophobicContact CG-CE2 3.39Å; E631-Y635 WeakPolarHBondContact O-CD2 3.44Å; E631-Y635 PolarHBondContact O-N 2.04Å; E631-Y707 HydrophobicContact CB-CE2 3.74Å; E631-Y707 HydrophobicContact CG-CE2 4.34Å; E631-Y707 WeakPolarHBondContact CG-OH 3.34Å
632	Q	95.4	Very high	95.6	Very high	82 Å²	82	41.1 Å²	41.1	38%	0.383	19%	0.186	S	C	.	.	H	α-helix	trans	-60.6	-46.4	179.8	-75.1	173.8	-17	0	0	111.4	T629 L636	T629-Q632 PolarHBondContact O-N 2.98Å; T629-Q632 VanDerWaalsContact OG1-CG 3.3Å; T629-Q632 WeakPolarHBondContact OG1-CG 3Å; T629-Q632 PolarHBondContact OG1-N 2.77Å; Q632-L636 WeakPolarHBondContact O-CB 3.31Å; Q632-L636 VanDerWaalsContact O-CG 3.26Å; Q632-L636 WeakPolarHBondContact O-CG 3.3Å; Q632-L636 PolarHBondContact O-N 3.37Å; Q632-L636 VanDerWaalsContact O-N 3.09Å
633	V	96.6	Very high	95.7	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-68.3	-39.3	179.5	175.3	0	0	0	0	111.3	I624 R628 T629 A630 E631 Y635 L636 L637 F693 F708	I624-V633 HydrophobicContact CG2-CG1 3.64Å; R628-V633 HydrophobicContact CB-CG2 3.66Å; R628-V633 HydrophobicContact CG-CG2 4.46Å; T629-V633 PolarHBondContact O-N 2.8Å; A630-V633 PolarHBondContact O-N 3.39Å; E631-V633 PolarHBondContact O-N 3.18Å; V633-Y635 PolarHBondContact O-N 2.85Å; V633-L636 PolarHBondContact O-N 3.47Å; V633-L637 HydrophobicContact CG1-CD1 3.84Å; V633-L637 HydrophobicContact CG1-CG 4.2Å; V633-L637 WeakPolarHBondContact O-CG 3.45Å; V633-L637 PolarHBondContact O-N 2.86Å; V633-F693 HydrophobicContact CB-CD2 3.69Å; V633-F693 HydrophobicContact CB-CE2 3.51Å; V633-F693 HydrophobicContact CB-CG 4.29Å; V633-F693 HydrophobicContact CB-CZ 3.98Å; V633-F693 HydrophobicContact CG1-CD1 4.23Å; V633-F693 HydrophobicContact CG1-CD2 4.04Å; V633-F693 HydrophobicContact CG1-CE1 3.85Å; V633-F693 HydrophobicContact CG1-CE2 3.61Å; V633-F693 HydrophobicContact CG1-CG 4.32Å; V633-F693 HydrophobicContact CG1-CZ 3.51Å; V633-F693 HydrophobicContact CG2-CB 4.19Å; V633-F693 HydrophobicContact CG2-CD1 4.37Å; V633-F693 HydrophobicContact CG2-CD2 3.46Å; V633-F693 VanDerWaalsContact CG2-CD2 3.46Å; V633-F693 HydrophobicContact CG2-CE2 3.87Å; V633-F693 HydrophobicContact CG2-CG 3.74Å; V633-F693 HydrophobicContact CG2-CZ 4.48Å; V633-F708 HydrophobicContact CG1-CZ 4.28Å
634	Y	97	Very high	95.8	Very high	39 Å²	39	45.5 Å²	45.5	15%	0.153	21%	0.205	C	C	.	.	H	α-helix	trans	-57.1	-51.3	176.2	176.3	-93.3	0	0	0	111.8	A630 E631 L636 L637 K638 Y707 F708 L722 L723	A630-Y634 VanDerWaalsContact O-CB 3.32Å; A630-Y634 WeakPolarHBondContact O-CB 3.3Å; A630-Y634 PolarHBondContact O-N 2.87Å; E631-Y634 PolarHBondContact O-N 2.7Å; Y634-L636 PolarHBondContact O-N 3.04Å; Y634-L637 PolarHBondContact O-N 3.37Å; Y634-K638 WeakPolarHBondContact O-CB 3.23Å; Y634-K638 PolarHBondContact O-N 3.42Å; Y634-Y707 AromaticContact CD1-CD1 3.52Å; Y634-Y707 HydrophobicContact CD1-CD1 3.52Å; Y634-Y707 AromaticContact CD1-CE1 3.9Å; Y634-Y707 HydrophobicContact CD1-CE1 3.9Å; Y634-Y707 HydrophobicContact CD1-CG 4.46Å; Y634-Y707 AromaticContact CD2-CD1 3.7Å; Y634-Y707 HydrophobicContact CD2-CD1 3.7Å; Y634-Y707 HydrophobicContact CD2-CG 4.07Å; Y634-Y707 WeakPolarHBondContact CD2-O 3.26Å; Y634-Y707 AromaticContact CE1-CD1 3.96Å; Y634-Y707 HydrophobicContact CE1-CD1 3.96Å; Y634-Y707 HydrophobicContact CE1-CE1 4.31Å; Y634-Y707 HydrophobicContact CE2-CD1 4.09Å; Y634-Y707 AromaticContact CG-CD1 3.38Å; Y634-Y707 HydrophobicContact CG-CD1 3.38Å; Y634-Y707 HydrophobicContact CG-CE1 4.17Å; Y634-Y707 AromaticContact CG-CG 3.9Å; Y634-Y707 HydrophobicContact CG-CG 3.9Å; Y634-F708 HydrophobicContact CD2-CZ 4.39Å; Y634-L722 HydrophobicContact CD2-CD2 4.44Å; Y634-L722 HydrophobicContact CD2-CG 4.41Å; Y634-L722 HydrophobicContact CE2-CB 4.2Å; Y634-L723 WeakPolarHBondContact CE2-O 3.33Å; Y634-L723 VanDerWaalsContact CZ-O 3.24Å; Y634-L723 PolarHBondContact OH-O 2.91Å
635	Y	96.8	Very high	95.9	Very high	136 Å²	136	45.4 Å²	45.4	53%	0.533	21%	0.205	S	C	.	.	H	α-helix	trans	-66.8	-35	179.2	-71.6	-59.1	0	0	0	113	E631 V633 K638 K639	E631-Y635 HydrophobicContact CG-CD2 3.69Å; E631-Y635 HydrophobicContact CG-CE2 3.39Å; E631-Y635 WeakPolarHBondContact O-CD2 3.44Å; E631-Y635 PolarHBondContact O-N 2.04Å; V633-Y635 PolarHBondContact O-N 2.85Å; Y635-K638 PolarHBondContact O-N 3.41Å; Y635-K639 WeakPolarHBondContact O-CB 2.93Å; Y635-K639 PolarHBondContact O-N 3.46Å
636	L	96.3	Very high	96	Very high	42 Å²	42	45.4 Å²	45.4	22%	0.22	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-43.9	174	-76.5	170.9	0	0	0	112.1	E620 Q623 Q632 V633 Y634 K639 Y640	E620-L636 HydrophobicContact CB-CD2 4.28Å; E620-L636 HydrophobicContact CG-CD2 4.34Å; Q623-L636 HydrophobicContact CB-CD1 3.86Å; Q623-L636 HydrophobicContact CG-CD1 4.08Å; Q632-L636 WeakPolarHBondContact O-CB 3.31Å; Q632-L636 VanDerWaalsContact O-CG 3.26Å; Q632-L636 WeakPolarHBondContact O-CG 3.3Å; Q632-L636 PolarHBondContact O-N 3.37Å; Q632-L636 VanDerWaalsContact O-N 3.09Å; V633-L636 PolarHBondContact O-N 3.47Å; Y634-L636 PolarHBondContact O-N 3.04Å; L636-K639 WeakPolarHBondContact O-CB 3.44Å; L636-Y640 VanDerWaalsContact O-CD2 3.3Å; L636-Y640 WeakPolarHBondContact O-CD2 3.46Å
637	L	97	Very high	96.2	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-72.7	-36.5	178.7	-68.6	176.2	0	0	0	111.7	A586 I621 I624 V633 Y634 K639 Y640 T642 L645 F708 L722	A586-L637 HydrophobicContact CB-CD2 3.76Å; I621-L637 HydrophobicContact CG2-CD2 4.4Å; I624-L637 HydrophobicContact CG2-CD1 4.28Å; I624-L637 HydrophobicContact CG2-CD2 4.31Å; V633-L637 HydrophobicContact CG1-CD1 3.84Å; V633-L637 HydrophobicContact CG1-CG 4.2Å; V633-L637 WeakPolarHBondContact O-CG 3.45Å; V633-L637 PolarHBondContact O-N 2.86Å; Y634-L637 PolarHBondContact O-N 3.37Å; L637-K639 VanDerWaalsContact C-N 3.31Å; L637-K639 PolarHBondContact O-N 2.88Å; L637-Y640 PolarHBondContact O-N 2.96Å; L637-Y640 VanDerWaalsContact O-N 3.14Å; L637-T642 HydrophobicContact CB-CG2 4.47Å; L637-T642 VanDerWaalsContact O-CB 3.25Å; L637-T642 WeakPolarHBondContact O-CB 3.33Å; L637-T642 PolarHBondContact O-N 3.2Å; L637-T642 PolarHBondContact O-OG1 3Å; L637-L645 HydrophobicContact CD1-CB 4.22Å; L637-L645 HydrophobicContact CD1-CD1 4.1Å; L637-L645 HydrophobicContact CD1-CD2 3.96Å; L637-L645 HydrophobicContact CD1-CG 4.32Å; L637-F708 HydrophobicContact CD1-CE1 4.21Å; L637-L722 HydrophobicContact CB-CD2 3.56Å; L637-L722 HydrophobicContact CD1-CD1 4.31Å; L637-L722 HydrophobicContact CD1-CD2 4.21Å
638	K	96	Very high	96.3	Very high	93 Å²	93	45.4 Å²	45.4	40%	0.404	21%	0.205	S	C	.	.	H	α-helix	trans	-68.7	-30.2	178.9	-166.1	48.1	170.9	170.7	0	112.8	Y634 Y635 Y640 D641	Y634-K638 WeakPolarHBondContact O-CB 3.23Å; Y634-K638 PolarHBondContact O-N 3.42Å; Y635-K638 PolarHBondContact O-N 3.41Å; K638-Y640 PolarHBondContact O-N 3.12Å; K638-Y640 VanDerWaalsContact O-N 3.14Å; K638-D641 PolarHBondContact O-N 2.95Å
639	K	95.3	Very high	96.2	Very high	121 Å²	121	44 Å²	44	53%	0.526	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-29	169.5	178.3	-175.5	170.5	-173.5	0	113.3	E620 Y635 L636 L637	E620-K639 IonicContact OE1-NZ 3.41Å; E620-K639 PolarHBondContact OE1-NZ 3.15Å; E620-K639 IonicContact OE2-NZ 3.57Å; E620-K639 PolarHBondContact OE2-NZ 3.28Å; Y635-K639 WeakPolarHBondContact O-CB 2.93Å; Y635-K639 PolarHBondContact O-N 3.46Å; L636-K639 WeakPolarHBondContact O-CB 3.44Å; L637-K639 VanDerWaalsContact C-N 3.31Å; L637-K639 PolarHBondContact O-N 2.88Å
640	Y	94.5	Very high	96.1	Very high	18 Å²	18	45 Å²	45	7%	0.071	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	22	179.8	-60.9	-65	0	0	0	113.3	R617 E620 I621 L636 L637 K638 T642	R617-Y640 HydrophobicContact CB-CE1 3.98Å; R617-Y640 HydrophobicContact CG-CD1 3.88Å; R617-Y640 HydrophobicContact CG-CD2 4.2Å; R617-Y640 HydrophobicContact CG-CE1 3.61Å; R617-Y640 HydrophobicContact CG-CE2 3.97Å; R617-Y640 HydrophobicContact CG-CG 4.16Å; E620-Y640 HydrophobicContact CB-CE2 4.09Å; E620-Y640 VanDerWaalsContact OE2-CE2 3.26Å; E620-Y640 WeakPolarHBondContact OE2-CE2 3.22Å; E620-Y640 VanDerWaalsContact OE2-CZ 3.26Å; E620-Y640 PolarHBondContact OE2-OH 3.27Å; I621-Y640 HydrophobicContact CD1-CD2 4.4Å; I621-Y640 HydrophobicContact CG1-CD2 4.11Å; I621-Y640 HydrophobicContact CG1-CE2 4.4Å; L636-Y640 VanDerWaalsContact O-CD2 3.3Å; L636-Y640 WeakPolarHBondContact O-CD2 3.46Å; L637-Y640 PolarHBondContact O-N 2.96Å; L637-Y640 VanDerWaalsContact O-N 3.14Å; K638-Y640 PolarHBondContact O-N 3.12Å; K638-Y640 VanDerWaalsContact O-N 3.14Å; Y640-T642 PolarHBondContact O-N 3.29Å; Y640-T642 VanDerWaalsContact O-N 3.14Å
