A0A096ND93_PAPAN Loading...

AarF domain containing kinase 5

AlphaFold DB , UniProt , Accession A0A096ND93, Species PAPAN (Papio anubis, Olive baboon), Gene ADCK5, Length 580 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	35.5	Very low	35.2	Very low	244 Å²	244	183.9 Å²	183.9	100%	1.202	88%	0.876	S	S	*	*				0	103.9	0	-94.5	165	59.9	0	0	108.8
2	W	27.7	Very low	35.4	Very low	247 Å²	247	176.8 Å²	176.8	94%	0.936	86%	0.861	S	S	*	*			trans	-81.8	141.1	166.8	-82	31.1	0	0	0	109.5
3	R	30.5	Very low	35.4	Very low	246 Å²	246	170.5 Å²	170.5	93%	0.928	86%	0.855	S	S	*	*			trans	-152.3	129.5	132.1	-103.5	-173.9	-173.6	-166.4	1.8	109.5
4	P	37.5	Very low	35.6	Very low	110 Å²	110	170.1 Å²	170.1	71%	0.714	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-91.8	152.6	-179.9	36.3	-32.4	0	0	0	111.5
5	L	32.6	Very low	35.5	Very low	176 Å²	176	168.7 Å²	168.7	92%	0.921	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-97.9	127.9	163.3	-96.1	157.6	0	0	0	109.4
6	Q	37	Very low	35.4	Very low	188 Å²	188	169.6 Å²	169.6	88%	0.879	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-66.6	131.4	-178.8	-67.7	163.6	-44.1	0	0	111.2
7	L	34	Very low	35	Very low	171 Å²	171	166.6 Å²	166.6	90%	0.895	85%	0.849	S	S	*	*			trans	-125.7	137.4	157.3	-96.9	159.6	0	0	0	109.1
8	C	36.8	Very low	35	Very low	114 Å²	114	170.7 Å²	170.7	77%	0.77	85%	0.852	S	S	*	*			trans	-50.2	139.5	-159.8	-62.6	0	0	0	0	117.1	F10	C8-F10 PolarHBondContact O-N 3.31Å
9	H	38	Very low	34.8	Very low	187 Å²	187	170.7 Å²	170.7	87%	0.866	85%	0.85	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	5.5	-173.4	-101.7	-78	0	0	0	118.1
10	F	39.6	Very low	34.6	Very low	183 Å²	183	171.9 Å²	171.9	80%	0.803	85%	0.849	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-24.1	-172.4	-162.2	-104.7	0	0	0	114.2	C8	C8-F10 PolarHBondContact O-N 3.31Å
11	H	38.5	Very low	34.9	Very low	157 Å²	157	168.9 Å²	168.9	73%	0.727	84%	0.843	S	S	*	*	S	Bend	trans	-96.7	-2.9	-175.4	-77	90.5	0	0	0	115.3
12	S	36.8	Very low	34.6	Very low	99 Å²	99	169.5 Å²	169.5	69%	0.692	83%	0.832	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-15.3	-178	-165.6	0	0	0	0	113.9	L14	S12-L14 PolarHBondContact O-N 3.49Å
13	A	35.7	Very low	34.9	Very low	94 Å²	94	163.3 Å²	163.3	78%	0.777	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-3.6	-173	0	0	0	0	0	115.6
14	L	37.7	Very low	35	Very low	165 Å²	165	156.5 Å²	156.5	86%	0.864	81%	0.813	S	S	*	*	S	Bend	trans	-115.2	-6.8	-174.7	-92.8	156.8	0	0	0	115.3	S12	S12-L14 PolarHBondContact O-N 3.49Å
15	L	34.3	Very low	34.6	Very low	150 Å²	150	157.7 Å²	157.7	79%	0.785	82%	0.821	S	S	*	*	S	Bend	trans	-108.4	2.6	-173.3	-78.5	167.7	0	0	0	115.7
16	H	33.9	Very low	34.5	Very low	183 Å²	183	153.8 Å²	153.8	85%	0.847	81%	0.814	S	S	*	*	S	Bend	trans	-127.9	75.6	173.7	-82.7	8.9	0	0	0	112.5
17	S	29.7	Very low	34.1	Very low	118 Å²	118	149.1 Å²	149.1	83%	0.825	81%	0.808	S	S	*	*			trans	-161	98.8	133.4	60.6	0	0	0	0	110.9
18	R	33.5	Very low	33.9	Very low	240 Å²	240	150.1 Å²	150.1	91%	0.906	81%	0.805	S	S	*	*			trans	-135.6	112	161	-114.1	-168.6	-177.7	-170.9	2.6	107.2
19	Q	31.5	Very low	33.5	Very low	172 Å²	172	153 Å²	153	80%	0.804	81%	0.805	S	S	*	*				158.2	113.6	117	-85.5	-175.1	-0.7	0	0	112.5
20	K	30.8	Very low	33.1	Very low	193 Å²	193	155.4 Å²	155.4	84%	0.839	81%	0.806	S	S	*	*			trans	60.4	167.6	139.8	-70.5	-175.3	178.5	-179.2	0	119.9
21	P	42.1	Very low	32.7	Very low	110 Å²	110	157.5 Å²	157.5	71%	0.714	81%	0.809	S	S	*	*			cis	-129.7	156.5	-34.7	34.2	-18.4	0	0	0	112.2
22	W	28.2	Very low	32.2	Very low	256 Å²	256	157.5 Å²	157.5	97%	0.97	81%	0.814	S	S	*	*			trans	-126	141.3	161.2	-95.9	52.8	0	0	0	110.5
23	P	34.3	Very low	32.2	Very low	118 Å²	118	158.8 Å²	158.8	77%	0.766	82%	0.818	S	S	*	*			trans	-92.6	171.5	-167.9	37.7	-35.2	0	0	0	114.3
24	S	31.8	Very low	32	Very low	102 Å²	102	165.7 Å²	165.7	71%	0.713	82%	0.824	S	S	*	*			trans	-62.5	153.9	-177.4	61.1	0	0	0	0	115.7
25	P	30.6	Very low	32.2	Very low	136 Å²	136	165 Å²	165	88%	0.883	82%	0.819	S	S	*	*			trans	-109.7	83.8	154.6	30.6	-15.9	0	0	0	111
26	A	29	Very low	32.3	Very low	94 Å²	94	165.4 Å²	165.4	78%	0.777	82%	0.821	S	S	*	*			trans	-108	76.7	152.8	0	0	0	0	0	107.9
27	A	29.4	Very low	32.6	Very low	89 Å²	89	161.4 Å²	161.4	74%	0.736	81%	0.812	S	S	*	*			trans	168.4	77.2	156	0	0	0	0	0	110.7
28	F	28.9	Very low	33.2	Very low	193 Å²	193	161.7 Å²	161.7	85%	0.846	81%	0.811	S	S	*	*	S	Bend	trans	-125.4	102.3	150.3	-126.6	-113.6	0	0	0	106.7
29	F	29.2	Very low	33.4	Very low	173 Å²	173	162.1 Å²	162.1	76%	0.759	81%	0.812	S	S	*	*			trans	79.9	95.9	162.8	-70.3	-89.9	0	0	0	120.6
30	R	30.7	Very low	33.7	Very low	239 Å²	239	163.4 Å²	163.4	90%	0.902	82%	0.816	S	S	*	*			trans	-69.9	147.4	136.9	-98.7	-174.9	-179.3	-168.3	1.2	110.1
31	R	31.1	Very low	34.4	Very low	226 Å²	226	159.6 Å²	159.6	85%	0.853	81%	0.814	S	S	*	*			trans	82.7	103.8	162.3	-80.9	-177.7	169.3	166.1	-3.6	118.2
32	N	27.6	Very low	34.9	Very low	158 Å²	158	159.4 Å²	159.4	85%	0.845	82%	0.815	S	S	*	*				-163.3	141.6	89.1	-94.2	-26.4	0	0	0	112.8
33	V	36.3	Very low	36.1	Very low	125 Å²	125	152.8 Å²	152.8	76%	0.758	81%	0.805	S	S	*	*			trans	-66.8	132.5	177.5	171.9	0	0	0	0	110.4	I35	V33-I35 HydrophobicContact CG1-CG1 4.3Å
34	R	31.7	Very low	37.2	Very low	239 Å²	239	151 Å²	151	90%	0.902	79%	0.792	S	S	*	*			trans	-141.4	117.2	149.4	-101.4	-176.9	-178.8	-179.9	0.2	109.7
35	I	42.6	Very low	38.6	Very low	150 Å²	150	148.8 Å²	148.8	77%	0.769	78%	0.775	S	S	*	*			trans	-70.7	130.1	174.6	-65.4	160.5	0	0	0	108.7	V33	V33-I35 HydrophobicContact CG1-CG1 4.3Å
36	L	35.1	Very low	40.1	Very low	159 Å²	159	149.1 Å²	149.1	83%	0.832	77%	0.769	S	S	*	*			trans	-144.4	151.8	157.9	-109	110.6	0	0	0	109.7
37	P	41.5	Very low	41.5	Very low	99 Å²	99	151.8 Å²	151.8	64%	0.643	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-83.3	168.3	-138.1	33.6	-35.4	0	0	0	114.3	R39	P37-R39 PolarHBondContact O-N 3.21Å
38	P	41.6	Very low	42.9	Very low	125 Å²	125	154.8 Å²	154.8	81%	0.812	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-67.9	121	-175.1	29	-33.4	0	0	0	110.1
39	R	37.3	Very low	44.2	Very low	248 Å²	248	151.2 Å²	151.2	94%	0.936	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-86.3	122.7	163.3	-91.3	-176.5	173.1	174	-1.6	108.9	P37	P37-R39 PolarHBondContact O-N 3.21Å
40	F	38.6	Very low	45.6	Very low	199 Å²	199	147 Å²	147	87%	0.873	72%	0.723	S	S	*	*			trans	-37.9	133.6	175.5	-85.5	-105.8	0	0	0	113.6	S42	F40-S42 PolarHBondContact O-N 3.37Å; F40-S42 VanDerWaalsContact O-N 3.17Å
41	S	44.6	Very low	46.8	Very low	114 Å²	114	140.3 Å²	140.3	80%	0.797	71%	0.705	S	S	*	*			trans	-58.6	109.6	165	38.1	0	0	0	0	109.8
42	S	53	Low	47.9	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-74.7	134.4	156.6	57.6	0	0	0	0	107.9	F40 T44	F40-S42 PolarHBondContact O-N 3.37Å; F40-S42 VanDerWaalsContact O-N 3.17Å; S42-T44 PolarHBondContact O-N 3.15Å
43	P	53.1	Low	49.3	Very low	118 Å²	118	129.5 Å²	129.5	77%	0.766	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-63.1	123.9	176.3	24.3	-30.2	0	0	0	108.4
44	T	56.5	Low	50.4	Low	80 Å²	80	126.1 Å²	126.1	49%	0.491	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-54.3	129.2	170.6	38.4	0	0	0	0	108.6	S42 L46 K49	S42-T44 PolarHBondContact O-N 3.15Å; T44-L46 PolarHBondContact O-N 3.44Å; T44-K49 WeakPolarHBondContact OG1-CE 3.18Å
45	P	62.1	Low	51.8	Low	56 Å²	56	119.3 Å²	119.3	36%	0.364	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-63.4	139.5	-171	26.7	-35.4	0	0	0	109.6	W47 R48	P45-W47 HydrophobicContact CB-CG 4.48Å; P45-W47 HydrophobicContact CG-CZ2 4.35Å; P45-W47 PolarHBondContact O-N 3.15Å; P45-R48 HydrophobicContact CG-CB 4.41Å; P45-R48 HydrophobicContact CG-CG 4.14Å; P45-R48 PolarHBondContact O-N 3.42Å
46	L	62.1	Low	52.7	Low	143 Å²	143	116.6 Å²	116.6	75%	0.749	63%	0.632	S	S	*	*	H	α-helix	trans	-51.8	-35.2	-169.9	-136.5	112.6	0	0	0	112.5	T44 R48 K49 V50	T44-L46 PolarHBondContact O-N 3.44Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 3.22Å; L46-K49 PolarHBondContact O-N 3.12Å; L46-V50 HydrophobicContact CD2-CG2 4.48Å; L46-V50 VanDerWaalsContact O-CG2 3.29Å; L46-V50 WeakPolarHBondContact O-CG2 3.43Å; L46-V50 PolarHBondContact O-N 2.76Å
47	W	59.3	Low	54	Low	150 Å²	150	110.2 Å²	110.2	57%	0.568	61%	0.605	S	S	*	*	H	α-helix	trans	-62.5	-32.9	177	70.3	-98.8	0	0	0	113.7	P45 L51	P45-W47 HydrophobicContact CB-CG 4.48Å; P45-W47 HydrophobicContact CG-CZ2 4.35Å; P45-W47 PolarHBondContact O-N 3.15Å; W47-L51 HydrophobicContact CE3-CD1 3.69Å; W47-L51 HydrophobicContact CZ3-CD1 4.11Å; W47-L51 WeakPolarHBondContact O-CB 3.44Å; W47-L51 PolarHBondContact O-N 3.46Å
48	R	58.7	Low	55.2	Low	151 Å²	151	107.7 Å²	107.7	57%	0.57	59%	0.593	S	S	*	*	H	α-helix	trans	-71.6	-36.6	174.6	-80.4	-172.2	176	-171	-2	111.8	P45 L46 S52	P45-R48 HydrophobicContact CG-CB 4.41Å; P45-R48 HydrophobicContact CG-CG 4.14Å; P45-R48 PolarHBondContact O-N 3.42Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 3.22Å; R48-S52 WeakPolarHBondContact O-CB 3.23Å; R48-S52 PolarHBondContact O-N 3.37Å; R48-S52 PolarHBondContact O-OG 3.13Å; R48-S52 VanDerWaalsContact O-OG 3.1Å
49	K	55.6	Low	56.8	Low	118 Å²	118	105.4 Å²	105.4	51%	0.513	58%	0.578	S	S	.	*	H	α-helix	trans	-66.9	-43.1	173.8	-71.5	-173.6	-176.7	-179.8	0	110.9	T44 L46 S52 T53	T44-K49 WeakPolarHBondContact OG1-CE 3.18Å; L46-K49 PolarHBondContact O-N 3.12Å; K49-S52 WeakPolarHBondContact CA-OG 3.41Å; K49-S52 PolarHBondContact O-N 2.92Å; K49-S52 PolarHBondContact O-OG 2.72Å; K49-T53 WeakPolarHBondContact O-CG2 3.33Å; K49-T53 PolarHBondContact O-N 2.86Å; K49-T53 PolarHBondContact O-OG1 3.42Å
50	V	59.1	Low	58.4	Low	84 Å²	84	99.3 Å²	99.3	51%	0.509	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-41.2	175.5	174.1	0	0	0	0	111.6	L46 T53 A54	L46-V50 HydrophobicContact CD2-CG2 4.48Å; L46-V50 VanDerWaalsContact O-CG2 3.29Å; L46-V50 WeakPolarHBondContact O-CG2 3.43Å; L46-V50 PolarHBondContact O-N 2.76Å; V50-T53 WeakPolarHBondContact CA-OG1 3.13Å; V50-T53 PolarHBondContact O-OG1 2.91Å; V50-A54 WeakPolarHBondContact O-CB 3.29Å; V50-A54 PolarHBondContact O-N 3.31Å
51	L	54.6	Low	60	Low	100 Å²	100	96 Å²	96	52%	0.524	55%	0.554	S	S	.	*	H	α-helix	trans	-64.4	-43.1	172.6	-109.1	122.2	0	0	0	111.5	W47 A54 V55	W47-L51 HydrophobicContact CE3-CD1 3.69Å; W47-L51 HydrophobicContact CZ3-CD1 4.11Å; W47-L51 WeakPolarHBondContact O-CB 3.44Å; W47-L51 PolarHBondContact O-N 3.46Å; L51-A54 PolarHBondContact O-N 3.41Å; L51-V55 VanDerWaalsContact O-CB 3.25Å; L51-V55 WeakPolarHBondContact O-CB 3.48Å; L51-V55 WeakPolarHBondContact O-CG2 3.48Å; L51-V55 PolarHBondContact O-N 2.97Å
52	S	54.9	Low	61.5	Low	64 Å²	64	95.2 Å²	95.2	45%	0.448	54%	0.541	S	S	.	.	H	α-helix	trans	-67.1	-38.3	178.8	60.8	0	0	0	0	113	R48 K49 V56	R48-S52 WeakPolarHBondContact O-CB 3.23Å; R48-S52 PolarHBondContact O-N 3.37Å; R48-S52 PolarHBondContact O-OG 3.13Å; R48-S52 VanDerWaalsContact O-OG 3.1Å; K49-S52 WeakPolarHBondContact CA-OG 3.41Å; K49-S52 PolarHBondContact O-N 2.92Å; K49-S52 PolarHBondContact O-OG 2.72Å; S52-V56 WeakPolarHBondContact O-CG2 3.42Å; S52-V56 PolarHBondContact O-N 2.75Å; S52-V56 VanDerWaalsContact O-N 3.16Å
53	T	57.1	Low	62.6	Low	93 Å²	93	92 Å²	92	57%	0.571	52%	0.523	S	S	*	.	H	α-helix	trans	-74.7	-31.7	176	49.6	0	0	0	0	111.9	K49 V50 G57	K49-T53 WeakPolarHBondContact O-CG2 3.33Å; K49-T53 PolarHBondContact O-N 2.86Å; K49-T53 PolarHBondContact O-OG1 3.42Å; V50-T53 WeakPolarHBondContact CA-OG1 3.13Å; V50-T53 PolarHBondContact O-OG1 2.91Å; T53-G57 VanDerWaalsContact O-CA 3.23Å; T53-G57 WeakPolarHBondContact O-CA 3.29Å; T53-G57 PolarHBondContact O-N 2.87Å