641	D	95.2	Very high	96	Very high	75 Å²	75	46.2 Å²	46.2	40%	0.401	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	35.6	-179.8	-63.6	-47.8	0	0	0	113.6	S584 K638 H643	S584-D641 PolarHBondContact OG-O 3.42Å; K638-D641 PolarHBondContact O-N 2.95Å; D641-H643 PolarHBondContact O-ND1 2.81Å
642	T	97	Very high	95.8	Very high	1 Å²	1	42 Å²	42	1%	0.006	20%	0.199	C	C	.	.			trans	-71.5	132.7	179.5	-53.9	0	0	0	0	110.8	S584 A586 L637 Y640 Y644 L722	S584-T642 VanDerWaalsContact OG-CA 3.31Å; S584-T642 WeakPolarHBondContact OG-CA 3.26Å; A586-T642 HydrophobicContact CB-CG2 3.56Å; L637-T642 HydrophobicContact CB-CG2 4.47Å; L637-T642 VanDerWaalsContact O-CB 3.25Å; L637-T642 WeakPolarHBondContact O-CB 3.33Å; L637-T642 PolarHBondContact O-N 3.2Å; L637-T642 PolarHBondContact O-OG1 3Å; Y640-T642 PolarHBondContact O-N 3.29Å; Y640-T642 VanDerWaalsContact O-N 3.14Å; T642-Y644 VanDerWaalsContact CG2-O 3.24Å; T642-Y644 WeakPolarHBondContact CG2-O 3.42Å; T642-L722 HydrophobicContact CG2-CD1 4.2Å; T642-L722 HydrophobicContact CG2-CD2 4.47Å
643	H	97.7	Very high	95.6	Very high	82 Å²	82	43.7 Å²	43.7	38%	0.38	20%	0.203	S	C	.	.			trans	-99	-40.2	172.6	-66.4	83.3	0	0	0	112.2	S584 D641 L722	S584-H643 PolarHBondContact N-ND1 3.22Å; S584-H643 PolarHBondContact O-N 3.31Å; S584-H643 VanDerWaalsContact O-N 3.1Å; S584-H643 PolarHBondContact OG-N 2.94Å; S584-H643 PolarHBondContact OG-ND1 2.78Å; D641-H643 PolarHBondContact O-ND1 2.81Å; H643-L722 PolarHBondContact O-N 2.64Å
644	Y	98.4	Very high	95.2	Very high	26 Å²	26	45.9 Å²	45.9	10%	0.102	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	139.8	-177.5	-62.6	-84.5	0	0	0	111.5	W574 T579 A583 S584 F585 A586 T642 M711 V719 Y720 Q721	W574-Y644 HydrophobicContact CH2-CD1 4.43Å; W574-Y644 HydrophobicContact CH2-CE1 4.34Å; T579-Y644 HydrophobicContact CG2-CE2 4.02Å; A583-Y644 HydrophobicContact CB-CD2 4.03Å; A583-Y644 HydrophobicContact CB-CE2 3.78Å; S584-Y644 PolarHBondContact O-N 3.09Å; F585-Y644 WeakPolarHBondContact CA-O 3.44Å; F585-Y644 HydrophobicContact CD1-CG 4.43Å; F585-Y644 VanDerWaalsContact CE1-CB 3.47Å; F585-Y644 HydrophobicContact CE1-CD2 4.1Å; F585-Y644 AromaticContact CE1-CG 3.9Å; F585-Y644 HydrophobicContact CE1-CG 3.9Å; F585-Y644 HydrophobicContact CE2-CD2 4.22Å; F585-Y644 AromaticContact CZ-CD2 3.84Å; F585-Y644 HydrophobicContact CZ-CD2 3.84Å; F585-Y644 HydrophobicContact CZ-CG 4.1Å; A586-Y644 PolarHBondContact N-O 2.9Å; T642-Y644 VanDerWaalsContact CG2-O 3.24Å; T642-Y644 WeakPolarHBondContact CG2-O 3.42Å; Y644-M711 HydrophobicContact CE1-CG 4.18Å; Y644-V719 HydrophobicContact CD1-CG1 4.03Å; Y644-V719 HydrophobicContact CG-CG1 4.37Å; Y644-Y720 CarbonylContact C-O 3.42Å; Y644-Y720 VanDerWaalsContact CA-O 3.32Å; Y644-Y720 WeakPolarHBondContact CA-O 3.28Å; Y644-Q721 HydrophobicContact CD1-CB 3.96Å; Y644-Q721 HydrophobicContact CD1-CG 4.43Å; Y644-Q721 HydrophobicContact CE1-CB 3.79Å; Y644-Q721 HydrophobicContact CE1-CG 4.02Å
645	L	98	Very high	94.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.9	173.5	172.6	65.6	0	0	0	109.4	A586 I624 L637 L647 F693 V719 Y720 L722	A586-L645 HydrophobicContact CB-CD1 4.43Å; I624-L645 HydrophobicContact CD1-CD1 3.8Å; I624-L645 HydrophobicContact CG2-CD1 3.84Å; I624-L645 HydrophobicContact CG2-CD2 4.18Å; L637-L645 HydrophobicContact CD1-CB 4.22Å; L637-L645 HydrophobicContact CD1-CD1 4.1Å; L637-L645 HydrophobicContact CD1-CD2 3.96Å; L637-L645 HydrophobicContact CD1-CG 4.32Å; L645-L647 HydrophobicContact CD1-CD2 4.26Å; L645-L647 HydrophobicContact CD2-CD1 4.38Å; L645-L647 HydrophobicContact CD2-CD2 4.12Å; L645-L647 HydrophobicContact CD2-CG 4.17Å; L645-L647 HydrophobicContact CG-CD2 4.18Å; L645-L647 HydrophobicContact CG-CG 4.19Å; L645-F693 HydrophobicContact CD2-CE1 3.74Å; L645-F693 HydrophobicContact CD2-CZ 4.1Å; L645-V719 CarbonylContact O-C 3.43Å; L645-V719 WeakPolarHBondContact O-CA 3.49Å; L645-Y720 PolarHBondContact N-O 3.35Å; L645-Y720 PolarHBondContact O-N 3.05Å; L645-L722 HydrophobicContact CB-CD1 4.12Å
646	I	97.9	Very high	94.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125	172.1	-46	179.1	0	0	0	109.3	L571 I575 F585 A586 L591 L592 V595 F717 V719	L571-I646 HydrophobicContact CD2-CG2 4.35Å; I575-I646 HydrophobicContact CD1-CD1 4.01Å; F585-I646 HydrophobicContact CD1-CD1 3.74Å; F585-I646 HydrophobicContact CD1-CG1 3.84Å; F585-I646 HydrophobicContact CE1-CD1 4.43Å; F585-I646 HydrophobicContact CG-CD1 4.49Å; A586-I646 PolarHBondContact O-N 3.43Å; L591-I646 HydrophobicContact CD2-CB 4.28Å; L591-I646 HydrophobicContact CD2-CD1 4.26Å; L591-I646 HydrophobicContact CD2-CG2 3.57Å; L592-I646 HydrophobicContact CD2-CD1 4.44Å; V595-I646 HydrophobicContact CG2-CD1 3.87Å; I646-F717 HydrophobicContact CG2-CD1 4.32Å; I646-V719 HydrophobicContact CG1-CG2 4.25Å; I646-V719 HydrophobicContact CG2-CG2 4.39Å
647	L	97.1	Very high	93.5	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.016	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139	172.5	-64.4	179.6	0	0	0	110.5	I624 Y625 L645 F693 C694 I697 F717 K718 Y720	I624-L647 HydrophobicContact CB-CD2 4.31Å; I624-L647 HydrophobicContact CD1-CD2 4.03Å; I624-L647 HydrophobicContact CG1-CD2 4.36Å; Y625-L647 HydrophobicContact CE1-CD2 4.48Å; L645-L647 HydrophobicContact CD1-CD2 4.26Å; L645-L647 HydrophobicContact CD2-CD1 4.38Å; L645-L647 HydrophobicContact CD2-CD2 4.12Å; L645-L647 HydrophobicContact CD2-CG 4.17Å; L645-L647 HydrophobicContact CG-CD2 4.18Å; L645-L647 HydrophobicContact CG-CG 4.19Å; L647-F693 HydrophobicContact CD1-CE1 4.4Å; L647-C694 HydrophobicContact CD1-CB 3.92Å; L647-C694 HydrophobicContact CD2-CB 3.91Å; L647-C694 HydrophobicContact CG-CB 4.47Å; L647-I697 HydrophobicContact CD1-CG2 3.52Å; L647-F717 WeakPolarHBondContact O-CA 3.32Å; L647-K718 PolarHBondContact N-O 2.62Å; L647-K718 PolarHBondContact O-N 3.3Å; L647-Y720 HydrophobicContact CD1-CD2 4.15Å; L647-Y720 HydrophobicContact CD1-CE2 3.83Å; L647-Y720 HydrophobicContact CG-CD2 4.5Å; L647-Y720 HydrophobicContact CG-CE2 4.45Å
648	E	95.7	Very high	92.8	Very high	20 Å²	20	59.9 Å²	59.9	9%	0.093	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123	-178.7	-69.2	175.8	-104.9	0	0	109.7	S588 L591 S650 I651 C652 F717	S588-E648 WeakPolarHBondContact CB-OE1 3.47Å; S588-E648 PolarHBondContact OG-OE1 3.05Å; L591-E648 HydrophobicContact CD2-CG 4.05Å; E648-S650 PolarHBondContact O-N 3.13Å; E648-I651 HydrophobicContact CB-CB 4.44Å; E648-I651 HydrophobicContact CB-CD1 4.13Å; E648-I651 HydrophobicContact CB-CG1 4.14Å; E648-I651 PolarHBondContact O-N 3.3Å; E648-I651 VanDerWaalsContact O-N 3.13Å; E648-C652 PolarHBondContact O-N 3.01Å; E648-F717 HydrophobicContact CG-CD1 3.75Å; E648-F717 HydrophobicContact CG-CE1 3.74Å
649	D	93.4	Very high	92.2	Very high	40 Å²	40	55.8 Å²	55.8	21%	0.214	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-34.6	179.4	-76.9	12.2	0	0	0	111.6	I651 C652 Y653 T716 K718	D649-I651 PolarHBondContact O-N 2.93Å; D649-C652 PolarHBondContact O-N 3.45Å; D649-Y653 HydrophobicContact CB-CD2 4.09Å; D649-Y653 WeakPolarHBondContact O-CB 3.26Å; D649-Y653 PolarHBondContact O-N 3.19Å; D649-T716 PolarHBondContact N-O 3.46Å; D649-K718 VanDerWaalsContact CG-CE 3.5Å; D649-K718 VanDerWaalsContact OD1-CD 3.23Å; D649-K718 WeakPolarHBondContact OD1-CD 3.49Å; D649-K718 WeakPolarHBondContact OD1-CE 3.49Å; D649-K718 IonicContact OD1-NZ 2.77Å; D649-K718 PolarHBondContact OD1-NZ 3.32Å; D649-K718 VanDerWaalsContact OD2-CE 3.29Å; D649-K718 WeakPolarHBondContact OD2-CE 3.3Å; D649-K718 IonicContact OD2-NZ 2.94Å; D649-K718 PolarHBondContact OD2-NZ 2.8Å
650	S	91.8	Very high	91.8	Very high	73 Å²	73	52.4 Å²	52.4	51%	0.51	27%	0.267	S	S	.	.	H	α-helix	trans	-58.8	-27.4	177.6	57.4	0	0	0	0	113.6	E648 E654	E648-S650 PolarHBondContact O-N 3.13Å; S650-E654 WeakPolarHBondContact O-CB 3.33Å