54	A	58.4	Low	63.7	Low	53 Å²	53	89.1 Å²	89.1	44%	0.438	51%	0.51	S	S	.	.	H	α-helix	trans	-69.3	-42.3	172.1	0	0	0	0	0	112	V50 L51 V56 A58	V50-A54 WeakPolarHBondContact O-CB 3.29Å; V50-A54 PolarHBondContact O-N 3.31Å; L51-A54 PolarHBondContact O-N 3.41Å; A54-V56 VanDerWaalsContact C-N 3.35Å; A54-V56 PolarHBondContact O-N 3.05Å; A54-A58 WeakPolarHBondContact O-CB 3.42Å; A54-A58 PolarHBondContact O-N 3.38Å; A54-A58 VanDerWaalsContact O-N 3.08Å
55	V	62	Low	64.8	Low	97 Å²	97	92.3 Å²	92.3	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-68.4	-30.9	-179.3	169.5	0	0	0	0	112.4	L51 P59	L51-V55 VanDerWaalsContact O-CB 3.25Å; L51-V55 WeakPolarHBondContact O-CB 3.48Å; L51-V55 WeakPolarHBondContact O-CG2 3.48Å; L51-V55 PolarHBondContact O-N 2.97Å; V55-P59 WeakPolarHBondContact O-CD 3.38Å; V55-P59 WeakPolarHBondContact O-CG 3.49Å
56	V	60.4	Low	65.7	Low	92 Å²	92	93.5 Å²	93.5	56%	0.558	51%	0.51	S	S	*	.	H	α-helix	trans	-97.4	-37.8	177.9	180	0	0	0	0	112.6	S52 A54 P59 L60	S52-V56 WeakPolarHBondContact O-CG2 3.42Å; S52-V56 PolarHBondContact O-N 2.75Å; S52-V56 VanDerWaalsContact O-N 3.16Å; A54-V56 VanDerWaalsContact C-N 3.35Å; A54-V56 PolarHBondContact O-N 3.05Å; V56-P59 WeakPolarHBondContact O-CD 3.5Å; V56-L60 HydrophobicContact CG1-CD1 4.03Å; V56-L60 WeakPolarHBondContact O-CD1 3.25Å; V56-L60 WeakPolarHBondContact O-CG 3.46Å; V56-L60 PolarHBondContact O-N 2.73Å
57	G	63.4	Low	66.7	Low	25 Å²	25	91.7 Å²	91.7	26%	0.258	51%	0.505	S	S	.	.	H	α-helix	trans	-74.3	-37.3	-177.3	0	0	0	0	0	113.6	T53 L60 L61	T53-G57 VanDerWaalsContact O-CA 3.23Å; T53-G57 WeakPolarHBondContact O-CA 3.29Å; T53-G57 PolarHBondContact O-N 2.87Å; G57-L60 PolarHBondContact O-N 3.26Å; G57-L61 WeakPolarHBondContact O-CB 3.46Å; G57-L61 WeakPolarHBondContact O-CG 3.36Å; G57-L61 PolarHBondContact O-N 3.12Å
58	A	67.2	Low	67.7	Low	47 Å²	47	90.3 Å²	90.3	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-44.9	179.2	0	0	0	0	0	112.7	A54 L60 L61 L62	A54-A58 WeakPolarHBondContact O-CB 3.42Å; A54-A58 PolarHBondContact O-N 3.38Å; A54-A58 VanDerWaalsContact O-N 3.08Å; A58-L60 PolarHBondContact O-N 2.79Å; A58-L61 PolarHBondContact O-N 3.46Å; A58-L62 VanDerWaalsContact O-CB 3.32Å; A58-L62 WeakPolarHBondContact O-CB 3.42Å; A58-L62 WeakPolarHBondContact O-CD1 3.4Å; A58-L62 WeakPolarHBondContact O-CG 3.22Å; A58-L62 PolarHBondContact O-N 2.76Å
59	P	74	Confident	68.8	Low	77 Å²	77	83.4 Å²	83.4	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-63.5	-36.6	174.8	-24.5	35.2	0	0	0	113.8	V55 V56 G63	V55-P59 WeakPolarHBondContact O-CD 3.38Å; V55-P59 WeakPolarHBondContact O-CG 3.49Å; V56-P59 WeakPolarHBondContact O-CD 3.5Å; P59-G63 PolarHBondContact O-N 2.84Å
60	L	72.1	Confident	70.1	Confident	120 Å²	120	85.2 Å²	85.2	63%	0.628	50%	0.499	S	S	*	.	H	α-helix	trans	-68	-42.8	177.1	-78.2	168.4	0	0	0	112	V56 G57 A58 G63 A64	V56-L60 HydrophobicContact CG1-CD1 4.03Å; V56-L60 WeakPolarHBondContact O-CD1 3.25Å; V56-L60 WeakPolarHBondContact O-CG 3.46Å; V56-L60 PolarHBondContact O-N 2.73Å; G57-L60 PolarHBondContact O-N 3.26Å; A58-L60 PolarHBondContact O-N 2.79Å; L60-G63 PolarHBondContact O-N 2.95Å; L60-A64 WeakPolarHBondContact O-CB 3.47Å; L60-A64 PolarHBondContact O-N 2.77Å
61	L	72.6	Confident	71	Confident	130 Å²	130	84.4 Å²	84.4	68%	0.681	50%	0.501	S	S	*	.	H	α-helix	trans	-65.9	-40.4	174.9	-75.8	167.7	0	0	0	111.9	G57 A58 R65	G57-L61 WeakPolarHBondContact O-CB 3.46Å; G57-L61 WeakPolarHBondContact O-CG 3.36Å; G57-L61 PolarHBondContact O-N 3.12Å; A58-L61 PolarHBondContact O-N 3.46Å; L61-R65 VanDerWaalsContact O-CB 3.29Å; L61-R65 WeakPolarHBondContact O-CB 3.43Å; L61-R65 PolarHBondContact O-N 3.2Å
62	L	74.8	Confident	72.1	Confident	97 Å²	97	85.2 Å²	85.2	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-40.8	172.8	-81.3	159.2	0	0	0	111.6	A58 R65 Y66 M77	A58-L62 VanDerWaalsContact O-CB 3.32Å; A58-L62 WeakPolarHBondContact O-CB 3.42Å; A58-L62 WeakPolarHBondContact O-CD1 3.4Å; A58-L62 WeakPolarHBondContact O-CG 3.22Å; A58-L62 PolarHBondContact O-N 2.76Å; L62-R65 PolarHBondContact O-N 3.22Å; L62-Y66 VanDerWaalsContact O-CB 3.31Å; L62-Y66 WeakPolarHBondContact O-CB 3.35Å; L62-Y66 PolarHBondContact O-N 3.23Å; L62-M77 HydrophobicContact CD2-CE 3.86Å; L62-M77 VanDerWaalsContact O-CE 3.32Å; L62-M77 WeakPolarHBondContact O-CE 3.44Å
63	G	76.7	Confident	73.3	Confident	36 Å²	36	85.3 Å²	85.3	37%	0.371	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-44.2	176.1	0	0	0	0	0	112.6	P59 L60 Y66 V67	P59-G63 PolarHBondContact O-N 2.84Å; L60-G63 PolarHBondContact O-N 2.95Å; G63-Y66 WeakPolarHBondContact O-CB 3.37Å; G63-Y66 PolarHBondContact O-N 2.97Å; G63-V67 WeakPolarHBondContact O-CG2 3.47Å; G63-V67 PolarHBondContact O-N 3.33Å; G63-V67 VanDerWaalsContact O-N 3.15Å
64	A	75.1	Confident	74.5	Confident	58 Å²	58	83.8 Å²	83.8	48%	0.479	48%	0.476	S	S	.	.	H	α-helix	trans	-62.4	-46.3	175.4	0	0	0	0	0	111.6	L60 Y66 V67 T68	L60-A64 WeakPolarHBondContact O-CB 3.47Å; L60-A64 PolarHBondContact O-N 2.77Å; A64-Y66 VanDerWaalsContact C-N 3.31Å; A64-Y66 PolarHBondContact O-N 3.19Å; A64-V67 PolarHBondContact O-N 2.82Å; A64-T68 PolarHBondContact O-N 2.93Å; A64-T68 PolarHBondContact O-OG1 3.41Å
65	R	80.3	Confident	75.6	Confident	148 Å²	148	82.1 Å²	82.1	56%	0.558	46%	0.458	S	S	*	.	H	α-helix	trans	-62.5	-37.2	175.5	-171.3	175.4	177	149.6	1.6	112.1	L61 L62 V67 T68 A69 E73	L61-R65 VanDerWaalsContact O-CB 3.29Å; L61-R65 WeakPolarHBondContact O-CB 3.43Å; L61-R65 PolarHBondContact O-N 3.2Å; L62-R65 PolarHBondContact O-N 3.22Å; R65-V67 VanDerWaalsContact C-N 3.33Å; R65-V67 PolarHBondContact O-N 3.49Å; R65-T68 PolarHBondContact O-N 3.17Å; R65-T68 PolarHBondContact O-OG1 3.45Å; R65-A69 WeakPolarHBondContact O-CB 3.43Å; R65-A69 PolarHBondContact O-N 3.37Å; R65-E73 IonicContact CZ-OE1 3.67Å; R65-E73 VanDerWaalsContact CZ-OE1 3.29Å; R65-E73 IonicContact NE-OE1 2.71Å; R65-E73 PolarHBondContact NE-OE1 2.94Å; R65-E73 IonicContact NH2-OE1 2.73Å; R65-E73 PolarHBondContact NH2-OE1 3.01Å
66	Y	82.1	Confident	76.5	Confident	80 Å²	80	83.6 Å²	83.6	31%	0.314	45%	0.453	S	S	.	.	H	α-helix	trans	-63.5	-37.4	176.5	-176.8	-96	0	0	0	112.3	L62 G63 A64 K74 M77 R78	L62-Y66 VanDerWaalsContact O-CB 3.31Å; L62-Y66 WeakPolarHBondContact O-CB 3.35Å; L62-Y66 PolarHBondContact O-N 3.23Å; G63-Y66 WeakPolarHBondContact O-CB 3.37Å; G63-Y66 PolarHBondContact O-N 2.97Å; A64-Y66 VanDerWaalsContact C-N 3.31Å; A64-Y66 PolarHBondContact O-N 3.19Å; Y66-K74 HydrophobicContact CD2-CB 4.45Å; Y66-K74 HydrophobicContact CD2-CG 4.17Å; Y66-K74 HydrophobicContact CE2-CB 3.92Å; Y66-K74 HydrophobicContact CE2-CG 3.99Å; Y66-K74 WeakPolarHBondContact O-CE 3.43Å; Y66-K74 WeakPolarHBondContact O-CG 3.39Å; Y66-M77 HydrophobicContact CD2-CB 4.06Å; Y66-M77 HydrophobicContact CD2-CE 4.2Å; Y66-M77 HydrophobicContact CD2-SD 3.99Å; Y66-M77 HydrophobicContact CE2-CB 4.46Å; Y66-R78 HydrophobicContact CE2-CG 4.09Å
67	V	82.1	Confident	77.5	Confident	106 Å²	106	80.9 Å²	80.9	64%	0.642	44%	0.435	S	S	*	.	H	α-helix	trans	-69.3	-42	-179.9	173	0	0	0	0	111.2	G63 A64 R65 K74	G63-V67 WeakPolarHBondContact O-CG2 3.47Å; G63-V67 PolarHBondContact O-N 3.33Å; G63-V67 VanDerWaalsContact O-N 3.15Å; A64-V67 PolarHBondContact O-N 2.82Å; R65-V67 VanDerWaalsContact C-N 3.33Å; R65-V67 PolarHBondContact O-N 3.49Å; V67-K74 WeakPolarHBondContact O-CE 3.45Å; V67-K74 PolarHBondContact O-NZ 2.93Å
68	T	80.8	Confident	78.4	Confident	120 Å²	120	86.2 Å²	86.2	74%	0.736	45%	0.447	S	S	*	.	H	α-helix	trans	-84.6	-14.2	-176.9	59.3	0	0	0	0	114.3	A64 R65	A64-T68 PolarHBondContact O-N 2.93Å; A64-T68 PolarHBondContact O-OG1 3.41Å; R65-T68 PolarHBondContact O-N 3.17Å; R65-T68 PolarHBondContact O-OG1 3.45Å
69	A	81.5	Confident	79	Confident	6 Å²	6	85 Å²	85	5%	0.05	43%	0.434	C	S	.	.	S	Bend	trans	-65.6	148.4	-179.5	0	0	0	0	0	113.6	R65 E73 K74	R65-A69 WeakPolarHBondContact O-CB 3.43Å; R65-A69 PolarHBondContact O-N 3.37Å; A69-E73 HydrophobicContact CB-CB 3.91Å; A69-E73 HydrophobicContact CB-CG 3.91Å; A69-K74 HydrophobicContact CB-CG 3.88Å; A69-K74 WeakPolarHBondContact O-CD 3.33Å; A69-K74 WeakPolarHBondContact O-CE 3.46Å; A69-K74 PolarHBondContact O-NZ 2.61Å
70	E	82.6	Confident	79.2	Confident	156 Å²	156	85.6 Å²	85.6	73%	0.729	44%	0.436	S	S	*	.			trans	-65.2	162.3	169.8	-65.3	-179	175	0	0	111.4	R72 E73 K74	E70-R72 PolarHBondContact O-N 3.08Å; E70-R72 VanDerWaalsContact O-N 3.17Å; E70-E73 PolarHBondContact O-N 2.82Å; E70-E73 VanDerWaalsContact O-N 3.08Å; E70-K74 PolarHBondContact O-N 3.34Å
71	A	77.9	Confident	79.7	Confident	67 Å²	67	84.6 Å²	84.6	55%	0.554	44%	0.435	S	S	*	.	H	α-helix	trans	-53.8	-40.2	-176.4	0	0	0	0	0	112.9	R75	A71-R75 PolarHBondContact O-N 2.91Å
72	R	78.3	Confident	80.1	Confident	118 Å²	118	82.7 Å²	82.7	45%	0.445	43%	0.425	S	S	.	.	H	α-helix	trans	-66.2	-42.9	177.9	-169.5	176.4	-175.4	-176.9	5	112.9	E70 R75 R76 E188	E70-R72 PolarHBondContact O-N 3.08Å; E70-R72 VanDerWaalsContact O-N 3.17Å; R72-R75 PolarHBondContact O-N 3.3Å; R72-R76 PolarHBondContact O-N 3.5Å; R72-E188 IonicContact NE-OE1 3.87Å
73	E	79.7	Confident	80.4	Confident	65 Å²	65	78.8 Å²	78.8	30%	0.304	41%	0.408	S	S	.	.	H	α-helix	trans	-70.7	-38.9	178.5	-175	176.4	-162	0	0	110.9	R65 A69 E70 R75 R76 M77	R65-E73 IonicContact CZ-OE1 3.67Å; R65-E73 VanDerWaalsContact CZ-OE1 3.29Å; R65-E73 IonicContact NE-OE1 2.71Å; R65-E73 PolarHBondContact NE-OE1 2.94Å; R65-E73 IonicContact NH2-OE1 2.73Å; R65-E73 PolarHBondContact NH2-OE1 3.01Å; A69-E73 HydrophobicContact CB-CB 3.91Å; A69-E73 HydrophobicContact CB-CG 3.91Å; E70-E73 PolarHBondContact O-N 2.82Å; E70-E73 VanDerWaalsContact O-N 3.08Å; E73-R75 PolarHBondContact O-N 3Å; E73-R76 PolarHBondContact O-N 3.07Å; E73-M77 HydrophobicContact CG-SD 4.44Å; E73-M77 WeakPolarHBondContact O-CG 3.4Å; E73-M77 PolarHBondContact O-N 3.2Å
74	K	82.1	Confident	80.8	Confident	61 Å²	61	83.5 Å²	83.5	27%	0.265	42%	0.422	S	S	.	.	H	α-helix	trans	-57.8	-44.1	170	-76.1	170.6	172	150.3	0	112.5	Y66 V67 A69 E70 M77 R78	Y66-K74 HydrophobicContact CD2-CB 4.45Å; Y66-K74 HydrophobicContact CD2-CG 4.17Å; Y66-K74 HydrophobicContact CE2-CB 3.92Å; Y66-K74 HydrophobicContact CE2-CG 3.99Å; Y66-K74 WeakPolarHBondContact O-CE 3.43Å; Y66-K74 WeakPolarHBondContact O-CG 3.39Å; V67-K74 WeakPolarHBondContact O-CE 3.45Å; V67-K74 PolarHBondContact O-NZ 2.93Å; A69-K74 HydrophobicContact CB-CG 3.88Å; A69-K74 WeakPolarHBondContact O-CD 3.33Å; A69-K74 WeakPolarHBondContact O-CE 3.46Å; A69-K74 PolarHBondContact O-NZ 2.61Å; E70-K74 PolarHBondContact O-N 3.34Å; K74-M77 PolarHBondContact O-N 3.4Å; K74-R78 PolarHBondContact O-N 3.46Å; K74-R78 VanDerWaalsContact O-N 3.1Å
75	R	82.9	Confident	81.3	Confident	19 Å²	19	82.6 Å²	82.6	7%	0.072	42%	0.419	C	S	.	.	H	α-helix	trans	-58.4	-51.3	173.1	164.5	171.7	41.4	-116.3	-6.5	110.5	A71 R72 E73 M77 R78 L79 E184 E188 D236	A71-R75 PolarHBondContact O-N 2.91Å; R72-R75 PolarHBondContact O-N 3.3Å; E73-R75 PolarHBondContact O-N 3Å; R75-M77 VanDerWaalsContact C-N 3.33Å; R75-M77 PolarHBondContact O-N 3.36Å; R75-R78 PolarHBondContact O-N 3.26Å; R75-L79 HydrophobicContact CG-CD1 3.65Å; R75-L79 HydrophobicContact CG-CG 4.13Å; R75-L79 VanDerWaalsContact O-CG 3.3Å; R75-L79 WeakPolarHBondContact O-CG 3.4Å; R75-L79 PolarHBondContact O-N 3.24Å; R75-E184 IonicContact CZ-OE2 3.6Å; R75-E184 IonicContact NH1-OE2 3.32Å; R75-E184 PolarHBondContact NH1-OE2 3.19Å; R75-E184 IonicContact NH2-OE2 2.77Å; R75-E188 IonicContact CZ-OE1 3.97Å; R75-E188 IonicContact NH2-OE1 3.27Å; R75-E188 PolarHBondContact NH2-OE1 2.69Å; R75-D236 IonicContact NE-OD2 3.83Å