651	I	92.9	Very high	91.6	Very high	25 Å²	25	51.7 Å²	51.7	13%	0.128	26%	0.264	C	S	.	.	H	α-helix	trans	-94.6	-42	177.6	-57.8	177.4	0	0	0	110.3	Y625 E648 D649 Y653 E654 L662	Y625-I651 HydrophobicContact CD1-CB 4.36Å; Y625-I651 HydrophobicContact CD1-CG2 3.57Å; Y625-I651 HydrophobicContact CD2-CG2 4.26Å; Y625-I651 HydrophobicContact CE1-CB 3.81Å; Y625-I651 HydrophobicContact CE1-CG2 3.39Å; Y625-I651 HydrophobicContact CE2-CG2 4.09Å; Y625-I651 HydrophobicContact CG-CG2 4.01Å; E648-I651 HydrophobicContact CB-CB 4.44Å; E648-I651 HydrophobicContact CB-CD1 4.13Å; E648-I651 HydrophobicContact CB-CG1 4.14Å; E648-I651 PolarHBondContact O-N 3.3Å; E648-I651 VanDerWaalsContact O-N 3.13Å; D649-I651 PolarHBondContact O-N 2.93Å; I651-Y653 VanDerWaalsContact C-N 3.32Å; I651-Y653 PolarHBondContact O-N 3.45Å; I651-E654 PolarHBondContact O-N 2.53Å; I651-L662 HydrophobicContact CG2-CB 4.23Å; I651-L662 HydrophobicContact CG2-CD2 3.84Å
652	C	92.1	Very high	91.3	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.02	25%	0.251	C	S	.	.	H	α-helix	trans	-68.2	-30.2	-177.4	-76.1	0	0	0	0	114.5	E648 D649 C694 R695	E648-C652 PolarHBondContact O-N 3.01Å; D649-C652 PolarHBondContact O-N 3.45Å; C652-C694 WeakPolarHBondContact CA-SG 3.45Å; C652-C694 HydrophobicContact CB-CB 4.24Å; C652-C694 WeakPolarHBondContact CB-SG 2.83Å; C652-C694 WeakPolarHBondContact SG-CB 3.42Å; C652-C694 CovalentContact SG-SG 2.04Å; C652-C694 PolarHBondContact SG-SG 3.09Å; C652-R695 PolarHBondContact O-NE 2.87Å; C652-R695 PolarHBondContact O-NH2 3.31Å; C652-R695 VanDerWaalsContact O-NH2 3.13Å
653	Y	90.7	Very high	91.1	Very high	117 Å²	117	49.6 Å²	49.6	46%	0.459	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	18	179.5	-60.9	-75.6	0	0	0	112.3	D649 I651 N655 R695 M698	D649-Y653 HydrophobicContact CB-CD2 4.09Å; D649-Y653 WeakPolarHBondContact O-CB 3.26Å; D649-Y653 PolarHBondContact O-N 3.19Å; I651-Y653 VanDerWaalsContact C-N 3.32Å; I651-Y653 PolarHBondContact O-N 3.45Å; Y653-N655 PolarHBondContact O-N 3.45Å; Y653-R695 HydrophobicContact CE1-CG 4.19Å; Y653-M698 HydrophobicContact CE1-CE 4.5Å; Y653-M698 HydrophobicContact CE2-CE 3.69Å; Y653-M698 HydrophobicContact CE2-SD 4.13Å; Y653-M698 VanDerWaalsContact CZ-CE 3.44Å; Y653-M698 WeakPolarHBondContact OH-CE 3.41Å; Y653-M698 PolarHBondContact OH-SD 3.48Å; Y653-M698 VanDerWaalsContact OH-SD 3.38Å
654	E	88.7	Confident	90.7	Very high	49 Å²	49	46.2 Å²	46.2	23%	0.229	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-56.9	130.7	173.9	-165.8	178.3	-164.9	0	0	109.8	S650 I651 K657 S661 L662	S650-E654 WeakPolarHBondContact O-CB 3.33Å; I651-E654 PolarHBondContact O-N 2.53Å; E654-K657 WeakPolarHBondContact OE1-CE 3.19Å; E654-K657 IonicContact OE1-NZ 3.48Å; E654-K657 PolarHBondContact OE1-NZ 3.31Å; E654-S661 VanDerWaalsContact OE2-CB 3.31Å; E654-S661 WeakPolarHBondContact OE2-CB 3.18Å; E654-L662 PolarHBondContact OE2-N 2.82Å
655	N	86.6	Confident	90.4	Very high	131 Å²	131	45.1 Å²	45.1	70%	0.701	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-63.9	140.1	172.9	-70.7	-38.2	0	0	0	109.6	Y653 K657	Y653-N655 PolarHBondContact O-N 3.45Å; N655-K657 PolarHBondContact O-N 2.96Å
656	P	83.1	Confident	90.1	Very high	70 Å²	70	45.1 Å²	45.1	46%	0.455	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-52.3	138	175.8	-26.3	34.6	0	0	0	112
657	K	83.9	Confident	89.8	Confident	117 Å²	117	45.1 Å²	45.1	51%	0.509	24%	0.235	S	C	.	.			trans	-122.6	48.7	-178	-70.8	178.1	178	167.3	0	110.6	E654 N655 G659 C660 E664	E654-K657 WeakPolarHBondContact OE1-CE 3.19Å; E654-K657 IonicContact OE1-NZ 3.48Å; E654-K657 PolarHBondContact OE1-NZ 3.31Å; N655-K657 PolarHBondContact O-N 2.96Å; K657-G659 VanDerWaalsContact C-N 3.31Å; K657-G659 PolarHBondContact O-N 3.09Å; K657-C660 HydrophobicContact CB-CB 4.21Å; K657-C660 WeakPolarHBondContact O-CB 3.33Å; K657-C660 PolarHBondContact O-N 2.61Å; K657-C660 VanDerWaalsContact O-N 3.12Å; K657-E664 PolarHBondContact N-OE2 2.72Å
658	H	83.4	Confident	89.5	Confident	193 Å²	193	45.3 Å²	45.3	89%	0.894	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	46.3	178.4	-56.8	-66.4	0	0	0	113.4	E664	H658-E664 PolarHBondContact N-OE1 3.04Å
659	G	82.2	Confident	89.3	Confident	8 Å²	8	46.8 Å²	46.8	8%	0.082	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	12.2	179.8	0	0	0	0	0	115.3	R399 K657 E664	R399-G659 PolarHBondContact NH1-O 2.85Å; K657-G659 VanDerWaalsContact C-N 3.31Å; K657-G659 PolarHBondContact O-N 3.09Å; G659-E664 PolarHBondContact N-OE1 3.46Å; G659-E664 PolarHBondContact N-OE2 2.92Å
660	C	88	Confident	89.2	Confident	49 Å²	49	46.6 Å²	46.6	33%	0.331	24%	0.242	S	C	.	.			trans	-117.6	-5.5	-177.5	-76.9	0	0	0	0	115.7	C403 K657 E664	C403-C660 VanDerWaalsContact CA-SG 3.58Å; C403-C660 HydrophobicContact CB-CB 3.45Å; C403-C660 VanDerWaalsContact CB-CB 3.45Å; C403-C660 WeakPolarHBondContact CB-SG 3.43Å; C403-C660 WeakPolarHBondContact SG-CA 3.41Å; C403-C660 WeakPolarHBondContact SG-CB 3.45Å; C403-C660 CovalentContact SG-SG 2.04Å; C403-C660 PolarHBondContact SG-SG 3.32Å; K657-C660 HydrophobicContact CB-CB 4.21Å; K657-C660 WeakPolarHBondContact O-CB 3.33Å; K657-C660 PolarHBondContact O-N 2.61Å; K657-C660 VanDerWaalsContact O-N 3.12Å; C660-E664 PolarHBondContact N-OE2 3.27Å
661	S	89.8	Confident	89.1	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.021	23%	0.225	C	C	.	.	S	Bend	trans	-69.5	153.5	166.1	66.5	0	0	0	0	110	E654 A663 E664 I665	E654-S661 VanDerWaalsContact OE2-CB 3.31Å; E654-S661 WeakPolarHBondContact OE2-CB 3.18Å; S661-A663 PolarHBondContact O-N 2.97Å; S661-E664 VanDerWaalsContact CB-OE2 3.3Å; S661-E664 WeakPolarHBondContact CB-OE2 3.17Å; S661-E664 PolarHBondContact N-OE2 3.25Å; S661-E664 PolarHBondContact O-N 3.19Å; S661-E664 VanDerWaalsContact O-N 3.15Å; S661-E664 WeakPolarHBondContact OG-CB 3.37Å; S661-E664 WeakPolarHBondContact OG-CG 3.31Å; S661-E664 PolarHBondContact OG-N 3.02Å; S661-E664 PolarHBondContact OG-OE2 3.08Å; S661-I665 WeakPolarHBondContact O-CG1 3.28Å; S661-I665 PolarHBondContact O-N 2.92Å
662	L	89.7	Confident	89	Confident	23 Å²	23	43.9 Å²	43.9	12%	0.12	22%	0.224	C	C	.	.	H	α-helix	trans	-60.7	-38.2	-177.9	-178.1	58.4	0	0	0	111.8	F396 Y622 Y625 I651 E654 I665 I666	F396-L662 HydrophobicContact CE2-CD1 4.32Å; Y622-L662 HydrophobicContact CD2-CD1 3.67Å; Y622-L662 HydrophobicContact CD2-CD2 3.98Å; Y622-L662 HydrophobicContact CD2-CG 4.39Å; Y622-L662 HydrophobicContact CE2-CD1 3.98Å; Y622-L662 HydrophobicContact CE2-CD2 4Å; Y622-L662 HydrophobicContact CG-CD2 4.43Å; Y625-L662 HydrophobicContact CD2-CD2 3.49Å; Y625-L662 VanDerWaalsContact CD2-CD2 3.49Å; Y625-L662 HydrophobicContact CD2-CG 4.2Å; Y625-L662 HydrophobicContact CE2-CD2 3.68Å; Y625-L662 HydrophobicContact CG-CD2 4.22Å; I651-L662 HydrophobicContact CG2-CB 4.23Å; I651-L662 HydrophobicContact CG2-CD2 3.84Å; E654-L662 PolarHBondContact OE2-N 2.82Å; L662-I665 PolarHBondContact O-N 3.05Å; L662-I666 HydrophobicContact CD1-CG1 4.32Å; L662-I666 WeakPolarHBondContact O-CG1 3.41Å; L662-I666 PolarHBondContact O-N 3.45Å
663	A	91.4	Very high	88.9	Confident	10 Å²	10	44 Å²	44	8%	0.083	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-44.9	175.7	0	0	0	0	0	112.4	S661 I666 D667	S661-A663 PolarHBondContact O-N 2.97Å; A663-I666 PolarHBondContact O-N 2.94Å; A663-D667 WeakPolarHBondContact O-CB 3.46Å; A663-D667 VanDerWaalsContact O-CG 3.25Å; A663-D667 PolarHBondContact O-N 2.94Å
664	E	90.8	Very high	88.8	Confident	11 Å²	11	39 Å²	39	5%	0.051	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-41.2	176.8	-69.1	167.7	114.4	0	0	111.8	K657 H658 G659 C660 S661 I666 D667 L668 P674	K657-E664 PolarHBondContact N-OE2 2.72Å; H658-E664 PolarHBondContact N-OE1 3.04Å; G659-E664 PolarHBondContact N-OE1 3.46Å; G659-E664 PolarHBondContact N-OE2 2.92Å; C660-E664 PolarHBondContact N-OE2 3.27Å; S661-E664 VanDerWaalsContact CB-OE2 3.3Å; S661-E664 WeakPolarHBondContact CB-OE2 3.17Å; S661-E664 PolarHBondContact N-OE2 3.25Å; S661-E664 PolarHBondContact O-N 3.19Å; S661-E664 VanDerWaalsContact O-N 3.15Å; S661-E664 WeakPolarHBondContact OG-CB 3.37Å; S661-E664 WeakPolarHBondContact OG-CG 3.31Å; S661-E664 PolarHBondContact OG-N 3.02Å; S661-E664 PolarHBondContact OG-OE2 3.08Å; E664-I666 VanDerWaalsContact C-N 3.33Å; E664-I666 PolarHBondContact O-N 3.2Å; E664-D667 PolarHBondContact O-N 3.29Å; E664-L668 WeakPolarHBondContact O-CB 3.34Å; E664-L668 VanDerWaalsContact O-CG 3.26Å; E664-L668 WeakPolarHBondContact O-CG 3.5Å; E664-L668 PolarHBondContact O-N 3.46Å; E664-P674 HydrophobicContact CB-CB 4.15Å; E664-P674 HydrophobicContact CG-CB 3.86Å