76	R	79.8	Confident	81.7	Confident	127 Å²	127	76.2 Å²	76.2	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-56.8	-44.7	179.3	-77	-173.5	172.6	-156	-5.7	112.8	R72 E73 R78 L79 V80 D236	R72-R76 PolarHBondContact O-N 3.5Å; E73-R76 PolarHBondContact O-N 3.07Å; R76-R78 PolarHBondContact O-N 3.4Å; R76-L79 PolarHBondContact O-N 2.99Å; R76-V80 WeakPolarHBondContact O-CG2 3.43Å; R76-V80 PolarHBondContact O-N 3.46Å; R76-D236 IonicContact CZ-OD1 3.3Å; R76-D236 IonicContact NE-OD1 3.88Å; R76-D236 PolarHBondContact NE-OD1 3.46Å; R76-D236 IonicContact NH2-OD1 3.48Å; R76-D236 PolarHBondContact NH2-OD1 3.41Å
77	M	81.7	Confident	82	Confident	35 Å²	35	75.3 Å²	75.3	17%	0.172	39%	0.393	C	S	.	.	H	α-helix	trans	-61.8	-44.1	178.1	-67.7	175.4	75.3	0	0	112.1	L62 Y66 E73 K74 R75 V80 V81	L62-M77 HydrophobicContact CD2-CE 3.86Å; L62-M77 VanDerWaalsContact O-CE 3.32Å; L62-M77 WeakPolarHBondContact O-CE 3.44Å; Y66-M77 HydrophobicContact CD2-CB 4.06Å; Y66-M77 HydrophobicContact CD2-CE 4.2Å; Y66-M77 HydrophobicContact CD2-SD 3.99Å; Y66-M77 HydrophobicContact CE2-CB 4.46Å; E73-M77 HydrophobicContact CG-SD 4.44Å; E73-M77 WeakPolarHBondContact O-CG 3.4Å; E73-M77 PolarHBondContact O-N 3.2Å; K74-M77 PolarHBondContact O-N 3.4Å; R75-M77 VanDerWaalsContact C-N 3.33Å; R75-M77 PolarHBondContact O-N 3.36Å; M77-V80 PolarHBondContact O-N 3.12Å; M77-V81 PolarHBondContact O-N 3.06Å
78	R	81.3	Confident	82.4	Confident	138 Å²	138	72.1 Å²	72.1	52%	0.521	38%	0.381	S	S	.	.	H	α-helix	trans	-61.2	-45.3	173.7	-79.4	-173.9	-70.5	-172.6	0.4	112	Y66 K74 R75 R76 V80 V81 D82	Y66-R78 HydrophobicContact CE2-CG 4.09Å; K74-R78 PolarHBondContact O-N 3.46Å; K74-R78 VanDerWaalsContact O-N 3.1Å; R75-R78 PolarHBondContact O-N 3.26Å; R76-R78 PolarHBondContact O-N 3.4Å; R78-V80 VanDerWaalsContact C-N 3.27Å; R78-V80 PolarHBondContact O-N 3.41Å; R78-V81 PolarHBondContact O-N 3.42Å; R78-V81 VanDerWaalsContact O-N 3.12Å; R78-D82 PolarHBondContact O-N 3.17Å
79	L	80.6	Confident	82.9	Confident	21 Å²	21	71.3 Å²	71.3	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-62.1	-33.2	-179.5	-70	175.5	0	0	0	113.2	R75 R76 G83 D233 D236	R75-L79 HydrophobicContact CG-CD1 3.65Å; R75-L79 HydrophobicContact CG-CG 4.13Å; R75-L79 VanDerWaalsContact O-CG 3.3Å; R75-L79 WeakPolarHBondContact O-CG 3.4Å; R75-L79 PolarHBondContact O-N 3.24Å; R76-L79 PolarHBondContact O-N 2.99Å; L79-G83 WeakPolarHBondContact O-CA 3.24Å; L79-G83 PolarHBondContact O-N 3.25Å; L79-D233 HydrophobicContact CD1-CB 4.23Å; L79-D233 HydrophobicContact CD2-CB 3.81Å; L79-D236 HydrophobicContact CD1-CB 3.55Å
80	V	79	Confident	83.3	Confident	90 Å²	90	71.5 Å²	71.5	55%	0.545	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-46.4	173.7	170.4	0	0	0	0	110.9	R76 M77 R78 G83 M84	R76-V80 WeakPolarHBondContact O-CG2 3.43Å; R76-V80 PolarHBondContact O-N 3.46Å; M77-V80 PolarHBondContact O-N 3.12Å; R78-V80 VanDerWaalsContact C-N 3.27Å; R78-V80 PolarHBondContact O-N 3.41Å; V80-G83 WeakPolarHBondContact O-CA 3.41Å; V80-G83 PolarHBondContact O-N 3.22Å; V80-M84 HydrophobicContact CG1-CE 4.39Å; V80-M84 PolarHBondContact O-N 3.05Å; V80-M84 VanDerWaalsContact O-N 3.08Å
81	V	81.9	Confident	83.7	Confident	99 Å²	99	66.5 Å²	66.5	60%	0.6	34%	0.344	S	S	*	.	H	α-helix	trans	-63.3	-47.2	177.8	176	0	0	0	0	110.8	M77 R78 G83 M84 G85	M77-V81 PolarHBondContact O-N 3.06Å; R78-V81 PolarHBondContact O-N 3.42Å; R78-V81 VanDerWaalsContact O-N 3.12Å; V81-G83 PolarHBondContact O-N 3.43Å; V81-M84 WeakPolarHBondContact O-CB 3.41Å; V81-M84 PolarHBondContact O-N 2.88Å; V81-M84 VanDerWaalsContact O-N 3.17Å; V81-G85 PolarHBondContact O-N 3.19Å
82	D	80.8	Confident	84.4	Confident	89 Å²	89	70.5 Å²	70.5	48%	0.476	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-34.2	175.5	-67.6	-23.5	0	0	0	111.5	R78 G85 R86	R78-D82 PolarHBondContact O-N 3.17Å; D82-G85 PolarHBondContact O-N 2.91Å; D82-R86 WeakPolarHBondContact O-CG 3.46Å; D82-R86 PolarHBondContact O-N 3.39Å
83	G	82.3	Confident	85	Confident	15 Å²	15	66.1 Å²	66.1	16%	0.155	34%	0.335	C	S	.	.	H	α-helix	trans	-59.9	-41.3	174.6	0	0	0	0	0	112.7	L79 V80 V81 G85 R86 F87	L79-G83 WeakPolarHBondContact O-CA 3.24Å; L79-G83 PolarHBondContact O-N 3.25Å; V80-G83 WeakPolarHBondContact O-CA 3.41Å; V80-G83 PolarHBondContact O-N 3.22Å; V81-G83 PolarHBondContact O-N 3.43Å; G83-G85 VanDerWaalsContact C-N 3.32Å; G83-G85 PolarHBondContact O-N 3.45Å; G83-R86 PolarHBondContact O-N 2.89Å; G83-F87 WeakPolarHBondContact O-CB 3.49Å; G83-F87 PolarHBondContact O-N 2.97Å
84	M	83.9	Confident	85.5	Confident	135 Å²	135	63.7 Å²	63.7	67%	0.665	33%	0.327	S	S	*	.	H	α-helix	trans	-62.4	-40.1	173.6	-64.5	-179.3	177.9	0	0	111.8	V80 V81 F87 G88	V80-M84 HydrophobicContact CG1-CE 4.39Å; V80-M84 PolarHBondContact O-N 3.05Å; V80-M84 VanDerWaalsContact O-N 3.08Å; V81-M84 WeakPolarHBondContact O-CB 3.41Å; V81-M84 PolarHBondContact O-N 2.88Å; V81-M84 VanDerWaalsContact O-N 3.17Å; M84-F87 PolarHBondContact O-N 3.34Å; M84-G88 PolarHBondContact O-N 2.92Å
85	G	86.8	Confident	85.8	Confident	39 Å²	39	64.3 Å²	64.3	40%	0.402	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-40.6	174.5	0	0	0	0	0	113.1	V81 D82 G83 R89	V81-G85 PolarHBondContact O-N 3.19Å; D82-G85 PolarHBondContact O-N 2.91Å; G83-G85 VanDerWaalsContact C-N 3.32Å; G83-G85 PolarHBondContact O-N 3.45Å; G85-R89 WeakPolarHBondContact O-CG 3.16Å; G85-R89 PolarHBondContact O-N 3.32Å; G85-R89 VanDerWaalsContact O-N 3.12Å; G85-R89 PolarHBondContact O-NE 2.82Å
86	R	88.2	Confident	86.3	Confident	14 Å²	14	68.5 Å²	68.5	5%	0.053	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-43.4	172.6	-71.9	-167.3	-58.5	-79.5	-0.3	111.6	D82 G83 R89 S90 N141 D241	D82-R86 WeakPolarHBondContact O-CG 3.46Å; D82-R86 PolarHBondContact O-N 3.39Å; G83-R86 PolarHBondContact O-N 2.89Å; R86-R89 PolarHBondContact O-N 3.38Å; R86-S90 WeakPolarHBondContact O-CB 3.5Å; R86-S90 PolarHBondContact O-N 2.9Å; R86-S90 PolarHBondContact O-OG 3.02Å; R86-N141 HydrophobicContact CG-CB 4.43Å; R86-D241 IonicContact CZ-OD1 3.39Å; R86-D241 IonicContact NE-OD1 3.63Å; R86-D241 PolarHBondContact NE-OD1 2.88Å; R86-D241 IonicContact NE-OD2 3.98Å; R86-D241 PolarHBondContact NE-OD2 3.37Å; R86-D241 IonicContact NH2-OD1 3.59Å; R86-D241 PolarHBondContact NH2-OD1 3.35Å; R86-D241 IonicContact NH2-OD2 3.76Å
87	F	88	Confident	86.9	Confident	62 Å²	62	63.7 Å²	63.7	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-57.5	-51.5	175.8	179.1	-90.7	0	0	0	111.1	G83 M84 R89 S90 L91 T244 L247	G83-F87 WeakPolarHBondContact O-CB 3.49Å; G83-F87 PolarHBondContact O-N 2.97Å; M84-F87 PolarHBondContact O-N 3.34Å; F87-R89 PolarHBondContact O-N 2.95Å; F87-S90 PolarHBondContact O-N 3.41Å; F87-L91 HydrophobicContact CE1-CB 4.46Å; F87-L91 HydrophobicContact CE1-CD2 4.02Å; F87-L91 HydrophobicContact CZ-CD2 4.48Å; F87-L91 WeakPolarHBondContact O-CB 3.46Å; F87-L91 PolarHBondContact O-N 2.78Å; F87-T244 HydrophobicContact CB-CG2 4.33Å; F87-T244 HydrophobicContact CD2-CG2 3.42Å; F87-T244 VanDerWaalsContact CD2-CG2 3.42Å; F87-T244 HydrophobicContact CE2-CG2 4.1Å; F87-T244 HydrophobicContact CG-CG2 4.3Å; F87-L247 HydrophobicContact CE2-CD2 3.95Å; F87-L247 HydrophobicContact CZ-CD2 4.13Å
88	G	89.8	Confident	87.2	Confident	39 Å²	39	62.2 Å²	62.2	40%	0.402	33%	0.33	S	S	.	.	H	α-helix	trans	-59.9	-42.3	179.8	0	0	0	0	0	113.3	M84 K92	M84-G88 PolarHBondContact O-N 2.92Å; G88-K92 WeakPolarHBondContact O-CB 3.38Å; G88-K92 PolarHBondContact O-N 3.5Å
89	R	91.4	Very high	87.7	Confident	102 Å²	102	60.6 Å²	60.6	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-45.3	174.3	-74.6	-176.5	-71	171.2	-2	112	G85 R86 F87 K92 V93 S140 N141	G85-R89 WeakPolarHBondContact O-CG 3.16Å; G85-R89 PolarHBondContact O-N 3.32Å; G85-R89 VanDerWaalsContact O-N 3.12Å; G85-R89 PolarHBondContact O-NE 2.82Å; R86-R89 PolarHBondContact O-N 3.38Å; F87-R89 PolarHBondContact O-N 2.95Å; R89-K92 PolarHBondContact O-N 2.88Å; R89-V93 WeakPolarHBondContact O-CG2 3.19Å; R89-V93 PolarHBondContact O-N 3.02Å; R89-S140 VanDerWaalsContact NH1-C 3.29Å; R89-S140 PolarHBondContact NH1-O 2.94Å; R89-S140 PolarHBondContact NH1-OG 3.42Å; R89-N141 VanDerWaalsContact CZ-OD1 3.23Å; R89-N141 PolarHBondContact NE-OD1 2.88Å; R89-N141 PolarHBondContact NH2-OD1 2.86Å
90	S	90.8	Very high	88.2	Confident	11 Å²	11	61.4 Å²	61.4	8%	0.077	34%	0.336	C	S	.	.	H	α-helix	trans	-65.9	-40.5	-179.4	-52.6	0	0	0	0	111.9	R86 F87 V93 G94 N141 Y145 L248	R86-S90 WeakPolarHBondContact O-CB 3.5Å; R86-S90 PolarHBondContact O-N 2.9Å; R86-S90 PolarHBondContact O-OG 3.02Å; F87-S90 PolarHBondContact O-N 3.41Å; S90-V93 PolarHBondContact O-N 3.07Å; S90-G94 PolarHBondContact O-N 2.92Å; S90-N141 PolarHBondContact OG-ND2 2.82Å; S90-Y145 VanDerWaalsContact OG-CE1 3.3Å; S90-Y145 WeakPolarHBondContact OG-CE1 3.49Å; S90-Y145 PolarHBondContact OG-OH 2.77Å; S90-L248 VanDerWaalsContact CB-CD1 3.46Å
91	L	90.2	Very high	88.7	Confident	51 Å²	51	59 Å²	59	27%	0.267	32%	0.317	S	S	.	.	H	α-helix	trans	-62.3	-44.5	174.3	-179.3	62.7	0	0	0	111.5	F87 V93 G94 L95 L248 L251	F87-L91 HydrophobicContact CE1-CB 4.46Å; F87-L91 HydrophobicContact CE1-CD2 4.02Å; F87-L91 HydrophobicContact CZ-CD2 4.48Å; F87-L91 WeakPolarHBondContact O-CB 3.46Å; F87-L91 PolarHBondContact O-N 2.78Å; L91-V93 PolarHBondContact O-N 3.22Å; L91-G94 PolarHBondContact O-N 3.25Å; L91-L95 HydrophobicContact CD1-CD1 4.02Å; L91-L95 HydrophobicContact CD1-CG 4.06Å; L91-L95 HydrophobicContact CG-CD1 3.94Å; L91-L95 HydrophobicContact CG-CG 4.39Å; L91-L95 WeakPolarHBondContact O-CB 3.34Å; L91-L95 VanDerWaalsContact O-CG 3.3Å; L91-L95 WeakPolarHBondContact O-CG 3.27Å; L91-L95 PolarHBondContact O-N 2.83Å; L91-L248 HydrophobicContact CB-CD2 3.97Å; L91-L248 HydrophobicContact CD1-CD2 3.58Å; L91-L248 HydrophobicContact CG-CD2 4.39Å; L91-L251 HydrophobicContact CD1-CD1 4.25Å
92	K	92.6	Very high	89	Confident	150 Å²	150	60 Å²	60	65%	0.652	31%	0.31	S	S	*	.	H	α-helix	trans	-58.5	-47.7	175.9	-179.3	-175.6	173.8	-175.6	0	111.6	G88 R89 Q96	G88-K92 WeakPolarHBondContact O-CB 3.38Å; G88-K92 PolarHBondContact O-N 3.5Å; R89-K92 PolarHBondContact O-N 2.88Å; K92-Q96 WeakPolarHBondContact O-CB 3.47Å; K92-Q96 PolarHBondContact O-N 3.02Å
93	V	91.9	Very high	89.5	Confident	26 Å²	26	62.6 Å²	62.6	16%	0.158	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-47.8	178	171.7	0	0	0	0	110.7	R89 S90 L91 L95 Q96 I97 A133	R89-V93 WeakPolarHBondContact O-CG2 3.19Å; R89-V93 PolarHBondContact O-N 3.02Å; S90-V93 PolarHBondContact O-N 3.07Å; L91-V93 PolarHBondContact O-N 3.22Å; V93-L95 PolarHBondContact O-N 2.93Å; V93-Q96 PolarHBondContact O-N 3.48Å; V93-I97 HydrophobicContact CG1-CD1 3.79Å; V93-I97 HydrophobicContact CG1-CG1 4.45Å; V93-I97 WeakPolarHBondContact O-CG1 3.28Å; V93-I97 PolarHBondContact O-N 2.68Å; V93-A133 HydrophobicContact CG1-CB 4.28Å
94	G	89.2	Confident	89.9	Confident	14 Å²	14	62 Å²	62	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-59.9	-44.1	179	0	0	0	0	0	113	S90 L91 I97 S98	S90-G94 PolarHBondContact O-N 2.92Å; L91-G94 PolarHBondContact O-N 3.25Å; G94-I97 PolarHBondContact O-N 3.39Å; G94-S98 WeakPolarHBondContact O-CB 3.4Å; G94-S98 PolarHBondContact O-N 3.46Å; G94-S98 PolarHBondContact O-OG 3.46Å
95	L	89.8	Confident	89.9	Confident	75 Å²	75	58.6 Å²	58.6	39%	0.393	29%	0.294	S	S	.	.	H	α-helix	trans	-65.6	-42.3	175.7	-72.9	173.2	0	0	0	112.1	L91 V93 I97 S98 L99 M255	L91-L95 HydrophobicContact CD1-CD1 4.02Å; L91-L95 HydrophobicContact CD1-CG 4.06Å; L91-L95 HydrophobicContact CG-CD1 3.94Å; L91-L95 HydrophobicContact CG-CG 4.39Å; L91-L95 WeakPolarHBondContact O-CB 3.34Å; L91-L95 VanDerWaalsContact O-CG 3.3Å; L91-L95 WeakPolarHBondContact O-CG 3.27Å; L91-L95 PolarHBondContact O-N 2.83Å; V93-L95 PolarHBondContact O-N 2.93Å; L95-I97 PolarHBondContact O-N 3.31Å; L95-S98 PolarHBondContact O-N 3.36Å; L95-L99 WeakPolarHBondContact O-CB 3.41Å; L95-L99 VanDerWaalsContact O-CG 3.24Å; L95-L99 WeakPolarHBondContact O-CG 3.47Å; L95-L99 PolarHBondContact O-N 2.96Å; L95-M255 HydrophobicContact CD2-CE 4.17Å