665	I	90.8	Very high	88.4	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-44	178.4	-64.2	169.7	0	0	0	110.3	F396 R399 C403 S661 L662 L668 E669	F396-I665 HydrophobicContact CD2-CG2 3.62Å; F396-I665 HydrophobicContact CE2-CG2 4.09Å; F396-I665 HydrophobicContact CG-CG2 4.45Å; R399-I665 HydrophobicContact CB-CD1 4.45Å; R399-I665 HydrophobicContact CB-CG1 4.27Å; R399-I665 HydrophobicContact CB-CG2 4.01Å; C403-I665 HydrophobicContact CB-CD1 4.49Å; S661-I665 WeakPolarHBondContact O-CG1 3.28Å; S661-I665 PolarHBondContact O-N 2.92Å; L662-I665 PolarHBondContact O-N 3.05Å; I665-L668 PolarHBondContact O-N 3.21Å; I665-E669 WeakPolarHBondContact O-CB 3.26Å; I665-E669 PolarHBondContact O-N 3.46Å
666	I	92.6	Very high	87.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68	-38.5	177.5	-67.5	-68.2	0	0	0	111.8	F396 L662 A663 E664 N670	F396-I666 HydrophobicContact CD2-CD1 3.74Å; F396-I666 HydrophobicContact CE2-CD1 3.5Å; F396-I666 VanDerWaalsContact CE2-CD1 3.5Å; F396-I666 HydrophobicContact CE2-CG1 4.32Å; F396-I666 HydrophobicContact CZ-CD1 4.48Å; L662-I666 HydrophobicContact CD1-CG1 4.32Å; L662-I666 WeakPolarHBondContact O-CG1 3.41Å; L662-I666 PolarHBondContact O-N 3.45Å; A663-I666 PolarHBondContact O-N 2.94Å; E664-I666 VanDerWaalsContact C-N 3.33Å; E664-I666 PolarHBondContact O-N 3.2Å; I666-N670 WeakPolarHBondContact CG2-ND2 3.35Å; I666-N670 WeakPolarHBondContact O-CB 3.47Å; I666-N670 VanDerWaalsContact O-CG 3.29Å; I666-N670 PolarHBondContact O-N 3.14Å; I666-N670 PolarHBondContact O-ND2 2.75Å
667	D	92	Very high	87.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-47.1	175.3	-75.1	-4.8	0	0	0	110.6	K627 A663 E664 E669 N670 G671 H672 P674 R692	K627-D667 WeakPolarHBondContact CE-OD2 3.33Å; K627-D667 IonicContact NZ-OD2 3.56Å; A663-D667 WeakPolarHBondContact O-CB 3.46Å; A663-D667 VanDerWaalsContact O-CG 3.25Å; A663-D667 PolarHBondContact O-N 2.94Å; E664-D667 PolarHBondContact O-N 3.29Å; D667-E669 PolarHBondContact O-N 3Å; D667-N670 CarbonylContact O-C 3.49Å; D667-N670 PolarHBondContact O-N 3.27Å; D667-G671 PolarHBondContact O-N 2.84Å; D667-H672 CarbonylContact C-O 3.5Å; D667-H672 HydrophobicContact CB-CB 4.12Å; D667-H672 WeakPolarHBondContact O-CA 3.44Å; D667-H672 WeakPolarHBondContact O-CB 3.31Å; D667-H672 PolarHBondContact O-N 3.38Å; D667-P674 HydrophobicContact CB-CB 4.43Å; D667-P674 HydrophobicContact CB-CG 4.32Å; D667-R692 IonicContact OD1-CZ 3.56Å; D667-R692 IonicContact OD1-NH1 3.04Å; D667-R692 PolarHBondContact OD1-NH1 3.48Å; D667-R692 IonicContact OD1-NH2 2.72Å; D667-R692 IonicContact OD2-CZ 2.81Å; D667-R692 IonicContact OD2-NH1 2.58Å; D667-R692 PolarHBondContact OD2-NH1 2.77Å; D667-R692 IonicContact OD2-NH2 3.5Å; D667-R692 PolarHBondContact OD2-NH2 2.95Å
668	L	90.4	Very high	86.8	Confident	7 Å²	7	40 Å²	40	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-63.3	-40.4	179.2	-69.9	172.8	0	0	0	113.3	E664 I665 N670 G671 P674 L682 L685	E664-L668 WeakPolarHBondContact O-CB 3.34Å; E664-L668 VanDerWaalsContact O-CG 3.26Å; E664-L668 WeakPolarHBondContact O-CG 3.5Å; E664-L668 PolarHBondContact O-N 3.46Å; I665-L668 PolarHBondContact O-N 3.21Å; L668-N670 VanDerWaalsContact C-N 3.32Å; L668-G671 PolarHBondContact O-N 2.8Å; L668-P674 HydrophobicContact CD1-CG 4.45Å; L668-P674 HydrophobicContact CD2-CG 3.66Å; L668-P674 HydrophobicContact CG-CG 3.75Å; L668-L682 HydrophobicContact CD2-CD1 4.17Å; L668-L685 HydrophobicContact CD2-CD1 3.73Å; L668-L685 HydrophobicContact CD2-CD2 4.28Å
669	E	90.3	Very high	86.2	Confident	51 Å²	51	33.4 Å²	33.4	24%	0.238	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-39.9	175	177.9	61.4	-149.6	0	0	111.5	F396 K619 I665 D667 G671	F396-E669 HydrophobicContact CB-CB 4.16Å; F396-E669 HydrophobicContact CB-CG 3.9Å; F396-E669 WeakPolarHBondContact CB-OE2 3.46Å; F396-E669 PolarHBondContact N-OE2 2.64Å; K619-E669 VanDerWaalsContact CE-CD 3.41Å; K619-E669 WeakPolarHBondContact CE-OE1 3.26Å; K619-E669 IonicContact NZ-OE1 3.8Å; K619-E669 PolarHBondContact NZ-OE1 3.31Å; I665-E669 WeakPolarHBondContact O-CB 3.26Å; I665-E669 PolarHBondContact O-N 3.46Å; D667-E669 PolarHBondContact O-N 3Å; E669-G671 PolarHBondContact O-N 2.04Å
670	N	92	Very high	85.6	Confident	36 Å²	36	39 Å²	39	19%	0.193	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-0.8	176.8	-73.1	-38.7	0	0	0	113.5	Q623 R628 I666 D667 L668 H672	Q623-N670 PolarHBondContact OE1-ND2 2.94Å; Q623-N670 PolarHBondContact OE1-OD1 3.44Å; Q623-N670 VanDerWaalsContact OE1-OD1 3.08Å; R628-N670 PolarHBondContact NH2-OD1 3.26Å; I666-N670 WeakPolarHBondContact CG2-ND2 3.35Å; I666-N670 WeakPolarHBondContact O-CB 3.47Å; I666-N670 VanDerWaalsContact O-CG 3.29Å; I666-N670 PolarHBondContact O-N 3.14Å; I666-N670 PolarHBondContact O-ND2 2.75Å; D667-N670 CarbonylContact O-C 3.49Å; D667-N670 PolarHBondContact O-N 3.27Å; L668-N670 VanDerWaalsContact C-N 3.32Å; N670-H672 VanDerWaalsContact C-N 3.27Å; N670-H672 PolarHBondContact O-N 3.32Å
671	G	90.1	Very high	84.9	Confident	15 Å²	15	39.8 Å²	39.8	16%	0.155	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	23.4	-174.4	0	0	0	0	0	113.2	D667 L668 E669 L685 T686	D667-G671 PolarHBondContact O-N 2.84Å; L668-G671 PolarHBondContact O-N 2.8Å; E669-G671 PolarHBondContact O-N 2.04Å; G671-L685 CarbonylContact O-C 3.54Å; G671-L685 VanDerWaalsContact O-CA 3.28Å; G671-L685 WeakPolarHBondContact O-CA 3.28Å; G671-T686 PolarHBondContact O-N 3.49Å; G671-T686 PolarHBondContact O-OG1 3.2Å
672	H	91.1	Very high	84.3	Confident	25 Å²	25	43.2 Å²	43.2	12%	0.116	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-96.3	146.7	176.6	-59.8	159.9	0	0	0	111.7	D667 N670 P674 T686	D667-H672 CarbonylContact C-O 3.5Å; D667-H672 HydrophobicContact CB-CB 4.12Å; D667-H672 WeakPolarHBondContact O-CA 3.44Å; D667-H672 WeakPolarHBondContact O-CB 3.31Å; D667-H672 PolarHBondContact O-N 3.38Å; N670-H672 VanDerWaalsContact C-N 3.27Å; N670-H672 PolarHBondContact O-N 3.32Å; H672-P674 WeakPolarHBondContact O-CD 2.98Å; H672-T686 VanDerWaalsContact CA-O 3.3Å; H672-T686 WeakPolarHBondContact CA-O 3.24Å
673	V	89.3	Confident	83.9	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.042	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-69.8	122	169.7	-177	0	0	0	0	109.1	K627 S677 P681 L685 T686	K627-V673 PolarHBondContact NZ-O 3.13Å; K627-V673 VanDerWaalsContact NZ-O 3.13Å; V673-S677 WeakPolarHBondContact CG1-OG 3.46Å; V673-P681 HydrophobicContact CG1-CB 4.46Å; V673-P681 HydrophobicContact CG2-CB 3.83Å; V673-L685 HydrophobicContact CG2-CB 3.65Å; V673-L685 HydrophobicContact CG2-CD1 4.48Å; V673-T686 PolarHBondContact N-O 3.45Å; V673-T686 VanDerWaalsContact N-O 3.1Å
674	P	87.9	Confident	83.5	Confident	12 Å²	12	50.3 Å²	50.3	8%	0.078	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-63.4	148.6	177.3	-20.2	32.8	0	0	0	112.1	E664 D667 L668 H672 G676 S677	E664-P674 HydrophobicContact CB-CB 4.15Å; E664-P674 HydrophobicContact CG-CB 3.86Å; D667-P674 HydrophobicContact CB-CB 4.43Å; D667-P674 HydrophobicContact CB-CG 4.32Å; L668-P674 HydrophobicContact CD1-CG 4.45Å; L668-P674 HydrophobicContact CD2-CG 3.66Å; L668-P674 HydrophobicContact CG-CG 3.75Å; H672-P674 WeakPolarHBondContact O-CD 2.98Å; P674-G676 PolarHBondContact O-N 2.91Å; P674-S677 PolarHBondContact O-N 3.44Å; P674-S677 PolarHBondContact O-OG 3.31Å
675	E	80.4	Confident	83.3	Confident	67 Å²	67	50.8 Å²	50.8	31%	0.313	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	133.4	175.8	-74.5	163.4	-140.7	0	0	110.9	K627 S677 R692 R695	K627-E675 VanDerWaalsContact CE-OE1 3.26Å; K627-E675 WeakPolarHBondContact CE-OE1 3.35Å; K627-E675 IonicContact NZ-OE1 3.87Å; E675-S677 VanDerWaalsContact C-N 3.31Å; E675-S677 PolarHBondContact O-N 3.49Å; E675-R692 IonicContact OE1-CZ 3.31Å; E675-R692 IonicContact OE1-NE 3.98Å; E675-R692 PolarHBondContact OE1-NE 3.4Å; E675-R692 IonicContact OE1-NH2 3.9Å; E675-R692 PolarHBondContact OE1-NH2 3.18Å; E675-R695 IonicContact OE2-CZ 3.68Å; E675-R695 IonicContact OE2-NH1 2.73Å; E675-R695 PolarHBondContact OE2-NH1 3.04Å; E675-R695 IonicContact OE2-NH2 3.9Å
676	G	76.3	Confident	83.3	Confident	66 Å²	66	54.8 Å²	54.8	68%	0.68	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	9.7	178.7	0	0	0	0	0	115.1	P674 E678	P674-G676 PolarHBondContact O-N 2.91Å; G676-E678 PolarHBondContact O-N 2.84Å
677	S	75.9	Confident	83	Confident	56 Å²	56	61.7 Å²	61.7	39%	0.392	39%	0.386	S	S	.	.			trans	-66.1	116.4	173	62	0	0	0	0	110.8	V673 P674 E675	V673-S677 WeakPolarHBondContact CG1-OG 3.46Å; P674-S677 PolarHBondContact O-N 3.44Å; P674-S677 PolarHBondContact O-OG 3.31Å; E675-S677 VanDerWaalsContact C-N 3.31Å; E675-S677 PolarHBondContact O-N 3.49Å
678	E	69.2	Low	82.9	Confident	197 Å²	197	63.6 Å²	63.6	92%	0.921	40%	0.398	S	S	*	.			trans	-85.6	133.5	171.3	-64	-176	173	0	0	110.3	G676	G676-E678 PolarHBondContact O-N 2.84Å
679	G	69.4	Low	82.8	Confident	56 Å²	56	72.3 Å²	72.3	58%	0.577	44%	0.438	S	S	*	.	S	Bend	trans	102.9	173.2	179.3	0	0	0	0	0	114.8
680	P	69.4	Low	82.8	Confident	126 Å²	126	72 Å²	72	82%	0.818	44%	0.44	S	S	*	.	S	Bend	trans	-62.4	133.6	179.5	24.7	-32.1	0	0	0	110.5
681	P	75.1	Confident	82.8	Confident	65 Å²	65	74.1 Å²	74.1	42%	0.422	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-63.7	149.3	-177.7	26.5	-33.9	0	0	0	110.9	V673 L685	V673-P681 HydrophobicContact CG1-CB 4.46Å; V673-P681 HydrophobicContact CG2-CB 3.83Å; P681-L685 HydrophobicContact CB-CB 4.33Å; P681-L685 HydrophobicContact CB-CD1 4.43Å
682	L	77.1	Confident	82.9	Confident	74 Å²	74	73.8 Å²	73.8	39%	0.387	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-53.6	138	173.4	-70.3	166.9	0	0	0	110	R394 L668 G684 L685	R394-L682 PolarHBondContact NH2-O 3.16Å; L668-L682 HydrophobicContact CD2-CD1 4.17Å; L682-G684 PolarHBondContact O-N 2.92Å; L682-G684 VanDerWaalsContact O-N 3.15Å; L682-L685 HydrophobicContact CB-CD1 3.88Å; L682-L685 HydrophobicContact CB-CG 4.15Å; L682-L685 WeakPolarHBondContact O-CG 2.85Å; L682-L685 PolarHBondContact O-N 3.35Å; L682-L685 VanDerWaalsContact O-N 3.12Å
683	P	79.7	Confident	83.1	Confident	121 Å²	121	72.6 Å²	72.6	79%	0.786	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	117.8	-172.4	-28.6	34.2	0	0	0	114	R394	R394-P683 PolarHBondContact NH2-O 3.32Å
684	G	83.4	Confident	83.4	Confident	62 Å²	62	72.4 Å²	72.4	64%	0.639	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	20.5	-179.2	0	0	0	0	0	115.1	R394 L682	R394-G684 PolarHBondContact NH1-O 3.37Å; L682-G684 PolarHBondContact O-N 2.92Å; L682-G684 VanDerWaalsContact O-N 3.15Å
685	L	87.8	Confident	83.6	Confident	20 Å²	20	75.6 Å²	75.6	11%	0.105	45%	0.454	C	S	.	.			trans	-88.7	143.3	161.4	-61.8	-179.9	0	0	0	110.1	L668 G671 V673 P681 L682	L668-L685 HydrophobicContact CD2-CD1 3.73Å; L668-L685 HydrophobicContact CD2-CD2 4.28Å; G671-L685 CarbonylContact O-C 3.54Å; G671-L685 VanDerWaalsContact O-CA 3.28Å; G671-L685 WeakPolarHBondContact O-CA 3.28Å; V673-L685 HydrophobicContact CG2-CB 3.65Å; V673-L685 HydrophobicContact CG2-CD1 4.48Å; P681-L685 HydrophobicContact CB-CB 4.33Å; P681-L685 HydrophobicContact CB-CD1 4.43Å; L682-L685 HydrophobicContact CB-CD1 3.88Å; L682-L685 HydrophobicContact CB-CG 4.15Å; L682-L685 WeakPolarHBondContact O-CG 2.85Å; L682-L685 PolarHBondContact O-N 3.35Å; L682-L685 VanDerWaalsContact O-N 3.12Å
686	T	89.4	Confident	84.2	Confident	88 Å²	88	73.1 Å²	73.1	54%	0.54	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-117.2	146.6	178.1	56.4	0	0	0	0	111.3	G671 H672 V673	G671-T686 PolarHBondContact O-N 3.49Å; G671-T686 PolarHBondContact O-OG1 3.2Å; H672-T686 VanDerWaalsContact CA-O 3.3Å; H672-T686 WeakPolarHBondContact CA-O 3.24Å; V673-T686 PolarHBondContact N-O 3.45Å; V673-T686 VanDerWaalsContact N-O 3.1Å
687	H	87.5	Confident	85.1	Confident	145 Å²	145	70 Å²	70	67%	0.671	41%	0.412	S	S	*	.			trans	-79.2	136	167.1	-70.2	-89.7	0	0	0	109.5
688	T	88.5	Confident	85.7	Confident	40 Å²	40	70 Å²	70	25%	0.245	41%	0.407	C	S	.	.			trans	-114.6	141.5	174.4	179.3	0	0	0	0	109.8	K627 V690	K627-T688 HydrophobicContact CB-CG2 3.6Å; K627-T688 HydrophobicContact CD-CG2 3.28Å; K627-T688 HydrophobicContact CG-CG2 4.04Å; T688-V690 VanDerWaalsContact C-N 3.3Å; T688-V690 PolarHBondContact OG1-N 3.29Å
689	Q	88.3	Confident	86.3	Confident	189 Å²	189	66.8 Å²	66.8	88%	0.883	39%	0.391	S	S	*	.			trans	-83.9	-8.9	174.9	-60.6	-62.8	-15.3	0	0	112.2
690	V	91	Very high	87	Confident	45 Å²	45	66.2 Å²	66.2	27%	0.273	37%	0.374	S	S	.	.	S	Bend	trans	-72	125.4	179	-177.3	0	0	0	0	108.8	K627 T629 T688	K627-V690 WeakPolarHBondContact CB-O 3.32Å; T629-V690 HydrophobicContact CG2-CG1 4.09Å; T629-V690 HydrophobicContact CG2-CG2 4.47Å; T688-V690 VanDerWaalsContact C-N 3.3Å; T688-V690 PolarHBondContact OG1-N 3.29Å
691	P	91.6	Very high	87.5	Confident	81 Å²	81	68.7 Å²	68.7	53%	0.526	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-67.9	159.5	177.5	29.9	-35.7	0	0	0	110.9	F693 A696	P691-F693 PolarHBondContact O-N 3.19Å; P691-A696 HydrophobicContact CB-CB 4.1Å; P691-A696 HydrophobicContact CG-CB 3.84Å
692	R	92.7	Very high	87.9	Confident	8 Å²	8	68.4 Å²	68.4	3%	0.03	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-63.3	125.9	175.1	-169	171	-56	-74.6	-6.4	110.2	Y625 D667 E675 C694 R695 A696	Y625-R692 VanDerWaalsContact O-CD 3.31Å; Y625-R692 WeakPolarHBondContact O-CD 3.29Å; Y625-R692 WeakPolarHBondContact O-CG 3.25Å; Y625-R692 PolarHBondContact O-NH1 3.45Å; D667-R692 IonicContact OD1-CZ 3.56Å; D667-R692 IonicContact OD1-NH1 3.04Å; D667-R692 PolarHBondContact OD1-NH1 3.48Å; D667-R692 IonicContact OD1-NH2 2.72Å; D667-R692 IonicContact OD2-CZ 2.81Å; D667-R692 IonicContact OD2-NH1 2.58Å; D667-R692 PolarHBondContact OD2-NH1 2.77Å; D667-R692 IonicContact OD2-NH2 3.5Å; D667-R692 PolarHBondContact OD2-NH2 2.95Å; E675-R692 IonicContact OE1-CZ 3.31Å; E675-R692 IonicContact OE1-NE 3.98Å; E675-R692 PolarHBondContact OE1-NE 3.4Å; E675-R692 IonicContact OE1-NH2 3.9Å; E675-R692 PolarHBondContact OE1-NH2 3.18Å; R692-C694 PolarHBondContact O-N 2.89Å; R692-R695 HydrophobicContact CB-CG 4.49Å; R692-R695 PolarHBondContact O-N 3.18Å; R692-A696 PolarHBondContact O-N 2.91Å
693	F	95.6	Very high	88.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-53.9	-52.5	-171.7	170.3	-87.1	0	0	0	111.7	I624 G626 V633 L645 L647 P691 R695 A696 I697 F704 F708	I624-F693 HydrophobicContact CB-CD1 4.17Å; I624-F693 HydrophobicContact CB-CE1 4.39Å; I624-F693 HydrophobicContact CG2-CE1 4.42Å; I624-F693 WeakPolarHBondContact O-CB 3.24Å; I624-F693 VanDerWaalsContact O-CD1 3.28Å; I624-F693 WeakPolarHBondContact O-CD1 3.1Å; G626-F693 PolarHBondContact O-N 3.17Å; V633-F693 HydrophobicContact CB-CD2 3.69Å; V633-F693 HydrophobicContact CB-CE2 3.51Å; V633-F693 HydrophobicContact CB-CG 4.29Å; V633-F693 HydrophobicContact CB-CZ 3.98Å; V633-F693 HydrophobicContact CG1-CD1 4.23Å; V633-F693 HydrophobicContact CG1-CD2 4.04Å; V633-F693 HydrophobicContact CG1-CE1 3.85Å; V633-F693 HydrophobicContact CG1-CE2 3.61Å; V633-F693 HydrophobicContact CG1-CG 4.32Å; V633-F693 HydrophobicContact CG1-CZ 3.51Å; V633-F693 HydrophobicContact CG2-CB 4.19Å; V633-F693 HydrophobicContact CG2-CD1 4.37Å; V633-F693 HydrophobicContact CG2-CD2 3.46Å; V633-F693 VanDerWaalsContact CG2-CD2 3.46Å; V633-F693 HydrophobicContact CG2-CE2 3.87Å; V633-F693 HydrophobicContact CG2-CG 3.74Å; V633-F693 HydrophobicContact CG2-CZ 4.48Å; L645-F693 HydrophobicContact CD2-CE1 3.74Å; L645-F693 HydrophobicContact CD2-CZ 4.1Å; L647-F693 HydrophobicContact CD1-CE1 4.4Å; P691-F693 PolarHBondContact O-N 3.19Å; F693-R695 PolarHBondContact O-N 3.17Å; F693-R695 VanDerWaalsContact O-N 3.1Å; F693-A696 PolarHBondContact O-N 3.32Å; F693-A696 VanDerWaalsContact O-N 3.09Å; F693-I697 HydrophobicContact CE1-CB 4.49Å; F693-I697 HydrophobicContact CE1-CD1 3.99Å; F693-I697 HydrophobicContact CE1-CG2 4.41Å; F693-I697 HydrophobicContact CE2-CD1 4.37Å; F693-I697 HydrophobicContact CZ-CB 4.45Å; F693-I697 HydrophobicContact CZ-CD1 3.58Å; F693-I697 WeakPolarHBondContact O-CG2 3.19Å; F693-I697 PolarHBondContact O-N 2.94Å; F693-F704 AromaticContact CD2-CE1 3.63Å; F693-F704 HydrophobicContact CD2-CE1 3.63Å; F693-F704 HydrophobicContact CD2-CZ 4.34Å; F693-F704 HydrophobicContact CE2-CD1 4.17Å; F693-F704 AromaticContact CE2-CE1 3.6Å; F693-F704 HydrophobicContact CE2-CE1 3.6Å; F693-F704 HydrophobicContact CG-CE1 4.49Å; F693-F704 HydrophobicContact CZ-CE1 4.43Å; F693-F708 AromaticContact CE2-CE2 3.78Å; F693-F708 HydrophobicContact CE2-CE2 3.78Å; F693-F708 AromaticContact CE2-CZ 4Å; F693-F708 HydrophobicContact CE2-CZ 4Å; F693-F708 HydrophobicContact CZ-CD2 4.45Å; F693-F708 HydrophobicContact CZ-CE1 4.29Å; F693-F708 AromaticContact CZ-CE2 3.86Å; F693-F708 HydrophobicContact CZ-CE2 3.86Å; F693-F708 AromaticContact CZ-CZ 3.76Å; F693-F708 HydrophobicContact CZ-CZ 3.76Å