96	Q	93.1	Very high	89.8	Confident	106 Å²	106	60.4 Å²	60.4	50%	0.495	29%	0.294	S	S	.	.	H	α-helix	trans	-58.5	-48.8	176.4	177.3	-176.3	-23.9	0	0	111	K92 V93 D100	K92-Q96 WeakPolarHBondContact O-CB 3.47Å; K92-Q96 PolarHBondContact O-N 3.02Å; V93-Q96 PolarHBondContact O-N 3.48Å; Q96-D100 WeakPolarHBondContact O-CB 3.31Å; Q96-D100 PolarHBondContact O-N 2.81Å; Q96-D100 VanDerWaalsContact O-N 3.12Å
97	I	91	Very high	89.9	Confident	26 Å²	26	62.8 Å²	62.8	13%	0.133	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-50.9	177.8	-67.5	172.2	0	0	0	109.9	V93 G94 L95 L99 D100 Y101 A130 A133 L134	V93-I97 HydrophobicContact CG1-CD1 3.79Å; V93-I97 HydrophobicContact CG1-CG1 4.45Å; V93-I97 WeakPolarHBondContact O-CG1 3.28Å; V93-I97 PolarHBondContact O-N 2.68Å; G94-I97 PolarHBondContact O-N 3.39Å; L95-I97 PolarHBondContact O-N 3.31Å; I97-L99 PolarHBondContact O-N 3.01Å; I97-D100 WeakPolarHBondContact O-CB 3.34Å; I97-D100 PolarHBondContact O-N 3.31Å; I97-D100 VanDerWaalsContact O-N 3.13Å; I97-Y101 HydrophobicContact CG2-CD2 3.75Å; I97-Y101 HydrophobicContact CG2-CE2 3.7Å; I97-Y101 WeakPolarHBondContact O-CD2 3.27Å; I97-Y101 PolarHBondContact O-N 3.1Å; I97-A130 HydrophobicContact CD1-CB 4.46Å; I97-A130 HydrophobicContact CG1-CB 4.13Å; I97-A130 HydrophobicContact CG2-CB 3.8Å; I97-A133 HydrophobicContact CD1-CB 4.23Å; I97-A133 HydrophobicContact CG1-CB 4.12Å; I97-L134 HydrophobicContact CD1-CB 4.47Å
98	S	88.4	Confident	89.9	Confident	4 Å²	4	63.2 Å²	63.2	3%	0.028	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-44.4	-176.3	-57.1	0	0	0	0	112.5	G94 L95 D100 Y101 W102 M255 H256	G94-S98 WeakPolarHBondContact O-CB 3.4Å; G94-S98 PolarHBondContact O-N 3.46Å; G94-S98 PolarHBondContact O-OG 3.46Å; L95-S98 PolarHBondContact O-N 3.36Å; S98-D100 VanDerWaalsContact C-N 3.31Å; S98-D100 PolarHBondContact O-N 2.97Å; S98-Y101 PolarHBondContact O-N 3.1Å; S98-W102 WeakPolarHBondContact O-CB 3.32Å; S98-W102 PolarHBondContact O-N 3.07Å; S98-M255 VanDerWaalsContact OG-CE 3.27Å; S98-M255 WeakPolarHBondContact OG-CE 3.23Å; S98-H256 VanDerWaalsContact CA-NE2 3.31Å; S98-H256 WeakPolarHBondContact CA-NE2 3.27Å; S98-H256 VanDerWaalsContact CB-NE2 3.33Å; S98-H256 WeakPolarHBondContact CB-NE2 3.45Å; S98-H256 PolarHBondContact O-CE1 3.18Å; S98-H256 PolarHBondContact O-NE2 2.78Å; S98-H256 VanDerWaalsContact O-NE2 3.13Å
99	L	91.3	Very high	89.8	Confident	105 Å²	105	61.9 Å²	61.9	55%	0.55	30%	0.301	S	S	.	.	H	α-helix	trans	-64.4	-36.7	177.3	-71.8	171.1	0	0	0	112	L95 I97 W102 W103	L95-L99 WeakPolarHBondContact O-CB 3.41Å; L95-L99 VanDerWaalsContact O-CG 3.24Å; L95-L99 WeakPolarHBondContact O-CG 3.47Å; L95-L99 PolarHBondContact O-N 2.96Å; I97-L99 PolarHBondContact O-N 3.01Å; L99-W102 PolarHBondContact O-N 3.16Å; L99-W103 VanDerWaalsContact O-CB 3.28Å; L99-W103 WeakPolarHBondContact O-CB 3.47Å; L99-W103 PolarHBondContact O-N 3.14Å
100	D	92.3	Very high	89.6	Confident	37 Å²	37	66.9 Å²	66.9	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-46.9	177.4	-162.6	17.1	0	0	0	111.2	Q96 I97 S98 W102 W103 C104 R129	Q96-D100 WeakPolarHBondContact O-CB 3.31Å; Q96-D100 PolarHBondContact O-N 2.81Å; Q96-D100 VanDerWaalsContact O-N 3.12Å; I97-D100 WeakPolarHBondContact O-CB 3.34Å; I97-D100 PolarHBondContact O-N 3.31Å; I97-D100 VanDerWaalsContact O-N 3.13Å; S98-D100 VanDerWaalsContact C-N 3.31Å; S98-D100 PolarHBondContact O-N 2.97Å; D100-W102 PolarHBondContact O-N 2.84Å; D100-W103 PolarHBondContact O-N 2.6Å; D100-C104 WeakPolarHBondContact O-CB 3.35Å; D100-C104 PolarHBondContact O-N 2.56Å; D100-R129 VanDerWaalsContact CG-NH2 3.31Å; D100-R129 IonicContact OD1-CZ 2.71Å; D100-R129 IonicContact OD1-NE 2.69Å; D100-R129 IonicContact OD1-NH2 3.53Å; D100-R129 PolarHBondContact OD1-NH2 3.45Å; D100-R129 IonicContact OD2-CZ 3.45Å; D100-R129 IonicContact OD2-NE 3.71Å; D100-R129 PolarHBondContact OD2-NE 3.28Å; D100-R129 IonicContact OD2-NH2 3.64Å; D100-R129 PolarHBondContact OD2-NH2 3.26Å; D100-R129 VanDerWaalsContact OD2-NH2 3.1Å
101	Y	89.3	Confident	89.2	Confident	40 Å²	40	70.4 Å²	70.4	16%	0.157	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-47.2	172.4	-86	-87.5	0	0	0	111.7	I97 S98 W103 C104 T105 M123 H127 A130 Y163	I97-Y101 HydrophobicContact CG2-CD2 3.75Å; I97-Y101 HydrophobicContact CG2-CE2 3.7Å; I97-Y101 WeakPolarHBondContact O-CD2 3.27Å; I97-Y101 PolarHBondContact O-N 3.1Å; S98-Y101 PolarHBondContact O-N 3.1Å; Y101-W103 VanDerWaalsContact C-N 3.28Å; Y101-W103 PolarHBondContact O-N 3.33Å; Y101-C104 PolarHBondContact O-N 3.09Å; Y101-T105 WeakPolarHBondContact O-CB 3.26Å; Y101-T105 PolarHBondContact O-N 2.99Å; Y101-T105 PolarHBondContact O-OG1 3.33Å; Y101-T105 VanDerWaalsContact O-OG1 3.06Å; Y101-M123 HydrophobicContact CD1-CE 3.99Å; Y101-M123 HydrophobicContact CE1-CE 3.81Å; Y101-H127 AromaticContact CE1-CE1 3.77Å; Y101-H127 AromaticContact CE1-ND1 3.63Å; Y101-H127 AromaticContact CZ-ND1 3.56Å; Y101-H127 PolarHBondContact OH-ND1 3.19Å; Y101-A130 HydrophobicContact CE2-CB 3.71Å; Y101-Y163 WeakPolarHBondContact OH-CE2 3.5Å; Y101-Y163 PolarHBondContact OH-OH 3.49Å
102	W	88.9	Confident	88.9	Confident	119 Å²	119	70.7 Å²	70.7	45%	0.451	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-42.9	-179.7	-177.6	89.7	0	0	0	111.2	S98 L99 D100 N106 V107	S98-W102 WeakPolarHBondContact O-CB 3.32Å; S98-W102 PolarHBondContact O-N 3.07Å; L99-W102 PolarHBondContact O-N 3.16Å; D100-W102 PolarHBondContact O-N 2.84Å; W102-N106 VanDerWaalsContact CD1-ND2 3.31Å; W102-N106 HydrophobicContact CZ2-CB 4.43Å; W102-N106 PolarHBondContact NE1-ND2 3.14Å; W102-N106 VanDerWaalsContact O-CB 3.25Å; W102-N106 WeakPolarHBondContact O-CB 3.48Å; W102-N106 PolarHBondContact O-N 3.24Å; W102-N106 PolarHBondContact O-ND2 2.99Å; W102-V107 HydrophobicContact CZ3-CG2 4.22Å
103	W	91.2	Very high	88.3	Confident	144 Å²	144	71.1 Å²	71.1	55%	0.545	37%	0.367	S	S	.	.	H	α-helix	trans	-66.1	-48.1	177.6	-173.4	-92.2	0	0	0	112.2	L99 D100 Y101 T105 V107 V108	L99-W103 VanDerWaalsContact O-CB 3.28Å; L99-W103 WeakPolarHBondContact O-CB 3.47Å; L99-W103 PolarHBondContact O-N 3.14Å; D100-W103 PolarHBondContact O-N 2.6Å; Y101-W103 VanDerWaalsContact C-N 3.28Å; Y101-W103 PolarHBondContact O-N 3.33Å; W103-T105 PolarHBondContact O-N 2.98Å; W103-V107 HydrophobicContact CD2-CB 4.1Å; W103-V107 HydrophobicContact CD2-CG1 4.4Å; W103-V107 HydrophobicContact CD2-CG2 3.98Å; W103-V107 HydrophobicContact CE3-CB 4.39Å; W103-V107 HydrophobicContact CE3-CG2 3.79Å; W103-V107 HydrophobicContact CG-CB 4.45Å; W103-V107 HydrophobicContact CH2-CG1 4.16Å; W103-V107 HydrophobicContact CH2-CG2 4.48Å; W103-V107 HydrophobicContact CZ2-CB 4.46Å; W103-V107 HydrophobicContact CZ2-CG1 3.87Å; W103-V107 HydrophobicContact CZ3-CG2 4.05Å; W103-V107 WeakPolarHBondContact O-CA 3.4Å; W103-V107 VanDerWaalsContact O-CB 3.27Å; W103-V107 WeakPolarHBondContact O-CB 3.36Å; W103-V107 PolarHBondContact O-N 3.4Å; W103-V108 PolarHBondContact O-N 3.08Å; W103-V108 VanDerWaalsContact O-N 3.14Å
104	C	89.4	Confident	87.3	Confident	4 Å²	4	76.7 Å²	76.7	3%	0.027	39%	0.391	C	S	.	.	I	π-helix	trans	-57.2	-50	176.8	-80.4	0	0	0	0	111.3	D100 Y101 V108 L109 V122 M123 C126	D100-C104 WeakPolarHBondContact O-CB 3.35Å; D100-C104 PolarHBondContact O-N 2.56Å; Y101-C104 PolarHBondContact O-N 3.09Å; C104-V108 PolarHBondContact O-N 2.96Å; C104-L109 VanDerWaalsContact O-CB 3.27Å; C104-L109 WeakPolarHBondContact O-CB 3.42Å; C104-L109 VanDerWaalsContact O-CG 3.31Å; C104-L109 WeakPolarHBondContact O-CG 3.34Å; C104-L109 PolarHBondContact O-N 3.21Å; C104-V122 HydrophobicContact CB-CG1 4.29Å; C104-M123 HydrophobicContact CB-SD 4.49Å; C104-C126 HydrophobicContact CB-CB 4.39Å
105	T	84	Confident	86.4	Confident	62 Å²	62	81.8 Å²	81.8	38%	0.38	42%	0.415	S	S	.	.	I	π-helix	trans	-73.7	-42.5	-176	-52	0	0	0	0	113.2	Y101 W103	Y101-T105 WeakPolarHBondContact O-CB 3.26Å; Y101-T105 PolarHBondContact O-N 2.99Å; Y101-T105 PolarHBondContact O-OG1 3.33Å; Y101-T105 VanDerWaalsContact O-OG1 3.06Å; W103-T105 PolarHBondContact O-N 2.98Å
106	N	85.6	Confident	85.9	Confident	78 Å²	78	79.5 Å²	79.5	42%	0.417	41%	0.405	S	S	.	.	I	π-helix	trans	-95.1	-19	-171	-64.2	-85.1	0	0	0	114.5	W102	W102-N106 VanDerWaalsContact CD1-ND2 3.31Å; W102-N106 HydrophobicContact CZ2-CB 4.43Å; W102-N106 PolarHBondContact NE1-ND2 3.14Å; W102-N106 VanDerWaalsContact O-CB 3.25Å; W102-N106 WeakPolarHBondContact O-CB 3.48Å; W102-N106 PolarHBondContact O-N 3.24Å; W102-N106 PolarHBondContact O-ND2 2.99Å
107	V	89.6	Confident	85.2	Confident	63 Å²	63	79.7 Å²	79.7	38%	0.382	42%	0.416	S	S	.	.	I	π-helix	trans	-114.5	-56.6	-176.8	-174.3	0	0	0	0	110.8	W102 W103	W102-V107 HydrophobicContact CZ3-CG2 4.22Å; W103-V107 HydrophobicContact CD2-CB 4.1Å; W103-V107 HydrophobicContact CD2-CG1 4.4Å; W103-V107 HydrophobicContact CD2-CG2 3.98Å; W103-V107 HydrophobicContact CE3-CB 4.39Å; W103-V107 HydrophobicContact CE3-CG2 3.79Å; W103-V107 HydrophobicContact CG-CB 4.45Å; W103-V107 HydrophobicContact CH2-CG1 4.16Å; W103-V107 HydrophobicContact CH2-CG2 4.48Å; W103-V107 HydrophobicContact CZ2-CB 4.46Å; W103-V107 HydrophobicContact CZ2-CG1 3.87Å; W103-V107 HydrophobicContact CZ3-CG2 4.05Å; W103-V107 WeakPolarHBondContact O-CA 3.4Å; W103-V107 VanDerWaalsContact O-CB 3.27Å; W103-V107 WeakPolarHBondContact O-CB 3.36Å; W103-V107 PolarHBondContact O-N 3.4Å
108	V	88.8	Confident	84.7	Confident	72 Å²	72	80.3 Å²	80.3	44%	0.436	43%	0.428	S	S	.	.	I	π-helix	trans	-74.1	-45.6	-174	-177.4	0	0	0	0	111.7	W103 C104 R110 V122	W103-V108 PolarHBondContact O-N 3.08Å; W103-V108 VanDerWaalsContact O-N 3.14Å; C104-V108 PolarHBondContact O-N 2.96Å; V108-R110 VanDerWaalsContact C-N 3.3Å; V108-R110 PolarHBondContact O-N 3.39Å; V108-V122 HydrophobicContact CB-CG1 4.41Å; V108-V122 HydrophobicContact CG1-CG1 3.88Å; V108-V122 HydrophobicContact CG1-CG2 4.15Å
109	L	88.1	Confident	84.4	Confident	10 Å²	10	82.1 Å²	82.1	5%	0.052	44%	0.435	C	S	.	.	S	Bend	trans	-93.1	13	-175.8	-64.5	173	0	0	0	113.3	C104 G111 V112 Y119 V122 M123	C104-L109 VanDerWaalsContact O-CB 3.27Å; C104-L109 WeakPolarHBondContact O-CB 3.42Å; C104-L109 VanDerWaalsContact O-CG 3.31Å; C104-L109 WeakPolarHBondContact O-CG 3.34Å; C104-L109 PolarHBondContact O-N 3.21Å; L109-G111 PolarHBondContact O-N 2.87Å; L109-G111 VanDerWaalsContact O-N 3.12Å; L109-V112 HydrophobicContact CD2-CB 4.29Å; L109-V112 HydrophobicContact CD2-CG1 4.33Å; L109-V112 HydrophobicContact CD2-CG2 4.3Å; L109-V112 WeakPolarHBondContact O-CB 3.36Å; L109-V112 PolarHBondContact O-N 2.72Å; L109-V112 VanDerWaalsContact O-N 3.07Å; L109-Y119 HydrophobicContact CB-CD2 4.13Å; L109-Y119 HydrophobicContact CB-CE2 4.19Å; L109-Y119 HydrophobicContact CD1-CD2 3.77Å; L109-Y119 HydrophobicContact CD1-CE2 3.74Å; L109-Y119 HydrophobicContact CD1-CG 4.26Å; L109-Y119 HydrophobicContact CD2-CD2 3.92Å; L109-Y119 HydrophobicContact CD2-CG 4.3Å; L109-Y119 HydrophobicContact CG-CD2 4.16Å; L109-Y119 HydrophobicContact CG-CE2 4.41Å; L109-V122 HydrophobicContact CD1-CB 4.26Å; L109-V122 HydrophobicContact CD1-CG1 3.98Å; L109-V122 HydrophobicContact CD2-CB 3.9Å; L109-V122 HydrophobicContact CD2-CG1 4.1Å; L109-V122 HydrophobicContact CD2-CG2 4.1Å; L109-V122 HydrophobicContact CG-CB 4.27Å; L109-V122 HydrophobicContact CG-CG1 3.96Å; L109-M123 HydrophobicContact CD1-CG 3.66Å; L109-M123 HydrophobicContact CD1-SD 3.59Å; L109-M123 VanDerWaalsContact CD1-SD 3.59Å
110	R	86.9	Confident	83.9	Confident	207 Å²	207	80 Å²	80	78%	0.781	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	116.2	-177.5	-169.6	177.1	-179.1	179.5	0.6	110.5	V108 V112	V108-R110 VanDerWaalsContact C-N 3.3Å; V108-R110 PolarHBondContact O-N 3.39Å; R110-V112 PolarHBondContact O-N 3.46Å
111	G	81.1	Confident	83.6	Confident	86 Å²	86	85.3 Å²	85.3	89%	0.887	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	8.4	-179.1	0	0	0	0	0	114.2	L109	L109-G111 PolarHBondContact O-N 2.87Å; L109-G111 VanDerWaalsContact O-N 3.12Å
112	V	83.8	Confident	83.5	Confident	57 Å²	57	85.3 Å²	85.3	35%	0.345	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-82.8	135.7	168.9	-178.2	0	0	0	0	108.1	L109 R110 E114 S116 Y119	L109-V112 HydrophobicContact CD2-CB 4.29Å; L109-V112 HydrophobicContact CD2-CG1 4.33Å; L109-V112 HydrophobicContact CD2-CG2 4.3Å; L109-V112 WeakPolarHBondContact O-CB 3.36Å; L109-V112 PolarHBondContact O-N 2.72Å; L109-V112 VanDerWaalsContact O-N 3.07Å; R110-V112 PolarHBondContact O-N 3.46Å; V112-E114 PolarHBondContact O-N 2.63Å; V112-S116 VanDerWaalsContact CG1-OG 3.27Å; V112-S116 WeakPolarHBondContact CG1-OG 2.74Å; V112-Y119 HydrophobicContact CG1-CD2 4.42Å
113	E	80.3	Confident	83.4	Confident	159 Å²	159	80.6 Å²	80.6	74%	0.743	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-63.8	128.9	176.6	-167	173.7	-167.3	0	0	110.2	N115 S116	E113-N115 PolarHBondContact O-N 2.92Å; E113-S116 WeakPolarHBondContact O-CB 3.38Å; E113-S116 PolarHBondContact O-N 3.08Å; E113-S116 VanDerWaalsContact O-N 3.14Å; E113-S116 PolarHBondContact O-OG 2.87Å
114	E	70.7	Confident	83.2	Confident	143 Å²	143	75.9 Å²	75.9	67%	0.668	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	135.6	175.4	-70.9	-178.3	170.4	0	0	109.4	V112 S116 Y119	V112-E114 PolarHBondContact O-N 2.63Å; E114-S116 VanDerWaalsContact C-N 3.27Å; E114-S116 PolarHBondContact O-N 3Å; E114-Y119 HydrophobicContact CG-CE2 4.14Å
115	N	70.5	Confident	83.2	Confident	120 Å²	120	77.8 Å²	77.8	64%	0.642	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	5.8	-175.8	-46.7	-51.4	0	0	0	116.6	E113	E113-N115 PolarHBondContact O-N 2.92Å
116	S	78.9	Confident	83.5	Confident	28 Å²	28	74.9 Å²	74.9	20%	0.196	42%	0.422	C	S	.	.			trans	-62.4	151.7	166	63.5	0	0	0	0	111	V112 E113 E114 G118 Y119 L120	V112-S116 VanDerWaalsContact CG1-OG 3.27Å; V112-S116 WeakPolarHBondContact CG1-OG 2.74Å; E113-S116 WeakPolarHBondContact O-CB 3.38Å; E113-S116 PolarHBondContact O-N 3.08Å; E113-S116 VanDerWaalsContact O-N 3.14Å; E113-S116 PolarHBondContact O-OG 2.87Å; E114-S116 VanDerWaalsContact C-N 3.27Å; E114-S116 PolarHBondContact O-N 3Å; S116-G118 PolarHBondContact O-N 3.38Å; S116-Y119 WeakPolarHBondContact O-CA 3Å; S116-Y119 WeakPolarHBondContact O-CB 3.33Å; S116-Y119 PolarHBondContact O-N 3.17Å; S116-Y119 WeakPolarHBondContact OG-CB 3.09Å; S116-Y119 PolarHBondContact OG-N 3.01Å; S116-L120 PolarHBondContact O-N 2.94Å
117	P	78.6	Confident	83.7	Confident	110 Å²	110	72.8 Å²	72.8	71%	0.714	41%	0.41	S	S	*	.	H	α-helix	trans	-53.9	-39.5	179.7	-28.1	34.9	0	0	0	113.4	L120 E121	P117-L120 PolarHBondContact O-N 2.94Å; P117-E121 PolarHBondContact O-N 3.15Å
118	G	80.9	Confident	83.8	Confident	38 Å²	38	72.7 Å²	72.7	39%	0.392	41%	0.405	S	S	.	.	H	α-helix	trans	-68.7	-32.9	176.3	0	0	0	0	0	113.6	S116 V122	S116-G118 PolarHBondContact O-N 3.38Å; G118-V122 WeakPolarHBondContact O-CG2 3.45Å; G118-V122 PolarHBondContact O-N 2.79Å
119	Y	83.3	Confident	84.1	Confident	42 Å²	42	74.3 Å²	74.3	17%	0.165	40%	0.403	C	S	.	.	H	α-helix	trans	-63.3	-48.9	172.1	-177	-80.4	0	0	0	111.1	L109 V112 E114 S116 E121 V122 M123	L109-Y119 HydrophobicContact CB-CD2 4.13Å; L109-Y119 HydrophobicContact CB-CE2 4.19Å; L109-Y119 HydrophobicContact CD1-CD2 3.77Å; L109-Y119 HydrophobicContact CD1-CE2 3.74Å; L109-Y119 HydrophobicContact CD1-CG 4.26Å; L109-Y119 HydrophobicContact CD2-CD2 3.92Å; L109-Y119 HydrophobicContact CD2-CG 4.3Å; L109-Y119 HydrophobicContact CG-CD2 4.16Å; L109-Y119 HydrophobicContact CG-CE2 4.41Å; V112-Y119 HydrophobicContact CG1-CD2 4.42Å; E114-Y119 HydrophobicContact CG-CE2 4.14Å; S116-Y119 WeakPolarHBondContact O-CA 3Å; S116-Y119 WeakPolarHBondContact O-CB 3.33Å; S116-Y119 PolarHBondContact O-N 3.17Å; S116-Y119 WeakPolarHBondContact OG-CB 3.09Å; S116-Y119 PolarHBondContact OG-N 3.01Å; Y119-E121 VanDerWaalsContact C-N 3.33Å; Y119-E121 PolarHBondContact O-N 3.23Å; Y119-V122 PolarHBondContact O-N 2.9Å; Y119-M123 HydrophobicContact CD1-CG 3.96Å; Y119-M123 HydrophobicContact CE1-CG 3.55Å; Y119-M123 WeakPolarHBondContact O-CB 3.46Å; Y119-M123 WeakPolarHBondContact O-CG 3.42Å; Y119-M123 PolarHBondContact O-N 3.45Å
120	L	79.6	Confident	84.3	Confident	62 Å²	62	73.9 Å²	73.9	33%	0.325	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-38.9	-178.3	-66	174.3	0	0	0	112.1	S116 P117 M123 S124	S116-L120 PolarHBondContact O-N 2.94Å; P117-L120 PolarHBondContact O-N 2.94Å; L120-M123 PolarHBondContact O-N 2.92Å; L120-S124 WeakPolarHBondContact O-CB 3.29Å; L120-S124 PolarHBondContact O-N 3.45Å
121	E	85.8	Confident	84.5	Confident	147 Å²	147	64 Å²	64	69%	0.687	36%	0.364	S	S	*	.	H	α-helix	trans	-64	-47.7	178.3	-172.9	177.2	-172	0	0	112.3	P117 Y119 M123 S124 A125	P117-E121 PolarHBondContact O-N 3.15Å; Y119-E121 VanDerWaalsContact C-N 3.33Å; Y119-E121 PolarHBondContact O-N 3.23Å; E121-M123 PolarHBondContact O-N 3.36Å; E121-S124 PolarHBondContact O-N 3.3Å; E121-A125 PolarHBondContact O-N 2.84Å
122	V	88.3	Confident	85.1	Confident	41 Å²	41	63.7 Å²	63.7	25%	0.248	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-42.3	178.3	173.6	0	0	0	0	111.1	C104 V108 L109 G118 Y119 A125 C126	C104-V122 HydrophobicContact CB-CG1 4.29Å; V108-V122 HydrophobicContact CB-CG1 4.41Å; V108-V122 HydrophobicContact CG1-CG1 3.88Å; V108-V122 HydrophobicContact CG1-CG2 4.15Å; L109-V122 HydrophobicContact CD1-CB 4.26Å; L109-V122 HydrophobicContact CD1-CG1 3.98Å; L109-V122 HydrophobicContact CD2-CB 3.9Å; L109-V122 HydrophobicContact CD2-CG1 4.1Å; L109-V122 HydrophobicContact CD2-CG2 4.1Å; L109-V122 HydrophobicContact CG-CB 4.27Å; L109-V122 HydrophobicContact CG-CG1 3.96Å; G118-V122 WeakPolarHBondContact O-CG2 3.45Å; G118-V122 PolarHBondContact O-N 2.79Å; Y119-V122 PolarHBondContact O-N 2.9Å; V122-A125 PolarHBondContact O-N 3.48Å; V122-C126 PolarHBondContact O-N 2.88Å
123	M	86.3	Confident	85.5	Confident	20 Å²	20	61.5 Å²	61.5	10%	0.099	33%	0.33	C	S	.	.	H	α-helix	trans	-67.4	-42.8	178.3	-74.6	-52.5	-56	0	0	112.3	Y101 C104 L109 Y119 L120 E121 A125 C126 H127	Y101-M123 HydrophobicContact CD1-CE 3.99Å; Y101-M123 HydrophobicContact CE1-CE 3.81Å; C104-M123 HydrophobicContact CB-SD 4.49Å; L109-M123 HydrophobicContact CD1-CG 3.66Å; L109-M123 HydrophobicContact CD1-SD 3.59Å; L109-M123 VanDerWaalsContact CD1-SD 3.59Å; Y119-M123 HydrophobicContact CD1-CG 3.96Å; Y119-M123 HydrophobicContact CE1-CG 3.55Å; Y119-M123 WeakPolarHBondContact O-CB 3.46Å; Y119-M123 WeakPolarHBondContact O-CG 3.42Å; Y119-M123 PolarHBondContact O-N 3.45Å; L120-M123 PolarHBondContact O-N 2.92Å; E121-M123 PolarHBondContact O-N 3.36Å; M123-A125 VanDerWaalsContact C-N 3.33Å; M123-A125 PolarHBondContact O-N 2.95Å; M123-C126 CarbonylContact O-C 3.59Å; M123-C126 WeakPolarHBondContact O-CB 3.37Å; M123-C126 PolarHBondContact O-N 3.27Å; M123-C126 VanDerWaalsContact O-N 3.1Å; M123-H127 PolarHBondContact O-CD2 2.92Å; M123-H127 PolarHBondContact O-N 3.4Å
124	S	86	Confident	86	Confident	45 Å²	45	56.6 Å²	56.6	32%	0.315	31%	0.308	S	S	.	.	H	α-helix	trans	-56.7	-46.4	174	176.2	0	0	0	0	111.2	L120 E121 C126 H127 Q128 E162	L120-S124 WeakPolarHBondContact O-CB 3.29Å; L120-S124 PolarHBondContact O-N 3.45Å; E121-S124 PolarHBondContact O-N 3.3Å; S124-C126 VanDerWaalsContact C-N 3.32Å; S124-C126 PolarHBondContact O-N 3.43Å; S124-H127 PolarHBondContact O-N 3.29Å; S124-Q128 PolarHBondContact O-N 2.89Å; S124-E162 WeakPolarHBondContact CB-OE1 3.28Å; S124-E162 PolarHBondContact OG-OE1 3.26Å
125	A	90.1	Very high	86.9	Confident	44 Å²	44	50.4 Å²	50.4	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-36.6	175.8	0	0	0	0	0	113	E121 V122 M123 R129	E121-A125 PolarHBondContact O-N 2.84Å; V122-A125 PolarHBondContact O-N 3.48Å; M123-A125 VanDerWaalsContact C-N 3.33Å; M123-A125 PolarHBondContact O-N 2.95Å; A125-R129 WeakPolarHBondContact O-CG 3.41Å; A125-R129 PolarHBondContact O-N 3.06Å; A125-R129 PolarHBondContact O-NH1 3.23Å
126	C	91.1	Very high	87.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-45.9	173.6	-172.7	0	0	0	0	111.5	C104 V122 M123 S124 Q128 R129 A130	C104-C126 HydrophobicContact CB-CB 4.39Å; V122-C126 PolarHBondContact O-N 2.88Å; M123-C126 CarbonylContact O-C 3.59Å; M123-C126 WeakPolarHBondContact O-CB 3.37Å; M123-C126 PolarHBondContact O-N 3.27Å; M123-C126 VanDerWaalsContact O-N 3.1Å; S124-C126 VanDerWaalsContact C-N 3.32Å; S124-C126 PolarHBondContact O-N 3.43Å; C126-Q128 VanDerWaalsContact C-N 3.31Å; C126-Q128 PolarHBondContact O-N 3.39Å; C126-R129 PolarHBondContact O-N 3.21Å; C126-A130 WeakPolarHBondContact O-CB 3.33Å; C126-A130 PolarHBondContact O-N 2.96Å
127	H	89.2	Confident	88.3	Confident	35 Å²	35	46.8 Å²	46.8	16%	0.162	27%	0.27	C	S	.	.	H	α-helix	trans	-57.3	-43.9	175.6	-63.8	-37.7	0	0	0	111.6	Y101 M123 S124 A130 A131 P160 E162 Y163	Y101-H127 AromaticContact CE1-CE1 3.77Å; Y101-H127 AromaticContact CE1-ND1 3.63Å; Y101-H127 AromaticContact CZ-ND1 3.56Å; Y101-H127 PolarHBondContact OH-ND1 3.19Å; M123-H127 PolarHBondContact O-CD2 2.92Å; M123-H127 PolarHBondContact O-N 3.4Å; S124-H127 PolarHBondContact O-N 3.29Å; H127-A130 PolarHBondContact O-N 3.5Å; H127-A131 WeakPolarHBondContact O-CB 3.43Å; H127-A131 PolarHBondContact O-N 3.39Å; H127-P160 HydrophobicContact CB-CB 4.17Å; H127-E162 HydrophobicContact CB-CB 3.97Å; H127-E162 HydrophobicContact CB-CG 4.08Å; H127-E162 IonicContact CD2-OE2 3.1Å; H127-Y163 HydrophobicContact CB-CD2 4.39Å; H127-Y163 HydrophobicContact CB-CE2 4.15Å
128	Q	92.6	Very high	88.8	Confident	61 Å²	61	41.9 Å²	41.9	29%	0.285	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-49.5	178.3	-171.7	57.9	54.7	0	0	112.5	S124 C126 A130 A131 D132 E162 T166	S124-Q128 PolarHBondContact O-N 2.89Å; C126-Q128 VanDerWaalsContact C-N 3.31Å; C126-Q128 PolarHBondContact O-N 3.39Å; Q128-A130 VanDerWaalsContact C-N 3.27Å; Q128-A130 PolarHBondContact O-N 2.83Å; Q128-A131 WeakPolarHBondContact O-CB 3.27Å; Q128-A131 PolarHBondContact O-N 2.94Å; Q128-D132 PolarHBondContact NE2-OD1 2.98Å; Q128-D132 VanDerWaalsContact O-CG 3.28Å; Q128-D132 PolarHBondContact O-N 3.19Å; Q128-E162 HydrophobicContact CB-CB 4.21Å; Q128-E162 HydrophobicContact CB-CG 4.06Å; Q128-T166 PolarHBondContact NE2-OG1 3.33Å
129	R	94.9	Very high	89	Confident	105 Å²	105	43.1 Å²	43.1	40%	0.396	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-38.7	177.8	-69.8	-169.8	-56.6	-86.9	8.4	112.2	D100 A125 C126 A133	D100-R129 VanDerWaalsContact CG-NH2 3.31Å; D100-R129 IonicContact OD1-CZ 2.71Å; D100-R129 IonicContact OD1-NE 2.69Å; D100-R129 IonicContact OD1-NH2 3.53Å; D100-R129 PolarHBondContact OD1-NH2 3.45Å; D100-R129 IonicContact OD2-CZ 3.45Å; D100-R129 IonicContact OD2-NE 3.71Å; D100-R129 PolarHBondContact OD2-NE 3.28Å; D100-R129 IonicContact OD2-NH2 3.64Å; D100-R129 PolarHBondContact OD2-NH2 3.26Å; D100-R129 VanDerWaalsContact OD2-NH2 3.1Å; A125-R129 WeakPolarHBondContact O-CG 3.41Å; A125-R129 PolarHBondContact O-N 3.06Å; A125-R129 PolarHBondContact O-NH1 3.23Å; C126-R129 PolarHBondContact O-N 3.21Å; R129-A133 WeakPolarHBondContact O-CB 3.24Å; R129-A133 PolarHBondContact O-N 3.15Å
130	A	91.5	Very high	89.1	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-67.9	-41.2	177.5	0	0	0	0	0	112.2	I97 Y101 C126 H127 Q128 A133 L134 Y163	I97-A130 HydrophobicContact CD1-CB 4.46Å; I97-A130 HydrophobicContact CG1-CB 4.13Å; I97-A130 HydrophobicContact CG2-CB 3.8Å; Y101-A130 HydrophobicContact CE2-CB 3.71Å; C126-A130 WeakPolarHBondContact O-CB 3.33Å; C126-A130 PolarHBondContact O-N 2.96Å; H127-A130 PolarHBondContact O-N 3.5Å; Q128-A130 VanDerWaalsContact C-N 3.27Å; Q128-A130 PolarHBondContact O-N 2.83Å; A130-A133 PolarHBondContact O-N 2.84Å; A130-L134 WeakPolarHBondContact O-CB 3.47Å; A130-L134 PolarHBondContact O-N 2.92Å; A130-Y163 HydrophobicContact CB-CE1 4.3Å; A130-Y163 WeakPolarHBondContact CB-OH 3.4Å