694	C	94.8	Very high	89	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.014	34%	0.343	C	S	.	.	H	α-helix	trans	-69.2	-13.2	-174.1	81.6	0	0	0	0	114.3	I624 Y625 L647 C652 R692 M698	I624-C694 WeakPolarHBondContact O-CB 3.28Å; I624-C694 PolarHBondContact O-N 3.22Å; Y625-C694 HydrophobicContact CD1-CB 4.34Å; L647-C694 HydrophobicContact CD1-CB 3.92Å; L647-C694 HydrophobicContact CD2-CB 3.91Å; L647-C694 HydrophobicContact CG-CB 4.47Å; C652-C694 WeakPolarHBondContact CA-SG 3.45Å; C652-C694 HydrophobicContact CB-CB 4.24Å; C652-C694 WeakPolarHBondContact CB-SG 2.83Å; C652-C694 WeakPolarHBondContact SG-CB 3.42Å; C652-C694 CovalentContact SG-SG 2.04Å; C652-C694 PolarHBondContact SG-SG 3.09Å; R692-C694 PolarHBondContact O-N 2.89Å; C694-M698 VanDerWaalsContact O-CE 3.24Å; C694-M698 WeakPolarHBondContact O-CE 3.29Å
695	R	93.4	Very high	89.4	Confident	80 Å²	80	63.4 Å²	63.4	30%	0.302	33%	0.332	S	S	.	.	H	α-helix	trans	-87.1	-46	168.1	-65.4	-174.8	-173.1	159.1	3.6	111.6	C652 Y653 E675 R692 F693 I697 M698	C652-R695 PolarHBondContact O-NE 2.87Å; C652-R695 PolarHBondContact O-NH2 3.31Å; C652-R695 VanDerWaalsContact O-NH2 3.13Å; Y653-R695 HydrophobicContact CE1-CG 4.19Å; E675-R695 IonicContact OE2-CZ 3.68Å; E675-R695 IonicContact OE2-NH1 2.73Å; E675-R695 PolarHBondContact OE2-NH1 3.04Å; E675-R695 IonicContact OE2-NH2 3.9Å; R692-R695 HydrophobicContact CB-CG 4.49Å; R692-R695 PolarHBondContact O-N 3.18Å; F693-R695 PolarHBondContact O-N 3.17Å; F693-R695 VanDerWaalsContact O-N 3.1Å; R695-I697 PolarHBondContact O-N 3.48Å; R695-M698 HydrophobicContact CB-CE 4.39Å; R695-M698 WeakPolarHBondContact O-CE 3.32Å; R695-M698 PolarHBondContact O-N 2.72Å
696	A	93.2	Very high	89.7	Confident	15 Å²	15	72 Å²	72	12%	0.124	36%	0.363	C	S	.	.	H	α-helix	trans	-66.6	-34	-176	0	0	0	0	0	113.7	P691 R692 F693 M698 E699 F704	P691-A696 HydrophobicContact CB-CB 4.1Å; P691-A696 HydrophobicContact CG-CB 3.84Å; R692-A696 PolarHBondContact O-N 2.91Å; F693-A696 PolarHBondContact O-N 3.32Å; F693-A696 VanDerWaalsContact O-N 3.09Å; A696-M698 PolarHBondContact O-N 3.18Å; A696-E699 PolarHBondContact O-N 3.14Å; A696-F704 HydrophobicContact CB-CE1 4.48Å; A696-F704 HydrophobicContact CB-CE2 3.76Å; A696-F704 HydrophobicContact CB-CZ 3.52Å
697	I	94.8	Very high	90	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-63.4	-23	178.8	-168.9	167.4	0	0	0	113.2	L647 F693 R695 E699 M700 F704 F708 Y720	L647-I697 HydrophobicContact CD1-CG2 3.52Å; F693-I697 HydrophobicContact CE1-CB 4.49Å; F693-I697 HydrophobicContact CE1-CD1 3.99Å; F693-I697 HydrophobicContact CE1-CG2 4.41Å; F693-I697 HydrophobicContact CE2-CD1 4.37Å; F693-I697 HydrophobicContact CZ-CB 4.45Å; F693-I697 HydrophobicContact CZ-CD1 3.58Å; F693-I697 WeakPolarHBondContact O-CG2 3.19Å; F693-I697 PolarHBondContact O-N 2.94Å; R695-I697 PolarHBondContact O-N 3.48Å; I697-E699 VanDerWaalsContact C-N 3.25Å; I697-E699 PolarHBondContact O-N 3.13Å; I697-M700 HydrophobicContact CG1-SD 4.19Å; I697-M700 WeakPolarHBondContact O-CG 3.47Å; I697-M700 PolarHBondContact O-N 3.33Å; I697-M700 VanDerWaalsContact O-SD 3.34Å; I697-F704 HydrophobicContact CB-CD1 3.66Å; I697-F704 HydrophobicContact CB-CE1 3.73Å; I697-F704 HydrophobicContact CB-CG 4.49Å; I697-F704 HydrophobicContact CD1-CD1 4.27Å; I697-F704 HydrophobicContact CG1-CD1 3.7Å; I697-F704 HydrophobicContact CG1-CE1 4.26Å; I697-F704 HydrophobicContact CG1-CG 4.46Å; I697-F708 HydrophobicContact CD1-CB 4.01Å; I697-F708 HydrophobicContact CD1-CD1 4.25Å; I697-F708 HydrophobicContact CD1-CD2 4Å; I697-F708 HydrophobicContact CD1-CG 3.81Å; I697-Y720 HydrophobicContact CD1-CD1 3.73Å; I697-Y720 HydrophobicContact CD1-CD2 4.12Å; I697-Y720 HydrophobicContact CD1-CE1 3.88Å; I697-Y720 HydrophobicContact CD1-CE2 4.27Å; I697-Y720 HydrophobicContact CD1-CG 3.84Å; I697-Y720 HydrophobicContact CG1-CD1 4.01Å; I697-Y720 HydrophobicContact CG1-CE1 3.66Å; I697-Y720 HydrophobicContact CG1-CE2 4.45Å; I697-Y720 HydrophobicContact CG2-CE2 4.31Å
698	M	87.3	Confident	90.4	Very high	56 Å²	56	63 Å²	63	28%	0.276	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-67.3	-26	179.6	-82.2	178.1	-75.5	0	0	113.6	Y653 C694 R695 A696 M700	Y653-M698 HydrophobicContact CE1-CE 4.5Å; Y653-M698 HydrophobicContact CE2-CE 3.69Å; Y653-M698 HydrophobicContact CE2-SD 4.13Å; Y653-M698 VanDerWaalsContact CZ-CE 3.44Å; Y653-M698 WeakPolarHBondContact OH-CE 3.41Å; Y653-M698 PolarHBondContact OH-SD 3.48Å; Y653-M698 VanDerWaalsContact OH-SD 3.38Å; C694-M698 VanDerWaalsContact O-CE 3.24Å; C694-M698 WeakPolarHBondContact O-CE 3.29Å; R695-M698 HydrophobicContact CB-CE 4.39Å; R695-M698 WeakPolarHBondContact O-CE 3.32Å; R695-M698 PolarHBondContact O-N 2.72Å; A696-M698 PolarHBondContact O-N 3.18Å; M698-M700 VanDerWaalsContact C-N 3.25Å; M698-M700 PolarHBondContact O-N 3.21Å
699	E	83.6	Confident	90.8	Very high	129 Å²	129	67.8 Å²	67.8	60%	0.603	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-73.9	-20.6	177.5	-64.7	-173.3	-170.1	0	0	112.2	A696 I697 R701	A696-E699 PolarHBondContact O-N 3.14Å; I697-E699 VanDerWaalsContact C-N 3.25Å; I697-E699 PolarHBondContact O-N 3.13Å; E699-R701 VanDerWaalsContact C-N 3.3Å; E699-R701 HydrophobicContact CB-CB 4.44Å; E699-R701 HydrophobicContact CB-CG 4.27Å; E699-R701 WeakPolarHBondContact O-CG 3.42Å; E699-R701 PolarHBondContact O-N 3.34Å
700	M	83.6	Confident	91.1	Very high	44 Å²	44	62.1 Å²	62.1	22%	0.217	30%	0.302	C	S	.	.			trans	44.7	57.5	-175.5	-69.8	-59.3	-68.5	0	0	110.6	I697 M698 D705 F708 Y720	I697-M700 HydrophobicContact CG1-SD 4.19Å; I697-M700 WeakPolarHBondContact O-CG 3.47Å; I697-M700 PolarHBondContact O-N 3.33Å; I697-M700 VanDerWaalsContact O-SD 3.34Å; M698-M700 VanDerWaalsContact C-N 3.25Å; M698-M700 PolarHBondContact O-N 3.21Å; M700-D705 VanDerWaalsContact C-OD1 3.25Å; M700-D705 WeakPolarHBondContact CA-OD1 3.45Å; M700-D705 WeakPolarHBondContact CB-OD1 3.3Å; M700-D705 WeakPolarHBondContact CE-OD1 3.38Å; M700-D705 VanDerWaalsContact O-OD1 3.13Å; M700-F708 WeakPolarHBondContact CE-O 3.45Å; M700-Y720 HydrophobicContact SD-CD1 4.17Å; M700-Y720 HydrophobicContact SD-CE1 3.69Å
701	R	80.1	Confident	91.4	Very high	179 Å²	179	63.6 Å²	63.6	68%	0.675	31%	0.307	S	S	*	.			trans	-125.9	145.1	-179	-76.4	176.1	-178	-174.7	-2.2	110.8	E699 S703 F704	E699-R701 VanDerWaalsContact C-N 3.3Å; E699-R701 HydrophobicContact CB-CB 4.44Å; E699-R701 HydrophobicContact CB-CG 4.27Å; E699-R701 WeakPolarHBondContact O-CG 3.42Å; E699-R701 PolarHBondContact O-N 3.34Å; R701-S703 PolarHBondContact O-N 3.45Å; R701-F704 WeakPolarHBondContact O-CD2 3.18Å
702	G	83.3	Confident	91.7	Very high	58 Å²	58	60.7 Å²	60.7	60%	0.598	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	-119.6	169.9	0	0	0	0	0	112.9	F704	G702-F704 VanDerWaalsContact C-N 3.33Å; G702-F704 PolarHBondContact O-N 2.95Å
703	S	87.6	Confident	91.8	Very high	55 Å²	55	67.3 Å²	67.3	39%	0.385	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.3	-176.1	54	0	0	0	0	113.5	R701 D705 R706 Y707	R701-S703 PolarHBondContact O-N 3.45Å; S703-D705 PolarHBondContact O-N 3.09Å; S703-R706 PolarHBondContact O-N 2.95Å; S703-Y707 WeakPolarHBondContact O-CD2 3.45Å
704	F	92.5	Very high	91.8	Very high	22 Å²	22	68.2 Å²	68.2	10%	0.096	32%	0.32	C	S	.	.	H	α-helix	trans	-63.3	-41.3	-177.8	-71.8	-83.6	0	0	0	112.9	A630 F693 A696 I697 R701 G702 R706 Y707 F708	A630-F704 HydrophobicContact CB-CD1 3.57Å; A630-F704 HydrophobicContact CB-CD2 4.32Å; A630-F704 HydrophobicContact CB-CE1 3.73Å; A630-F704 HydrophobicContact CB-CE2 4.43Å; A630-F704 HydrophobicContact CB-CG 3.9Å; A630-F704 HydrophobicContact CB-CZ 4.15Å; F693-F704 AromaticContact CD2-CE1 3.63Å; F693-F704 HydrophobicContact CD2-CE1 3.63Å; F693-F704 HydrophobicContact CD2-CZ 4.34Å; F693-F704 HydrophobicContact CE2-CD1 4.17Å; F693-F704 AromaticContact CE2-CE1 3.6Å; F693-F704 HydrophobicContact CE2-CE1 3.6Å; F693-F704 HydrophobicContact CG-CE1 4.49Å; F693-F704 HydrophobicContact CZ-CE1 4.43Å; A696-F704 HydrophobicContact CB-CE1 4.48Å; A696-F704 HydrophobicContact CB-CE2 3.76Å; A696-F704 HydrophobicContact CB-CZ 3.52Å; I697-F704 HydrophobicContact CB-CD1 3.66Å; I697-F704 HydrophobicContact CB-CE1 3.73Å; I697-F704 HydrophobicContact CB-CG 4.49Å; I697-F704 HydrophobicContact CD1-CD1 4.27Å; I697-F704 HydrophobicContact CG1-CD1 3.7Å; I697-F704 HydrophobicContact CG1-CE1 4.26Å; I697-F704 HydrophobicContact CG1-CG 4.46Å; R701-F704 WeakPolarHBondContact O-CD2 3.18Å; G702-F704 VanDerWaalsContact C-N 3.33Å; G702-F704 PolarHBondContact O-N 2.95Å; F704-R706 PolarHBondContact O-N 3.29Å; F704-Y707 PolarHBondContact O-N 3.1Å; F704-Y707 VanDerWaalsContact O-N 3.09Å; F704-F708 HydrophobicContact CD1-CD2 4.43Å; F704-F708 PolarHBondContact O-N 3.06Å