131	A	90.6	Very high	89.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-44.4	175	0	0	0	0	0	112	H127 Q128 L134 V135 Y163 T166	H127-A131 WeakPolarHBondContact O-CB 3.43Å; H127-A131 PolarHBondContact O-N 3.39Å; Q128-A131 WeakPolarHBondContact O-CB 3.27Å; Q128-A131 PolarHBondContact O-N 2.94Å; A131-L134 PolarHBondContact O-N 3.33Å; A131-V135 PolarHBondContact O-N 3.41Å; A131-Y163 HydrophobicContact CB-CD1 3.7Å; A131-Y163 HydrophobicContact CB-CE1 4.13Å; A131-Y163 HydrophobicContact CB-CG 3.98Å; A131-T166 HydrophobicContact CB-CG2 4.12Å
132	D	93.4	Very high	88.9	Confident	79 Å²	79	35.2 Å²	35.2	42%	0.422	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-45.4	176.9	-67.2	-28.4	0	0	0	111.4	Q128 L134 V135 A136 T166	Q128-D132 PolarHBondContact NE2-OD1 2.98Å; Q128-D132 VanDerWaalsContact O-CG 3.28Å; Q128-D132 PolarHBondContact O-N 3.19Å; D132-L134 VanDerWaalsContact C-N 3.34Å; D132-L134 PolarHBondContact O-N 2.92Å; D132-V135 PolarHBondContact O-N 3.02Å; D132-A136 WeakPolarHBondContact O-CB 3.36Å; D132-A136 PolarHBondContact O-N 3.16Å; D132-T166 VanDerWaalsContact OD1-CG2 3.23Å; D132-T166 WeakPolarHBondContact OD1-CG2 3.41Å
133	A	92.7	Very high	88.4	Confident	12 Å²	12	33.6 Å²	33.6	10%	0.099	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-39.9	177.2	0	0	0	0	0	111.9	V93 I97 R129 A130 A136 G137	V93-A133 HydrophobicContact CG1-CB 4.28Å; I97-A133 HydrophobicContact CD1-CB 4.23Å; I97-A133 HydrophobicContact CG1-CB 4.12Å; R129-A133 WeakPolarHBondContact O-CB 3.24Å; R129-A133 PolarHBondContact O-N 3.15Å; A130-A133 PolarHBondContact O-N 2.84Å; A133-A136 PolarHBondContact O-N 3.42Å; A133-G137 PolarHBondContact O-N 3.27Å
134	L	90.3	Very high	88	Confident	55 Å²	55	32.7 Å²	32.7	29%	0.288	20%	0.195	S	C	.	.	H	α-helix	trans	-64.7	-45.3	177.4	-174.2	64.9	0	0	0	111.5	I97 A130 A131 D132 G137 A138 L152 Y163 L167	I97-L134 HydrophobicContact CD1-CB 4.47Å; A130-L134 WeakPolarHBondContact O-CB 3.47Å; A130-L134 PolarHBondContact O-N 2.92Å; A131-L134 PolarHBondContact O-N 3.33Å; D132-L134 VanDerWaalsContact C-N 3.34Å; D132-L134 PolarHBondContact O-N 2.92Å; L134-G137 PolarHBondContact O-N 3.46Å; L134-A138 WeakPolarHBondContact O-CB 3.46Å; L134-A138 PolarHBondContact O-N 3.31Å; L134-L152 HydrophobicContact CD2-CD1 4.27Å; L134-Y163 HydrophobicContact CD2-CD1 4.21Å; L134-Y163 HydrophobicContact CD2-CE1 4.15Å; L134-L167 HydrophobicContact CD2-CD1 4.37Å; L134-L167 HydrophobicContact CD2-CD2 4Å; L134-L167 HydrophobicContact CG-CD2 4.31Å
135	V	89.7	Confident	87.9	Confident	14 Å²	14	31.4 Å²	31.4	9%	0.085	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-46.7	175.4	164.7	0	0	0	0	111.3	A131 D132 G137 A138 I139 T166 L167 V169 L170	A131-V135 PolarHBondContact O-N 3.41Å; D132-V135 PolarHBondContact O-N 3.02Å; V135-G137 VanDerWaalsContact C-N 3.32Å; V135-G137 PolarHBondContact O-N 3.14Å; V135-A138 PolarHBondContact O-N 2.94Å; V135-I139 HydrophobicContact CG1-CD1 3.69Å; V135-I139 HydrophobicContact CG1-CG1 4.39Å; V135-I139 WeakPolarHBondContact O-CG1 3.48Å; V135-I139 PolarHBondContact O-N 2.8Å; V135-T166 HydrophobicContact CB-CG2 4.49Å; V135-T166 HydrophobicContact CG2-CG2 3.94Å; V135-L167 HydrophobicContact CG2-CD2 3.76Å; V135-L167 HydrophobicContact CG2-CG 4.22Å; V135-V169 HydrophobicContact CG1-CG1 3.51Å; V135-V169 HydrophobicContact CG2-CG1 4.27Å; V135-L170 HydrophobicContact CG1-CD2 4.27Å; V135-L170 HydrophobicContact CG2-CD1 4.35Å; V135-L170 HydrophobicContact CG2-CG 4.36Å
136	A	90.3	Very high	87.5	Confident	61 Å²	61	30 Å²	30	50%	0.504	17%	0.17	S	C	.	.	H	α-helix	trans	-60.1	-43.7	177.9	0	0	0	0	0	111.5	D132 A133 S140	D132-A136 WeakPolarHBondContact O-CB 3.36Å; D132-A136 PolarHBondContact O-N 3.16Å; A133-A136 PolarHBondContact O-N 3.42Å; A136-S140 VanDerWaalsContact O-CB 3.24Å; A136-S140 WeakPolarHBondContact O-CB 3.42Å; A136-S140 PolarHBondContact O-N 2.92Å
137	G	89.9	Confident	86.9	Confident	11 Å²	11	31.1 Å²	31.1	11%	0.113	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-46	174.7	0	0	0	0	0	112.6	A133 L134 V135 S140 N141	A133-G137 PolarHBondContact O-N 3.27Å; L134-G137 PolarHBondContact O-N 3.46Å; V135-G137 VanDerWaalsContact C-N 3.32Å; V135-G137 PolarHBondContact O-N 3.14Å; G137-S140 PolarHBondContact O-N 2.81Å; G137-N141 WeakPolarHBondContact O-CB 2.92Å; G137-N141 PolarHBondContact O-N 2.84Å
138	A	87.8	Confident	86.4	Confident	7 Å²	7	30.1 Å²	30.1	6%	0.058	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-45.6	179.1	0	0	0	0	0	112.6	L134 V135 N141 G142 V146 L170	L134-A138 WeakPolarHBondContact O-CB 3.46Å; L134-A138 PolarHBondContact O-N 3.31Å; V135-A138 PolarHBondContact O-N 2.94Å; A138-N141 PolarHBondContact O-N 2.95Å; A138-G142 PolarHBondContact O-N 3.39Å; A138-V146 WeakPolarHBondContact O-CG2 3.28Å; A138-L170 HydrophobicContact CB-CD1 4.04Å; A138-L170 HydrophobicContact CB-CD2 4.26Å
139	I	84.8	Confident	85.8	Confident	64 Å²	64	27.4 Å²	27.4	33%	0.328	16%	0.16	S	C	.	.	H	α-helix	trans	-63.6	-42.9	176.2	-68	171.3	0	0	0	110.6	V135 N141 G142 L170	V135-I139 HydrophobicContact CG1-CD1 3.69Å; V135-I139 HydrophobicContact CG1-CG1 4.39Å; V135-I139 WeakPolarHBondContact O-CG1 3.48Å; V135-I139 PolarHBondContact O-N 2.8Å; I139-N141 VanDerWaalsContact C-N 3.35Å; I139-N141 PolarHBondContact O-N 3.45Å; I139-G142 PolarHBondContact O-N 3.45Å; I139-L170 HydrophobicContact CD1-CD2 4.17Å; I139-L170 HydrophobicContact CG1-CD2 3.63Å
140	S	85.4	Confident	85	Confident	66 Å²	66	23.7 Å²	23.7	46%	0.462	15%	0.146	S	C	.	.	H	α-helix	trans	-64.1	-38.8	-179.1	-163.2	0	0	0	0	112.3	R89 A136 G137	R89-S140 VanDerWaalsContact NH1-C 3.29Å; R89-S140 PolarHBondContact NH1-O 2.94Å; R89-S140 PolarHBondContact NH1-OG 3.42Å; A136-S140 VanDerWaalsContact O-CB 3.24Å; A136-S140 WeakPolarHBondContact O-CB 3.42Å; A136-S140 PolarHBondContact O-N 2.92Å; G137-S140 PolarHBondContact O-N 2.81Å
141	N	83.7	Confident	84.1	Confident	11 Å²	11	24.1 Å²	24.1	6%	0.059	15%	0.151	C	C	.	.	H	α-helix	trans	-83.1	-27.9	178.7	-72.1	-20.4	0	0	0	113.3	R86 R89 S90 G137 A138 I139 Y145	R86-N141 HydrophobicContact CG-CB 4.43Å; R89-N141 VanDerWaalsContact CZ-OD1 3.23Å; R89-N141 PolarHBondContact NE-OD1 2.88Å; R89-N141 PolarHBondContact NH2-OD1 2.86Å; S90-N141 PolarHBondContact OG-ND2 2.82Å; G137-N141 WeakPolarHBondContact O-CB 2.92Å; G137-N141 PolarHBondContact O-N 2.84Å; A138-N141 PolarHBondContact O-N 2.95Å; I139-N141 VanDerWaalsContact C-N 3.35Å; I139-N141 PolarHBondContact O-N 3.45Å; N141-Y145 HydrophobicContact CB-CD1 4.17Å; N141-Y145 HydrophobicContact CB-CD2 3.47Å; N141-Y145 VanDerWaalsContact CB-CD2 3.47Å; N141-Y145 HydrophobicContact CB-CE2 3.93Å; N141-Y145 HydrophobicContact CB-CG 3.63Å; N141-Y145 WeakPolarHBondContact ND2-CD1 3.37Å; N141-Y145 VanDerWaalsContact ND2-CE1 3.31Å; N141-Y145 WeakPolarHBondContact ND2-CE1 3.27Å
142	G	78.6	Confident	83.4	Confident	8 Å²	8	25.8 Å²	25.8	8%	0.082	16%	0.16	C	C	.	.			trans	64	-176.8	179.2	0	0	0	0	0	114.4	A138 I139 L144 Y145 R237	A138-G142 PolarHBondContact O-N 3.39Å; I139-G142 PolarHBondContact O-N 3.45Å; G142-L144 PolarHBondContact O-N 3.01Å; G142-L144 VanDerWaalsContact O-N 3.14Å; G142-Y145 PolarHBondContact O-N 3.35Å; G142-R237 VanDerWaalsContact C-NH2 3.34Å; G142-R237 PolarHBondContact O-NH2 3.28Å
143	G	77.7	Confident	82.2	Confident	6 Å²	6	22.5 Å²	22.5	6%	0.062	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	-114.6	174	0	0	0	0	0	113.3	Y145 V146 K147 R237	G143-Y145 VanDerWaalsContact C-N 3.27Å; G143-Y145 PolarHBondContact O-N 2.69Å; G143-Y145 VanDerWaalsContact O-N 3.17Å; G143-V146 PolarHBondContact O-N 2.81Å; G143-V146 VanDerWaalsContact O-N 3.13Å; G143-K147 PolarHBondContact O-N 3.16Å; G143-K147 VanDerWaalsContact O-N 3.09Å; G143-R237 VanDerWaalsContact CA-NH2 3.32Å
144	L	78.4	Confident	80.6	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-48.9	-42.5	-178.6	-158.1	80.6	0	0	0	114.3	G142 K147 L148 F238 D241 I242 L245 L272	G142-L144 PolarHBondContact O-N 3.01Å; G142-L144 VanDerWaalsContact O-N 3.14Å; L144-K147 PolarHBondContact O-N 3.4Å; L144-L148 HydrophobicContact CD2-CD1 4.24Å; L144-L148 HydrophobicContact CG-CD1 4.12Å; L144-L148 WeakPolarHBondContact O-CB 3.48Å; L144-L148 VanDerWaalsContact O-CG 3.31Å; L144-L148 WeakPolarHBondContact O-CG 3.23Å; L144-L148 PolarHBondContact O-N 3.46Å; L144-F238 HydrophobicContact CD1-CD2 3.49Å; L144-F238 VanDerWaalsContact CD1-CD2 3.49Å; L144-F238 HydrophobicContact CD1-CE2 3.85Å; L144-D241 HydrophobicContact CD2-CB 3.46Å; L144-D241 VanDerWaalsContact CD2-CB 3.46Å; L144-I242 HydrophobicContact CD2-CD1 3.86Å; L144-I242 HydrophobicContact CD2-CG1 3.93Å; L144-L245 HydrophobicContact CD2-CD1 4.36Å; L144-L272 HydrophobicContact CD1-CD1 4.48Å; L144-L272 HydrophobicContact CD1-CD2 3.22Å; L144-L272 HydrophobicContact CD1-CG 3.9Å; L144-L272 HydrophobicContact CG-CD2 3.79Å
145	Y	83.8	Confident	79.4	Confident	18 Å²	18	21 Å²	21	7%	0.071	13%	0.134	C	C	.	.	H	α-helix	trans	-70.8	-36.8	-175.7	-69.7	-104.6	0	0	0	112.1	S90 N141 G142 G143 K147 L148 G149 D241 L245	S90-Y145 VanDerWaalsContact OG-CE1 3.3Å; S90-Y145 WeakPolarHBondContact OG-CE1 3.49Å; S90-Y145 PolarHBondContact OG-OH 2.77Å; N141-Y145 HydrophobicContact CB-CD1 4.17Å; N141-Y145 HydrophobicContact CB-CD2 3.47Å; N141-Y145 VanDerWaalsContact CB-CD2 3.47Å; N141-Y145 HydrophobicContact CB-CE2 3.93Å; N141-Y145 HydrophobicContact CB-CG 3.63Å; N141-Y145 WeakPolarHBondContact ND2-CD1 3.37Å; N141-Y145 VanDerWaalsContact ND2-CE1 3.31Å; N141-Y145 WeakPolarHBondContact ND2-CE1 3.27Å; G142-Y145 PolarHBondContact O-N 3.35Å; G143-Y145 VanDerWaalsContact C-N 3.27Å; G143-Y145 PolarHBondContact O-N 2.69Å; G143-Y145 VanDerWaalsContact O-N 3.17Å; Y145-K147 VanDerWaalsContact C-N 3.33Å; Y145-L148 PolarHBondContact O-N 3.25Å; Y145-G149 PolarHBondContact O-N 2.7Å; Y145-D241 HydrophobicContact CE2-CB 4.2Å; Y145-L245 HydrophobicContact CD1-CD2 4.25Å; Y145-L245 HydrophobicContact CE1-CD2 3.72Å; Y145-L245 HydrophobicContact CE1-CG 4.26Å
146	V	80.6	Confident	77.9	Confident	13 Å²	13	23.4 Å²	23.4	8%	0.079	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-45	173	176.1	0	0	0	0	109.3	A138 G143 L148 G149 Q150 L170	A138-V146 WeakPolarHBondContact O-CG2 3.28Å; G143-V146 PolarHBondContact O-N 2.81Å; G143-V146 VanDerWaalsContact O-N 3.13Å; V146-L148 PolarHBondContact O-N 2.78Å; V146-G149 PolarHBondContact O-N 2.92Å; V146-Q150 WeakPolarHBondContact O-CG 3.23Å; V146-Q150 PolarHBondContact O-N 3.13Å; V146-L170 HydrophobicContact CG1-CB 4.17Å; V146-L170 HydrophobicContact CG1-CD2 4.38Å
147	K	78.8	Confident	76.2	Confident	25 Å²	25	22.7 Å²	22.7	11%	0.109	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-38.6	179.3	-175.3	53.9	160.9	-171.4	0	113.1	G143 L144 Y145 G149 Q150 G151 S210 L211 L272 E275	G143-K147 PolarHBondContact O-N 3.16Å; G143-K147 VanDerWaalsContact O-N 3.09Å; L144-K147 PolarHBondContact O-N 3.4Å; Y145-K147 VanDerWaalsContact C-N 3.33Å; K147-G149 VanDerWaalsContact C-N 3.33Å; K147-Q150 HydrophobicContact CD-CB 4.47Å; K147-Q150 VanDerWaalsContact CD-OE1 3.23Å; K147-Q150 WeakPolarHBondContact O-CB 3.04Å; K147-Q150 PolarHBondContact O-N 2.84Å; K147-G151 PolarHBondContact O-N 3.13Å; K147-S210 WeakPolarHBondContact CD-OG 3.48Å; K147-L211 HydrophobicContact CB-CD2 4.21Å; K147-L211 HydrophobicContact CG-CD1 4.23Å; K147-L211 HydrophobicContact CG-CD2 4.21Å; K147-L211 HydrophobicContact CG-CG 4.22Å; K147-L272 HydrophobicContact CB-CD1 4.28Å; K147-L272 HydrophobicContact CG-CD1 3.39Å; K147-E275 WeakPolarHBondContact CE-OE1 3.4Å; K147-E275 WeakPolarHBondContact CE-OE2 3.36Å; K147-E275 VanDerWaalsContact NZ-CD 3.28Å; K147-E275 IonicContact NZ-OE1 3.36Å; K147-E275 PolarHBondContact NZ-OE1 3.12Å; K147-E275 VanDerWaalsContact NZ-OE1 3.12Å; K147-E275 IonicContact NZ-OE2 3.97Å; K147-E275 PolarHBondContact NZ-OE2 2.79Å
148	L	79.5	Confident	74.7	Confident	14 Å²	14	22.2 Å²	22.2	7%	0.073	13%	0.128	C	C	.	.	H	α-helix	trans	-64.7	-39.6	173	-73.1	165.7	0	0	0	111.5	L144 Y145 V146 G151 L152 L245 L265 L268 L272	L144-L148 HydrophobicContact CD2-CD1 4.24Å; L144-L148 HydrophobicContact CG-CD1 4.12Å; L144-L148 WeakPolarHBondContact O-CB 3.48Å; L144-L148 VanDerWaalsContact O-CG 3.31Å; L144-L148 WeakPolarHBondContact O-CG 3.23Å; L144-L148 PolarHBondContact O-N 3.46Å; Y145-L148 PolarHBondContact O-N 3.25Å; V146-L148 PolarHBondContact O-N 2.78Å; L148-G151 CarbonylContact O-C 3.52Å; L148-G151 PolarHBondContact O-N 3.42Å; L148-L152 WeakPolarHBondContact O-CG 3.46Å; L148-L152 PolarHBondContact O-N 3.08Å; L148-L245 HydrophobicContact CD1-CD1 3.1Å; L148-L245 HydrophobicContact CD1-CG 4.47Å; L148-L265 HydrophobicContact CD2-CD1 4.39Å; L148-L268 HydrophobicContact CD2-CB 3.97Å; L148-L268 HydrophobicContact CD2-CD1 4.26Å; L148-L272 HydrophobicContact CD2-CD2 3.94Å; L148-L272 HydrophobicContact CG-CD2 4.03Å
149	G	80.6	Confident	73.9	Confident	4 Å²	4	23 Å²	23	4%	0.041	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-42.9	171.2	0	0	0	0	0	113.1	Y145 V146 K147 G151 L152 C153	Y145-G149 PolarHBondContact O-N 2.7Å; V146-G149 PolarHBondContact O-N 2.92Å; K147-G149 VanDerWaalsContact C-N 3.33Å; G149-G151 VanDerWaalsContact C-N 3.33Å; G149-G151 PolarHBondContact O-N 3.34Å; G149-L152 WeakPolarHBondContact O-CB 3.34Å; G149-L152 PolarHBondContact O-N 3.4Å; G149-C153 PolarHBondContact O-N 3.14Å; G149-C153 PolarHBondContact O-SG 3.25Å
150	Q	76.6	Confident	73.4	Confident	26 Å²	26	21 Å²	21	12%	0.121	12%	0.122	C	C	.	.	H	α-helix	trans	-60.9	-41.5	171.8	-67.1	172.1	-11.3	0	0	111.7	V146 K147 L152 C153 S154 L170 E171 S210	V146-Q150 WeakPolarHBondContact O-CG 3.23Å; V146-Q150 PolarHBondContact O-N 3.13Å; K147-Q150 HydrophobicContact CD-CB 4.47Å; K147-Q150 VanDerWaalsContact CD-OE1 3.23Å; K147-Q150 WeakPolarHBondContact O-CB 3.04Å; K147-Q150 PolarHBondContact O-N 2.84Å; Q150-L152 VanDerWaalsContact C-N 3.32Å; Q150-L152 PolarHBondContact O-N 3.24Å; Q150-C153 WeakPolarHBondContact O-CB 3.17Å; Q150-C153 PolarHBondContact O-N 3.36Å; Q150-S154 PolarHBondContact O-N 3.17Å; Q150-S154 PolarHBondContact O-OG 3.12Å; Q150-S154 VanDerWaalsContact O-OG 3.06Å; Q150-L170 HydrophobicContact CG-CB 4.23Å; Q150-L170 PolarHBondContact NE2-O 2.77Å; Q150-E171 HydrophobicContact CG-CG 4.27Å; Q150-S210 VanDerWaalsContact OE1-CB 3.31Å; Q150-S210 PolarHBondContact OE1-OG 3.11Å
151	G	73.1	Confident	73	Confident	10 Å²	10	21.3 Å²	21.3	10%	0.103	12%	0.122	C	C	.	.	H	α-helix	trans	-60.2	-41.5	173.7	0	0	0	0	0	112.1	K147 L148 G149 S154 F155	K147-G151 PolarHBondContact O-N 3.13Å; L148-G151 CarbonylContact O-C 3.52Å; L148-G151 PolarHBondContact O-N 3.42Å; G149-G151 VanDerWaalsContact C-N 3.33Å; G149-G151 PolarHBondContact O-N 3.34Å; G151-S154 VanDerWaalsContact O-CB 3.22Å; G151-S154 WeakPolarHBondContact O-CB 3.34Å; G151-S154 PolarHBondContact O-N 3.48Å; G151-S154 VanDerWaalsContact O-N 3.17Å; G151-F155 WeakPolarHBondContact O-CD2 3.47Å
152	L	75.1	Confident	73.1	Confident	36 Å²	36	22 Å²	22	19%	0.188	13%	0.125	C	C	.	.	H	α-helix	trans	-65.7	-38.1	175.3	-71.5	171.9	0	0	0	112.6	L134 L148 G149 Q150 S154 F155 L159 L167 V264 L268	L134-L152 HydrophobicContact CD2-CD1 4.27Å; L148-L152 WeakPolarHBondContact O-CG 3.46Å; L148-L152 PolarHBondContact O-N 3.08Å; G149-L152 WeakPolarHBondContact O-CB 3.34Å; G149-L152 PolarHBondContact O-N 3.4Å; Q150-L152 VanDerWaalsContact C-N 3.32Å; Q150-L152 PolarHBondContact O-N 3.24Å; L152-S154 PolarHBondContact O-N 3.14Å; L152-F155 CarbonylContact O-C 3.56Å; L152-F155 WeakPolarHBondContact O-CA 3.12Å; L152-F155 PolarHBondContact O-N 2.69Å; L152-L159 HydrophobicContact CB-CD1 3.94Å; L152-L159 HydrophobicContact CD2-CD1 4.33Å; L152-L159 WeakPolarHBondContact O-CD1 3.24Å; L152-L167 HydrophobicContact CB-CD1 4.17Å; L152-V264 HydrophobicContact CD2-CG1 4.25Å; L152-L268 HydrophobicContact CD2-CD1 3.91Å; L152-L268 HydrophobicContact CG-CD1 4.14Å
153	C	68.8	Low	73.4	Confident	10 Å²	10	22.8 Å²	22.8	7%	0.068	13%	0.126	C	C	.	.	H	α-helix	trans	-55.6	-34.8	171.5	-68.8	0	0	0	0	112.4	G149 Q150 F155 N156 L167 E171	G149-C153 PolarHBondContact O-N 3.14Å; G149-C153 PolarHBondContact O-SG 3.25Å; Q150-C153 WeakPolarHBondContact O-CB 3.17Å; Q150-C153 PolarHBondContact O-N 3.36Å; C153-F155 PolarHBondContact O-N 3.41Å; C153-N156 WeakPolarHBondContact O-CB 3.42Å; C153-N156 PolarHBondContact O-N 3.32Å; C153-N156 VanDerWaalsContact O-N 3.1Å; C153-L167 WeakPolarHBondContact SG-CB 3.37Å; C153-L167 PolarHBondContact SG-O 3.42Å; C153-L167 VanDerWaalsContact SG-O 3.42Å; C153-E171 VanDerWaalsContact CB-OE1 3.27Å; C153-E171 WeakPolarHBondContact CB-OE1 3.49Å
154	S	59.9	Low	73.3	Confident	18 Å²	18	23.2 Å²	23.2	13%	0.126	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-18.2	-179.2	-53.3	0	0	0	0	112.7	Q150 G151 L152 N156 R482	Q150-S154 PolarHBondContact O-N 3.17Å; Q150-S154 PolarHBondContact O-OG 3.12Å; Q150-S154 VanDerWaalsContact O-OG 3.06Å; G151-S154 VanDerWaalsContact O-CB 3.22Å; G151-S154 WeakPolarHBondContact O-CB 3.34Å; G151-S154 PolarHBondContact O-N 3.48Å; G151-S154 VanDerWaalsContact O-N 3.17Å; L152-S154 PolarHBondContact O-N 3.14Å; S154-N156 VanDerWaalsContact C-N 3.29Å; S154-R482 PolarHBondContact OG-NE 3.29Å; S154-R482 PolarHBondContact OG-NH1 2.88Å; S154-R482 PolarHBondContact OG-NH2 3.33Å
155	F	64	Low	73.5	Confident	18 Å²	18	28.8 Å²	28.8	8%	0.079	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	40.4	169	-65.2	-75.4	0	0	0	111.6	G151 L152 C153 H157 L158 L159 V264 L268 L478	G151-F155 WeakPolarHBondContact O-CD2 3.47Å; L152-F155 CarbonylContact O-C 3.56Å; L152-F155 WeakPolarHBondContact O-CA 3.12Å; L152-F155 PolarHBondContact O-N 2.69Å; C153-F155 PolarHBondContact O-N 3.41Å; F155-H157 PolarHBondContact O-N 3.4Å; F155-L158 HydrophobicContact CB-CB 4.09Å; F155-L158 HydrophobicContact CB-CD1 3.75Å; F155-L158 HydrophobicContact CB-CG 4.06Å; F155-L158 HydrophobicContact CD1-CD1 3.32Å; F155-L158 HydrophobicContact CD1-CG 4.15Å; F155-L158 HydrophobicContact CE1-CD1 4.08Å; F155-L158 HydrophobicContact CG-CD1 3.73Å; F155-L158 HydrophobicContact CG-CG 4.49Å; F155-L158 PolarHBondContact O-N 3.36Å; F155-L159 PolarHBondContact O-N 3.44Å; F155-V264 HydrophobicContact CD2-CG1 4.07Å; F155-V264 HydrophobicContact CE2-CG1 4Å; F155-V264 HydrophobicContact CZ-CG1 4.44Å; F155-L268 HydrophobicContact CE2-CD2 3.8Å; F155-L268 HydrophobicContact CE2-CG 4.12Å; F155-L478 HydrophobicContact CE1-CD1 4.36Å
156	N	58.9	Low	73.7	Confident	63 Å²	63	29.1 Å²	29.1	34%	0.337	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-14.6	178.2	60.1	-5.6	0	0	0	116.2	C153 S154 T164 N485	C153-N156 WeakPolarHBondContact O-CB 3.42Å; C153-N156 PolarHBondContact O-N 3.32Å; C153-N156 VanDerWaalsContact O-N 3.1Å; S154-N156 VanDerWaalsContact C-N 3.29Å; N156-T164 HydrophobicContact CB-CG2 4.1Å; N156-N485 PolarHBondContact ND2-ND2 3.04Å
157	H	54	Low	73.9	Confident	47 Å²	47	28.6 Å²	28.6	22%	0.218	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-8.1	179.9	54.8	-74.1	0	0	0	112.7	F155 L470	F155-H157 PolarHBondContact O-N 3.4Å; H157-L470 WeakPolarHBondContact CD2-CD1 3.22Å
158	L	59.2	Low	73.9	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-19	173.6	-64.4	-179.9	0	0	0	112.9	F155 F261 W263 V264 F463 M467 L470	F155-L158 HydrophobicContact CB-CB 4.09Å; F155-L158 HydrophobicContact CB-CD1 3.75Å; F155-L158 HydrophobicContact CB-CG 4.06Å; F155-L158 HydrophobicContact CD1-CD1 3.32Å; F155-L158 HydrophobicContact CD1-CG 4.15Å; F155-L158 HydrophobicContact CE1-CD1 4.08Å; F155-L158 HydrophobicContact CG-CD1 3.73Å; F155-L158 HydrophobicContact CG-CG 4.49Å; F155-L158 PolarHBondContact O-N 3.36Å; L158-F261 HydrophobicContact CB-CE1 4.48Å; L158-W263 HydrophobicContact CD1-CH2 3.62Å; L158-W263 HydrophobicContact CD1-CZ2 4.08Å; L158-W263 HydrophobicContact CD1-CZ3 4.46Å; L158-W263 HydrophobicContact CD2-CH2 4.26Å; L158-W263 HydrophobicContact CD2-CZ2 4.31Å; L158-V264 HydrophobicContact CD1-CG2 4.06Å; L158-F463 WeakPolarHBondContact O-CE2 3.38Å; L158-F463 WeakPolarHBondContact O-CZ 3.49Å; L158-M467 HydrophobicContact CB-SD 4.19Å; L158-M467 HydrophobicContact CD2-CE 3.78Å; L158-M467 HydrophobicContact CD2-SD 3.3Å; L158-M467 WeakPolarHBondContact CD2-SD 3.47Å; L158-M467 HydrophobicContact CG-SD 4.37Å; L158-L470 HydrophobicContact CD2-CB 3.98Å; L158-L470 HydrophobicContact CD2-CD1 3.2Å; L158-L470 HydrophobicContact CD2-CG 4.14Å; L158-L470 HydrophobicContact CG-CD1 4.15Å
159	L	70.5	Confident	74	Confident	23 Å²	23	36 Å²	36	12%	0.12	19%	0.185	C	C	.	.	S	Bend	trans	-113.1	146.1	-170.7	-63.5	176.6	0	0	0	111.2	L152 F155 T164 L167 F261	L152-L159 HydrophobicContact CB-CD1 3.94Å; L152-L159 HydrophobicContact CD2-CD1 4.33Å; L152-L159 WeakPolarHBondContact O-CD1 3.24Å; F155-L159 PolarHBondContact O-N 3.44Å; L159-T164 HydrophobicContact CB-CG2 3.93Å; L159-L167 HydrophobicContact CD1-CD1 4.42Å; L159-F261 HydrophobicContact CD2-CE1 3.71Å; L159-F261 HydrophobicContact CD2-CZ 4.01Å
160	P	74.9	Confident	73.8	Confident	23 Å²	23	35.8 Å²	35.8	15%	0.149	18%	0.183	C	C	.	.			trans	-52.3	146.3	171.2	-24.7	32	0	0	0	111.8	H127 E162 Y163 T164	H127-P160 HydrophobicContact CB-CB 4.17Å; P160-E162 VanDerWaalsContact CB-OE2 3.24Å; P160-E162 WeakPolarHBondContact CB-OE2 3.44Å; P160-E162 PolarHBondContact O-N 3.42Å; P160-E162 VanDerWaalsContact O-N 3.08Å; P160-Y163 HydrophobicContact CB-CD2 4.1Å; P160-Y163 HydrophobicContact CG-CD2 3.99Å; P160-Y163 HydrophobicContact CG-CE2 4.28Å; P160-Y163 WeakPolarHBondContact O-CB 3.28Å; P160-Y163 PolarHBondContact O-N 3.25Å; P160-T164 PolarHBondContact O-N 3.2Å
161	P	75.9	Confident	73.5	Confident	71 Å²	71	38.5 Å²	38.5	46%	0.461	20%	0.196	S	C	.	.	H	α-helix	trans	-54.9	-33.6	-174.4	21	-31.9	0	0	0	112.5	Y163 T164 Q165	P161-Y163 PolarHBondContact O-N 3.02Å; P161-T164 PolarHBondContact O-N 2.9Å; P161-T164 PolarHBondContact O-OG1 3.18Å; P161-Q165 WeakPolarHBondContact O-CB 3.49Å; P161-Q165 VanDerWaalsContact O-CG 3.32Å; P161-Q165 WeakPolarHBondContact O-CG 3.48Å; P161-Q165 PolarHBondContact O-N 3.34Å
162	E	86.6	Confident	72.8	Confident	25 Å²	25	44.9 Å²	44.9	12%	0.117	23%	0.228	C	C	.	.	H	α-helix	trans	-57.3	-44.9	177.2	-61.6	79.1	-171.6	0	0	111.9	S124 H127 Q128 P160 T166	S124-E162 WeakPolarHBondContact CB-OE1 3.28Å; S124-E162 PolarHBondContact OG-OE1 3.26Å; H127-E162 HydrophobicContact CB-CB 3.97Å; H127-E162 HydrophobicContact CB-CG 4.08Å; H127-E162 IonicContact CD2-OE2 3.1Å; Q128-E162 HydrophobicContact CB-CB 4.21Å; Q128-E162 HydrophobicContact CB-CG 4.06Å; P160-E162 VanDerWaalsContact CB-OE2 3.24Å; P160-E162 WeakPolarHBondContact CB-OE2 3.44Å; P160-E162 PolarHBondContact O-N 3.42Å; P160-E162 VanDerWaalsContact O-N 3.08Å; E162-T166 WeakPolarHBondContact O-CB 3.47Å; E162-T166 PolarHBondContact O-N 3.1Å; E162-T166 VanDerWaalsContact O-N 3.09Å; E162-T166 PolarHBondContact O-OG1 2.81Å