705	D	91.5	Very high	91.7	Very high	76 Å²	76	76.5 Å²	76.5	41%	0.406	36%	0.356	S	S	.	.	H	α-helix	trans	-65.9	-20.2	-179.1	-58.9	-37	0	0	0	113.8	M700 S703 L723	M700-D705 VanDerWaalsContact C-OD1 3.25Å; M700-D705 WeakPolarHBondContact CA-OD1 3.45Å; M700-D705 WeakPolarHBondContact CB-OD1 3.3Å; M700-D705 WeakPolarHBondContact CE-OD1 3.38Å; M700-D705 VanDerWaalsContact O-OD1 3.13Å; S703-D705 PolarHBondContact O-N 3.09Å; D705-L723 WeakPolarHBondContact O-CD1 3.48Å
706	R	93.4	Very high	91.8	Very high	199 Å²	199	74.8 Å²	74.8	75%	0.751	35%	0.354	S	S	*	.	H	α-helix	trans	-76.3	-27.2	176.5	-62.2	-175.9	-179.2	-177.2	-0.9	112.5	S703 F704	S703-R706 PolarHBondContact O-N 2.95Å; F704-R706 PolarHBondContact O-N 3.29Å
707	Y	95.6	Very high	91.9	Very high	43 Å²	43	74.4 Å²	74.4	17%	0.169	35%	0.35	C	S	.	.	H	α-helix	trans	-113.9	-24.5	-170.2	-67.5	-64.4	0	0	0	113.3	A630 E631 Y634 S703 F704 L723	A630-Y707 HydrophobicContact CB-CD2 4.03Å; E631-Y707 HydrophobicContact CB-CE2 3.74Å; E631-Y707 HydrophobicContact CG-CE2 4.34Å; E631-Y707 WeakPolarHBondContact CG-OH 3.34Å; Y634-Y707 AromaticContact CD1-CD1 3.52Å; Y634-Y707 HydrophobicContact CD1-CD1 3.52Å; Y634-Y707 AromaticContact CD1-CE1 3.9Å; Y634-Y707 HydrophobicContact CD1-CE1 3.9Å; Y634-Y707 HydrophobicContact CD1-CG 4.46Å; Y634-Y707 AromaticContact CD2-CD1 3.7Å; Y634-Y707 HydrophobicContact CD2-CD1 3.7Å; Y634-Y707 HydrophobicContact CD2-CG 4.07Å; Y634-Y707 WeakPolarHBondContact CD2-O 3.26Å; Y634-Y707 AromaticContact CE1-CD1 3.96Å; Y634-Y707 HydrophobicContact CE1-CD1 3.96Å; Y634-Y707 HydrophobicContact CE1-CE1 4.31Å; Y634-Y707 HydrophobicContact CE2-CD1 4.09Å; Y634-Y707 AromaticContact CG-CD1 3.38Å; Y634-Y707 HydrophobicContact CG-CD1 3.38Å; Y634-Y707 HydrophobicContact CG-CE1 4.17Å; Y634-Y707 AromaticContact CG-CG 3.9Å; Y634-Y707 HydrophobicContact CG-CG 3.9Å; S703-Y707 WeakPolarHBondContact O-CD2 3.45Å; F704-Y707 PolarHBondContact O-N 3.1Å; F704-Y707 VanDerWaalsContact O-N 3.09Å; Y707-L723 PolarHBondContact O-N 3.37Å
708	F	97	Very high	92	Very high	2 Å²	2	74.8 Å²	74.8	1%	0.009	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	149.3	-173.1	-57.8	-81.5	0	0	0	111.7	A630 V633 Y634 L637 F693 I697 M700 F704 Y720 Q721 L722	A630-F708 HydrophobicContact CB-CE2 4.34Å; V633-F708 HydrophobicContact CG1-CZ 4.28Å; Y634-F708 HydrophobicContact CD2-CZ 4.39Å; L637-F708 HydrophobicContact CD1-CE1 4.21Å; F693-F708 AromaticContact CE2-CE2 3.78Å; F693-F708 HydrophobicContact CE2-CE2 3.78Å; F693-F708 AromaticContact CE2-CZ 4Å; F693-F708 HydrophobicContact CE2-CZ 4Å; F693-F708 HydrophobicContact CZ-CD2 4.45Å; F693-F708 HydrophobicContact CZ-CE1 4.29Å; F693-F708 AromaticContact CZ-CE2 3.86Å; F693-F708 HydrophobicContact CZ-CE2 3.86Å; F693-F708 AromaticContact CZ-CZ 3.76Å; F693-F708 HydrophobicContact CZ-CZ 3.76Å; I697-F708 HydrophobicContact CD1-CB 4.01Å; I697-F708 HydrophobicContact CD1-CD1 4.25Å; I697-F708 HydrophobicContact CD1-CD2 4Å; I697-F708 HydrophobicContact CD1-CG 3.81Å; M700-F708 WeakPolarHBondContact CE-O 3.45Å; F704-F708 HydrophobicContact CD1-CD2 4.43Å; F704-F708 PolarHBondContact O-N 3.06Å; F708-Y720 HydrophobicContact CB-CD1 4.33Å; F708-Q721 CarbonylContact C-O 3.32Å; F708-Q721 VanDerWaalsContact CA-O 3.31Å; F708-Q721 WeakPolarHBondContact CA-O 3.48Å; F708-L722 HydrophobicContact CD1-CD1 4.3Å; F708-L722 HydrophobicContact CD1-CG 4.19Å; F708-L722 HydrophobicContact CE1-CD1 4.11Å; F708-L722 HydrophobicContact CE1-CG 3.88Å
709	R	95.6	Very high	92.5	Very high	141 Å²	141	72.1 Å²	72.1	53%	0.532	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	128.5	171.1	179.9	179.9	-64.9	173.3	1.6	110	M711 Y720 Q721 L723	R709-M711 HydrophobicContact CG-SD 4.08Å; R709-M711 PolarHBondContact O-N 3.31Å; R709-Y720 CarbonylContact O-C 3.57Å; R709-Y720 VanDerWaalsContact O-CA 3.28Å; R709-Y720 WeakPolarHBondContact O-CA 3.19Å; R709-Q721 PolarHBondContact N-O 3.1Å; R709-Q721 PolarHBondContact O-N 3.23Å; R709-L723 HydrophobicContact CB-CD1 4.32Å; R709-L723 HydrophobicContact CB-CD2 3.85Å; R709-L723 HydrophobicContact CB-CG 4.22Å
710	I	95.7	Very high	93.2	Very high	69 Å²	69	66.1 Å²	66.1	35%	0.354	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	130	175.2	-165.1	167.3	0	0	0	110.1	K713 Y720	I710-K713 HydrophobicContact CD1-CB 4.08Å; I710-K713 HydrophobicContact CD1-CD 4.11Å; I710-Y720 HydrophobicContact CB-CD1 4.07Å; I710-Y720 HydrophobicContact CB-CE1 3.91Å; I710-Y720 HydrophobicContact CD1-CE1 4.3Å; I710-Y720 HydrophobicContact CG1-CD1 4.47Å; I710-Y720 HydrophobicContact CG1-CE1 4.15Å
711	M	96.4	Very high	93.8	Very high	77 Å²	77	66.7 Å²	66.7	38%	0.379	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	-28.9	-176.7	-64.2	-58.1	-64.3	0	0	113	W574 Y644 R709 V719 Q721	W574-M711 HydrophobicContact CH2-CB 3.82Å; W574-M711 HydrophobicContact CZ2-CB 3.66Å; Y644-M711 HydrophobicContact CE1-CG 4.18Å; R709-M711 HydrophobicContact CG-SD 4.08Å; R709-M711 PolarHBondContact O-N 3.31Å; M711-V719 PolarHBondContact N-O 3.46Å; M711-Q721 HydrophobicContact CG-CB 3.57Å; M711-Q721 HydrophobicContact SD-CB 4.24Å
712	F	97.2	Very high	94.6	Very high	20 Å²	20	59 Å²	59	9%	0.088	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	143.3	177.6	176.3	-92	0	0	0	110	D570 L571 W574 N714 K718 V719	D570-F712 HydrophobicContact CB-CZ 4.32Å; D570-F712 WeakPolarHBondContact OD2-CZ 3.45Å; L571-F712 HydrophobicContact CB-CE1 4.11Å; L571-F712 HydrophobicContact CB-CZ 4.36Å; L571-F712 HydrophobicContact CD1-CD1 3.88Å; L571-F712 HydrophobicContact CD1-CE1 3.85Å; W574-F712 HydrophobicContact CB-CD2 3.71Å; W574-F712 HydrophobicContact CB-CE2 3.76Å; W574-F712 HydrophobicContact CB-CG 4.5Å; W574-F712 AromaticContact CD1-CD2 3.62Å; W574-F712 HydrophobicContact CD2-CB 3.64Å; W574-F712 AromaticContact CD2-CD2 3.73Å; W574-F712 HydrophobicContact CD2-CD2 3.73Å; W574-F712 AromaticContact CD2-CG 3.87Å; W574-F712 HydrophobicContact CD2-CG 3.87Å; W574-F712 HydrophobicContact CE3-CB 3.83Å; W574-F712 HydrophobicContact CE3-CD2 4.36Å; W574-F712 HydrophobicContact CE3-CG 4.1Å; W574-F712 HydrophobicContact CG-CB 4.22Å; W574-F712 AromaticContact CG-CD2 3.37Å; W574-F712 HydrophobicContact CG-CD2 3.37Å; W574-F712 AromaticContact CG-CE2 3.95Å; W574-F712 HydrophobicContact CG-CE2 3.95Å; W574-F712 HydrophobicContact CG-CG 4.01Å; W574-F712 HydrophobicContact CH2-CB 4.13Å; W574-F712 HydrophobicContact CZ2-CB 3.94Å; W574-F712 HydrophobicContact CZ3-CB 4.08Å; F712-N714 HydrophobicContact CE1-CB 4.02Å; F712-N714 WeakPolarHBondContact CE1-ND2 3.16Å; F712-N714 HydrophobicContact CZ-CB 3.98Å; F712-N714 WeakPolarHBondContact CZ-ND2 3.34Å; F712-K718 WeakPolarHBondContact O-CA 3.35Å; F712-V719 HydrophobicContact CB-CB 3.98Å; F712-V719 HydrophobicContact CB-CG2 4.02Å; F712-V719 HydrophobicContact CD1-CG2 3.99Å; F712-V719 HydrophobicContact CG-CG2 4.42Å; F712-V719 PolarHBondContact N-O 3.49Å; F712-V719 PolarHBondContact O-N 3.3Å
713	K	95.8	Very high	95.1	Very high	146 Å²	146	60.8 Å²	60.8	64%	0.635	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150	122.9	176.7	178.3	173.7	-180	179.8	0	109.3	I710 K718	I710-K713 HydrophobicContact CD1-CB 4.08Å; I710-K713 HydrophobicContact CD1-CD 4.11Å; K713-K718 HydrophobicContact CB-CG 4.45Å; K713-K718 HydrophobicContact CD-CG 4.48Å; K713-K718 HydrophobicContact CG-CG 3.99Å
714	N	95.4	Very high	95.5	Very high	20 Å²	20	61.1 Å²	61.1	11%	0.107	27%	0.274	C	S	.	.			trans	-126.8	-168.4	162.6	70.6	18.1	0	0	0	110	D567 F712 T716 F717 K718	D567-N714 WeakPolarHBondContact CA-ND2 3.27Å; D567-N714 PolarHBondContact O-ND2 3.09Å; F712-N714 HydrophobicContact CE1-CB 4.02Å; F712-N714 WeakPolarHBondContact CE1-ND2 3.16Å; F712-N714 HydrophobicContact CZ-CB 3.98Å; F712-N714 WeakPolarHBondContact CZ-ND2 3.34Å; N714-T716 VanDerWaalsContact C-N 3.31Å; N714-T716 PolarHBondContact O-N 2.73Å; N714-T716 PolarHBondContact OD1-N 2.81Å; N714-T716 VanDerWaalsContact OD1-N 3.11Å; N714-F717 PolarHBondContact N-O 3.48Å; N714-F717 PolarHBondContact OD1-N 3.48Å; N714-F717 PolarHBondContact OD1-O 3.21Å; N714-K718 PolarHBondContact O-NZ 3.12Å
715	K	93.5	Very high	95.7	Very high	175 Å²	175	63.1 Å²	63.1	76%	0.761	28%	0.284	S	S	*	.	S	Bend	trans	-62	-40.2	-175.4	-64.9	176.6	-179.8	176.5	0	111.4	D567 K718	D567-K715 WeakPolarHBondContact OD2-CB 3.5Å; K715-K718 PolarHBondContact O-NZ 3.15Å
716	T	94.3	Very high	95.9	Very high	45 Å²	45	62.4 Å²	62.4	28%	0.276	28%	0.277	S	S	.	.	S	Bend	trans	-95.1	-39.7	-174.8	-59.3	0	0	0	0	113.2	D567 D649 N714	D567-T716 WeakPolarHBondContact OD2-CB 3.48Å; D567-T716 PolarHBondContact OD2-N 3.5Å; D567-T716 PolarHBondContact OD2-OG1 3.19Å; D649-T716 PolarHBondContact N-O 3.46Å; N714-T716 VanDerWaalsContact C-N 3.31Å; N714-T716 PolarHBondContact O-N 2.73Å; N714-T716 PolarHBondContact OD1-N 2.81Å; N714-T716 VanDerWaalsContact OD1-N 3.11Å
717	F	96.7	Very high	96	Very high	7 Å²	7	54.4 Å²	54.4	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.3	-167.9	-52.3	-74.8	0	0	0	112.8	D567 T568 L571 L591 I646 L647 E648 N714	D567-F717 HydrophobicContact CB-CD2 4.18Å; D567-F717 HydrophobicContact CB-CE2 4.03Å; T568-F717 WeakPolarHBondContact OG1-CE2 3.12Å; T568-F717 WeakPolarHBondContact OG1-CZ 3.25Å; L571-F717 HydrophobicContact CB-CD2 4.13Å; L571-F717 HydrophobicContact CD1-CB 4.43Å; L571-F717 HydrophobicContact CD2-CB 4.12Å; L571-F717 HydrophobicContact CD2-CD1 3.93Å; L571-F717 HydrophobicContact CD2-CD2 3.84Å; L571-F717 HydrophobicContact CD2-CE1 4.3Å; L571-F717 HydrophobicContact CD2-CE2 4.23Å; L571-F717 HydrophobicContact CD2-CG 3.68Å; L571-F717 HydrophobicContact CD2-CZ 4.44Å; L591-F717 HydrophobicContact CD1-CE1 3.94Å; L591-F717 HydrophobicContact CD1-CZ 4.17Å; L591-F717 HydrophobicContact CD2-CD1 3.81Å; L591-F717 HydrophobicContact CD2-CE1 3.64Å; L591-F717 HydrophobicContact CG-CE1 4.43Å; I646-F717 HydrophobicContact CG2-CD1 4.32Å; L647-F717 WeakPolarHBondContact O-CA 3.32Å; E648-F717 HydrophobicContact CG-CD1 3.75Å; E648-F717 HydrophobicContact CG-CE1 3.74Å; N714-F717 PolarHBondContact N-O 3.48Å; N714-F717 PolarHBondContact OD1-N 3.48Å; N714-F717 PolarHBondContact OD1-O 3.21Å
718	K	96.7	Very high	96.1	Very high	8 Å²	8	55.1 Å²	55.1	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.6	166.5	-61.6	98.5	-172.5	105.9	0	109.3	L647 D649 F712 K713 N714 K715 Y720	L647-K718 PolarHBondContact N-O 2.62Å; L647-K718 PolarHBondContact O-N 3.3Å; D649-K718 VanDerWaalsContact CG-CE 3.5Å; D649-K718 VanDerWaalsContact OD1-CD 3.23Å; D649-K718 WeakPolarHBondContact OD1-CD 3.49Å; D649-K718 WeakPolarHBondContact OD1-CE 3.49Å; D649-K718 IonicContact OD1-NZ 2.77Å; D649-K718 PolarHBondContact OD1-NZ 3.32Å; D649-K718 VanDerWaalsContact OD2-CE 3.29Å; D649-K718 WeakPolarHBondContact OD2-CE 3.3Å; D649-K718 IonicContact OD2-NZ 2.94Å; D649-K718 PolarHBondContact OD2-NZ 2.8Å; F712-K718 WeakPolarHBondContact O-CA 3.35Å; K713-K718 HydrophobicContact CB-CG 4.45Å; K713-K718 HydrophobicContact CD-CG 4.48Å; K713-K718 HydrophobicContact CG-CG 3.99Å; N714-K718 PolarHBondContact O-NZ 3.12Å; K715-K718 PolarHBondContact O-NZ 3.15Å; K718-Y720 HydrophobicContact CB-CD2 4.42Å; K718-Y720 HydrophobicContact CB-CE2 3.64Å
719	V	97.6	Very high	96	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.5	177.4	-170.9	0	0	0	0	109.7	L571 W574 F585 Y644 L645 I646 M711 F712	L571-V719 HydrophobicContact CD1-CG2 3.51Å; W574-V719 HydrophobicContact CE3-CG2 4.4Å; W574-V719 HydrophobicContact CH2-CB 4.23Å; W574-V719 HydrophobicContact CH2-CG1 3.97Å; W574-V719 HydrophobicContact CZ3-CB 3.97Å; W574-V719 HydrophobicContact CZ3-CG1 3.78Å; W574-V719 HydrophobicContact CZ3-CG2 3.98Å; F585-V719 HydrophobicContact CE1-CG1 4.35Å; Y644-V719 HydrophobicContact CD1-CG1 4.03Å; Y644-V719 HydrophobicContact CG-CG1 4.37Å; L645-V719 CarbonylContact O-C 3.43Å; L645-V719 WeakPolarHBondContact O-CA 3.49Å; I646-V719 HydrophobicContact CG1-CG2 4.25Å; I646-V719 HydrophobicContact CG2-CG2 4.39Å; M711-V719 PolarHBondContact N-O 3.46Å; F712-V719 HydrophobicContact CB-CB 3.98Å; F712-V719 HydrophobicContact CB-CG2 4.02Å; F712-V719 HydrophobicContact CD1-CG2 3.99Å; F712-V719 HydrophobicContact CG-CG2 4.42Å; F712-V719 PolarHBondContact N-O 3.49Å; F712-V719 PolarHBondContact O-N 3.3Å
720	Y	97.5	Very high	96	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129	177.4	-63.4	-94.1	0	0	0	109.8	Y644 L645 L647 I697 M700 F708 R709 I710 K718	Y644-Y720 CarbonylContact C-O 3.42Å; Y644-Y720 VanDerWaalsContact CA-O 3.32Å; Y644-Y720 WeakPolarHBondContact CA-O 3.28Å; L645-Y720 PolarHBondContact N-O 3.35Å; L645-Y720 PolarHBondContact O-N 3.05Å; L647-Y720 HydrophobicContact CD1-CD2 4.15Å; L647-Y720 HydrophobicContact CD1-CE2 3.83Å; L647-Y720 HydrophobicContact CG-CD2 4.5Å; L647-Y720 HydrophobicContact CG-CE2 4.45Å; I697-Y720 HydrophobicContact CD1-CD1 3.73Å; I697-Y720 HydrophobicContact CD1-CD2 4.12Å; I697-Y720 HydrophobicContact CD1-CE1 3.88Å; I697-Y720 HydrophobicContact CD1-CE2 4.27Å; I697-Y720 HydrophobicContact CD1-CG 3.84Å; I697-Y720 HydrophobicContact CG1-CD1 4.01Å; I697-Y720 HydrophobicContact CG1-CE1 3.66Å; I697-Y720 HydrophobicContact CG1-CE2 4.45Å; I697-Y720 HydrophobicContact CG2-CE2 4.31Å; M700-Y720 HydrophobicContact SD-CD1 4.17Å; M700-Y720 HydrophobicContact SD-CE1 3.69Å; F708-Y720 HydrophobicContact CB-CD1 4.33Å; R709-Y720 CarbonylContact O-C 3.57Å; R709-Y720 VanDerWaalsContact O-CA 3.28Å; R709-Y720 WeakPolarHBondContact O-CA 3.19Å; I710-Y720 HydrophobicContact CB-CD1 4.07Å; I710-Y720 HydrophobicContact CB-CE1 3.91Å; I710-Y720 HydrophobicContact CD1-CE1 4.3Å; I710-Y720 HydrophobicContact CG1-CD1 4.47Å; I710-Y720 HydrophobicContact CG1-CE1 4.15Å; K718-Y720 HydrophobicContact CB-CD2 4.42Å; K718-Y720 HydrophobicContact CB-CE2 3.64Å
721	Q	97.4	Very high	96.1	Very high	57 Å²	57	51.5 Å²	51.5	27%	0.266	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137.7	166.1	-178.6	174.9	22.9	0	0	109.4	Y644 F708 R709 M711	Y644-Q721 HydrophobicContact CD1-CB 3.96Å; Y644-Q721 HydrophobicContact CD1-CG 4.43Å; Y644-Q721 HydrophobicContact CE1-CB 3.79Å; Y644-Q721 HydrophobicContact CE1-CG 4.02Å; F708-Q721 CarbonylContact C-O 3.32Å; F708-Q721 VanDerWaalsContact CA-O 3.31Å; F708-Q721 WeakPolarHBondContact CA-O 3.48Å; R709-Q721 PolarHBondContact N-O 3.1Å; R709-Q721 PolarHBondContact O-N 3.23Å; M711-Q721 HydrophobicContact CG-CB 3.57Å; M711-Q721 HydrophobicContact SD-CB 4.24Å
722	L	96.6	Very high	96.1	Very high	17 Å²	17	49.3 Å²	49.3	9%	0.089	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.8	168.3	-77.7	72.1	0	0	0	108.8	Y634 L637 T642 H643 L645 F708	Y634-L722 HydrophobicContact CD2-CD2 4.44Å; Y634-L722 HydrophobicContact CD2-CG 4.41Å; Y634-L722 HydrophobicContact CE2-CB 4.2Å; L637-L722 HydrophobicContact CB-CD2 3.56Å; L637-L722 HydrophobicContact CD1-CD1 4.31Å; L637-L722 HydrophobicContact CD1-CD2 4.21Å; T642-L722 HydrophobicContact CG2-CD1 4.2Å; T642-L722 HydrophobicContact CG2-CD2 4.47Å; H643-L722 PolarHBondContact O-N 2.64Å; L645-L722 HydrophobicContact CB-CD1 4.12Å; F708-L722 HydrophobicContact CD1-CD1 4.3Å; F708-L722 HydrophobicContact CD1-CG 4.19Å; F708-L722 HydrophobicContact CE1-CD1 4.11Å; F708-L722 HydrophobicContact CE1-CG 3.88Å
723	L	94	Very high	96	Very high	95 Å²	95	52 Å²	52	50%	0.497	25%	0.246	S	C	.	.			trans	-84.2	0	-175.3	-66.5	179.8	0	0	0	114	Y634 D705 Y707 R709	Y634-L723 WeakPolarHBondContact CE2-O 3.33Å; Y634-L723 VanDerWaalsContact CZ-O 3.24Å; Y634-L723 PolarHBondContact OH-O 2.91Å; D705-L723 WeakPolarHBondContact O-CD1 3.48Å; Y707-L723 PolarHBondContact O-N 3.37Å; R709-L723 HydrophobicContact CB-CD1 4.32Å; R709-L723 HydrophobicContact CB-CD2 3.85Å; R709-L723 HydrophobicContact CB-CG 4.22Å

Retrieved 723 of 723 residues in 237.4 ms (Link to these results)

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