163	Y	83.8	Confident	71.9	Confident	26 Å²	26	50 Å²	50	10%	0.102	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-49	174.9	-78.3	-84.9	0	0	0	111.2	Y101 H127 A130 A131 L134 P160 P161 Q165 T166 L167	Y101-Y163 WeakPolarHBondContact OH-CE2 3.5Å; Y101-Y163 PolarHBondContact OH-OH 3.49Å; H127-Y163 HydrophobicContact CB-CD2 4.39Å; H127-Y163 HydrophobicContact CB-CE2 4.15Å; A130-Y163 HydrophobicContact CB-CE1 4.3Å; A130-Y163 WeakPolarHBondContact CB-OH 3.4Å; A131-Y163 HydrophobicContact CB-CD1 3.7Å; A131-Y163 HydrophobicContact CB-CE1 4.13Å; A131-Y163 HydrophobicContact CB-CG 3.98Å; L134-Y163 HydrophobicContact CD2-CD1 4.21Å; L134-Y163 HydrophobicContact CD2-CE1 4.15Å; P160-Y163 HydrophobicContact CB-CD2 4.1Å; P160-Y163 HydrophobicContact CG-CD2 3.99Å; P160-Y163 HydrophobicContact CG-CE2 4.28Å; P160-Y163 WeakPolarHBondContact O-CB 3.28Å; P160-Y163 PolarHBondContact O-N 3.25Å; P161-Y163 PolarHBondContact O-N 3.02Å; Y163-Q165 VanDerWaalsContact C-N 3.32Å; Y163-Q165 PolarHBondContact O-N 3.44Å; Y163-T166 PolarHBondContact O-N 3.48Å; Y163-L167 HydrophobicContact CD1-CD1 4.35Å; Y163-L167 VanDerWaalsContact O-CB 3.24Å; Y163-L167 WeakPolarHBondContact O-CB 3.22Å; Y163-L167 WeakPolarHBondContact O-CD1 3.32Å; Y163-L167 VanDerWaalsContact O-CG 3.25Å; Y163-L167 WeakPolarHBondContact O-CG 3.49Å; Y163-L167 PolarHBondContact O-N 2.9Å
164	T	77.2	Confident	71.3	Confident	14 Å²	14	51.9 Å²	51.9	9%	0.086	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-35.1	-174.6	70.7	0	0	0	0	112.6	N156 L159 P160 P161 R168	N156-T164 HydrophobicContact CB-CG2 4.1Å; L159-T164 HydrophobicContact CB-CG2 3.93Å; P160-T164 PolarHBondContact O-N 3.2Å; P161-T164 PolarHBondContact O-N 2.9Å; P161-T164 PolarHBondContact O-OG1 3.18Å; T164-R168 WeakPolarHBondContact O-CG 3.44Å
165	Q	82.1	Confident	71.1	Confident	120 Å²	120	55.8 Å²	55.8	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-73.8	-43.3	177.4	-70.4	177.1	34.5	0	0	111.2	P161 Y163	P161-Q165 WeakPolarHBondContact O-CB 3.49Å; P161-Q165 VanDerWaalsContact O-CG 3.32Å; P161-Q165 WeakPolarHBondContact O-CG 3.48Å; P161-Q165 PolarHBondContact O-N 3.34Å; Y163-Q165 VanDerWaalsContact C-N 3.32Å; Y163-Q165 PolarHBondContact O-N 3.44Å
166	T	87.1	Confident	70.7	Confident	25 Å²	25	62.3 Å²	62.3	15%	0.153	31%	0.308	C	S	.	.	H	α-helix	trans	-72.6	-42.2	-175.5	-51.8	0	0	0	0	111.7	Q128 A131 D132 V135 E162 Y163 R168 V169	Q128-T166 PolarHBondContact NE2-OG1 3.33Å; A131-T166 HydrophobicContact CB-CG2 4.12Å; D132-T166 VanDerWaalsContact OD1-CG2 3.23Å; D132-T166 WeakPolarHBondContact OD1-CG2 3.41Å; V135-T166 HydrophobicContact CB-CG2 4.49Å; V135-T166 HydrophobicContact CG2-CG2 3.94Å; E162-T166 WeakPolarHBondContact O-CB 3.47Å; E162-T166 PolarHBondContact O-N 3.1Å; E162-T166 VanDerWaalsContact O-N 3.09Å; E162-T166 PolarHBondContact O-OG1 2.81Å; Y163-T166 PolarHBondContact O-N 3.48Å; T166-R168 PolarHBondContact O-N 3.47Å; T166-V169 WeakPolarHBondContact O-CG1 3.42Å; T166-V169 PolarHBondContact O-N 3.08Å
167	L	85.1	Confident	71	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-18.8	-178.8	-71.5	161.5	0	0	0	113.2	L134 V135 L152 C153 L159 Y163 V169 L170	L134-L167 HydrophobicContact CD2-CD1 4.37Å; L134-L167 HydrophobicContact CD2-CD2 4Å; L134-L167 HydrophobicContact CG-CD2 4.31Å; V135-L167 HydrophobicContact CG2-CD2 3.76Å; V135-L167 HydrophobicContact CG2-CG 4.22Å; L152-L167 HydrophobicContact CB-CD1 4.17Å; C153-L167 WeakPolarHBondContact SG-CB 3.37Å; C153-L167 PolarHBondContact SG-O 3.42Å; C153-L167 VanDerWaalsContact SG-O 3.42Å; L159-L167 HydrophobicContact CD1-CD1 4.42Å; Y163-L167 HydrophobicContact CD1-CD1 4.35Å; Y163-L167 VanDerWaalsContact O-CB 3.24Å; Y163-L167 WeakPolarHBondContact O-CB 3.22Å; Y163-L167 WeakPolarHBondContact O-CD1 3.32Å; Y163-L167 VanDerWaalsContact O-CG 3.25Å; Y163-L167 WeakPolarHBondContact O-CG 3.49Å; Y163-L167 PolarHBondContact O-N 2.9Å; L167-V169 PolarHBondContact O-N 3.45Å; L167-V169 VanDerWaalsContact O-N 3.09Å; L167-L170 HydrophobicContact CD2-CD1 3.61Å; L167-L170 WeakPolarHBondContact O-CB 3.41Å; L167-L170 WeakPolarHBondContact O-CG 3.43Å; L167-L170 PolarHBondContact O-N 2.97Å
168	R	78.6	Confident	71.3	Confident	144 Å²	144	62.1 Å²	62.1	54%	0.543	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-30.9	176.5	-80.8	170.4	-168.9	179	4.5	113.3	T164 T166 L170 E171	T164-R168 WeakPolarHBondContact O-CG 3.44Å; T166-R168 PolarHBondContact O-N 3.47Å; R168-L170 PolarHBondContact O-N 3.44Å; R168-E171 WeakPolarHBondContact O-CB 3.17Å; R168-E171 PolarHBondContact O-N 3.17Å
169	V	81.5	Confident	71.7	Confident	50 Å²	50	68.7 Å²	68.7	30%	0.303	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-21.7	176.7	75	0	0	0	0	113	V135 T166 L167 E171 R173	V135-V169 HydrophobicContact CG1-CG1 3.51Å; V135-V169 HydrophobicContact CG2-CG1 4.27Å; T166-V169 WeakPolarHBondContact O-CG1 3.42Å; T166-V169 PolarHBondContact O-N 3.08Å; L167-V169 PolarHBondContact O-N 3.45Å; L167-V169 VanDerWaalsContact O-N 3.09Å; V169-E171 VanDerWaalsContact C-N 3.34Å; V169-R173 WeakPolarHBondContact O-CG 3.09Å
170	L	77.3	Confident	71.8	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-75.5	-21.8	176	-58.5	179.8	0	0	0	112.4	V135 A138 I139 V146 Q150 L167 R168	V135-L170 HydrophobicContact CG1-CD2 4.27Å; V135-L170 HydrophobicContact CG2-CD1 4.35Å; V135-L170 HydrophobicContact CG2-CG 4.36Å; A138-L170 HydrophobicContact CB-CD1 4.04Å; A138-L170 HydrophobicContact CB-CD2 4.26Å; I139-L170 HydrophobicContact CD1-CD2 4.17Å; I139-L170 HydrophobicContact CG1-CD2 3.63Å; V146-L170 HydrophobicContact CG1-CB 4.17Å; V146-L170 HydrophobicContact CG1-CD2 4.38Å; Q150-L170 HydrophobicContact CG-CB 4.23Å; Q150-L170 PolarHBondContact NE2-O 2.77Å; L167-L170 HydrophobicContact CD2-CD1 3.61Å; L167-L170 WeakPolarHBondContact O-CB 3.41Å; L167-L170 WeakPolarHBondContact O-CG 3.43Å; L167-L170 PolarHBondContact O-N 2.97Å; R168-L170 PolarHBondContact O-N 3.44Å
171	E	69.2	Low	72.2	Confident	83 Å²	83	76.1 Å²	76.1	39%	0.388	37%	0.374	S	S	.	.	H	α-helix	trans	-73	-37	177.5	-64.1	178.9	168.7	0	0	111.6	Q150 C153 R168 V169	Q150-E171 HydrophobicContact CG-CG 4.27Å; C153-E171 VanDerWaalsContact CB-OE1 3.27Å; C153-E171 WeakPolarHBondContact CB-OE1 3.49Å; R168-E171 WeakPolarHBondContact O-CB 3.17Å; R168-E171 PolarHBondContact O-N 3.17Å; V169-E171 VanDerWaalsContact C-N 3.34Å
172	D	58.9	Low	72.7	Confident	145 Å²	145	72.8 Å²	72.8	78%	0.775	35%	0.352	S	S	*	.	H	α-helix	trans	-85.4	-14	-174.1	-71.2	-32	0	0	0	114.6	A174	D172-A174 PolarHBondContact O-N 2.9Å
173	R	56.1	Low	73	Confident	143 Å²	143	73.9 Å²	73.9	54%	0.54	36%	0.359	S	S	.	.			trans	-95.2	94.2	-174	-73	-172.1	-176.6	-149.6	4.1	112.3	V169	V169-R173 WeakPolarHBondContact O-CG 3.09Å
174	A	56.9	Low	73.2	Confident	49 Å²	49	76.5 Å²	76.5	41%	0.405	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-86.8	125.2	164.2	0	0	0	0	0	111.1	D172 A208	D172-A174 PolarHBondContact O-N 2.9Å; A174-A208 HydrophobicContact CB-CB 3.81Å; A174-A208 WeakPolarHBondContact CB-O 3.37Å
175	L	55.7	Low	73.9	Confident	100 Å²	100	75.8 Å²	75.8	52%	0.524	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-84.1	121.7	170.9	-67.4	167.9	0	0	0	108.5	Y231	L175-Y231 PolarHBondContact O-OH 3.14Å
176	K	55.8	Low	74.4	Confident	156 Å²	156	70.1 Å²	70.1	68%	0.678	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-85.4	128.1	169.7	-62.7	-174.5	-178.1	-173.4	0	108.7	A208	K176-A208 HydrophobicContact CG-CB 4.35Å
177	R	64.8	Low	74.7	Confident	66 Å²	66	73.1 Å²	73.1	25%	0.249	36%	0.356	C	S	.	.			trans	-108.9	167.2	177.9	-65.7	-161.3	-178.9	-178.8	5.3	111.8	E181 Y231 D233	R177-E181 VanDerWaalsContact CD-OE2 3.26Å; R177-E181 WeakPolarHBondContact CD-OE2 3.42Å; R177-E181 IonicContact NH1-OE1 3.64Å; R177-E181 IonicContact NH1-OE2 2.77Å; R177-E181 PolarHBondContact NH1-OE2 3.45Å; R177-Y231 HydrophobicContact CB-CD1 4.28Å; R177-Y231 HydrophobicContact CB-CE1 4.15Å; R177-Y231 HydrophobicContact CG-CD1 4.03Å; R177-Y231 HydrophobicContact CG-CE1 3.91Å; R177-D233 IonicContact CZ-OD1 2.9Å; R177-D233 IonicContact CZ-OD2 2.72Å; R177-D233 VanDerWaalsContact NH1-CG 3.3Å; R177-D233 IonicContact NH1-OD1 3.6Å; R177-D233 PolarHBondContact NH1-OD1 2.8Å; R177-D233 IonicContact NH1-OD2 3.95Å; R177-D233 IonicContact NH2-OD1 2.92Å; R177-D233 PolarHBondContact NH2-OD1 3.49Å; R177-D233 IonicContact NH2-OD2 3.71Å; R177-D233 PolarHBondContact NH2-OD2 3.29Å
178	G	60.8	Low	75	Confident	39 Å²	39	75.6 Å²	75.6	40%	0.402	37%	0.367	S	S	.	.			trans	-74.4	155.5	-175.5	0	0	0	0	0	113.6	Q180 E181	G178-Q180 VanDerWaalsContact C-N 3.3Å; G178-Q180 PolarHBondContact O-N 2.85Å; G178-E181 PolarHBondContact O-N 3Å
179	F	66.2	Low	75.7	Confident	139 Å²	139	71.1 Å²	71.1	61%	0.61	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.4	-176.1	19.6	-88	0	0	0	114.5	E181 V182 Y203	F179-E181 VanDerWaalsContact C-N 3.25Å; F179-E181 PolarHBondContact O-N 2.99Å; F179-V182 WeakPolarHBondContact O-CB 3.49Å; F179-V182 PolarHBondContact O-N 3.25Å; F179-V182 VanDerWaalsContact O-N 3.14Å; F179-Y203 HydrophobicContact CB-CD1 3.85Å; F179-Y203 HydrophobicContact CB-CG 4.46Å
180	Q	73.2	Confident	76.3	Confident	148 Å²	148	70.7 Å²	70.7	69%	0.692	35%	0.348	S	S	*	.	H	α-helix	trans	-62.4	-28.4	-178.8	-70.6	178	-19.2	0	0	113.6	G178 V182 E184	G178-Q180 VanDerWaalsContact C-N 3.3Å; G178-Q180 PolarHBondContact O-N 2.85Å; Q180-V182 VanDerWaalsContact C-N 3.27Å; Q180-V182 PolarHBondContact O-N 2.83Å; Q180-E184 PolarHBondContact O-N 2.74Å
181	E	82.6	Confident	77.2	Confident	55 Å²	55	79.3 Å²	79.3	26%	0.257	39%	0.388	S	S	.	.	H	α-helix	trans	-68.5	-27.3	178.2	-66.2	-175.6	-170.8	0	0	112.4	R177 G178 F179 L185 I232	R177-E181 VanDerWaalsContact CD-OE2 3.26Å; R177-E181 WeakPolarHBondContact CD-OE2 3.42Å; R177-E181 IonicContact NH1-OE1 3.64Å; R177-E181 IonicContact NH1-OE2 2.77Å; R177-E181 PolarHBondContact NH1-OE2 3.45Å; G178-E181 PolarHBondContact O-N 3Å; F179-E181 VanDerWaalsContact C-N 3.25Å; F179-E181 PolarHBondContact O-N 2.99Å; E181-L185 WeakPolarHBondContact O-CB 3.49Å; E181-L185 PolarHBondContact O-N 3.23Å; E181-I232 HydrophobicContact CB-CG2 4.01Å; E181-I232 HydrophobicContact CG-CG2 3.94Å
182	V	88.3	Confident	78.4	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.006	38%	0.376	C	S	.	.	H	α-helix	trans	-70.6	-50.7	-179	-179.6	0	0	0	0	110.4	F179 Q180 E184 L185 F186 P194 F201 Y203	F179-V182 WeakPolarHBondContact O-CB 3.49Å; F179-V182 PolarHBondContact O-N 3.25Å; F179-V182 VanDerWaalsContact O-N 3.14Å; Q180-V182 VanDerWaalsContact C-N 3.27Å; Q180-V182 PolarHBondContact O-N 2.83Å; V182-E184 VanDerWaalsContact C-N 3.34Å; V182-E184 PolarHBondContact O-N 3.42Å; V182-L185 PolarHBondContact O-N 2.73Å; V182-L185 VanDerWaalsContact O-N 3.14Å; V182-F186 HydrophobicContact CG1-CD2 3.74Å; V182-F186 HydrophobicContact CG1-CE2 3.86Å; V182-F186 WeakPolarHBondContact O-CD2 3.31Å; V182-F186 PolarHBondContact O-N 3.47Å; V182-P194 HydrophobicContact CG1-CG 4.1Å; V182-F201 HydrophobicContact CG1-CE1 4.02Å; V182-F201 HydrophobicContact CG1-CZ 4.01Å; V182-Y203 HydrophobicContact CB-CE1 4.45Å; V182-Y203 HydrophobicContact CG1-CE1 4.47Å
183	D	91.4	Very high	80.1	Confident	48 Å²	48	71.2 Å²	71.2	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-60.3	-44	-178.7	-72.5	-18.1	0	0	0	111.7	L185 F186 L187 L193 P194 Y203	D183-L185 VanDerWaalsContact C-N 3.3Å; D183-L185 PolarHBondContact O-N 3.1Å; D183-F186 PolarHBondContact O-N 3.48Å; D183-L187 WeakPolarHBondContact O-CB 3.37Å; D183-L187 WeakPolarHBondContact O-CG 3.3Å; D183-L187 PolarHBondContact O-N 2.94Å; D183-L193 HydrophobicContact CB-CD2 3.67Å; D183-P194 VanDerWaalsContact OD1-CD 3.27Å; D183-P194 WeakPolarHBondContact OD1-CD 3.5Å; D183-Y203 VanDerWaalsContact OD1-CE1 3.26Å; D183-Y203 WeakPolarHBondContact OD1-CE1 3.42Å; D183-Y203 PolarHBondContact OD1-OH 2.9Å
184	E	88.6	Confident	81.9	Confident	80 Å²	80	64.4 Å²	64.4	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-60.2	-40.6	176.4	-72.1	-174.8	-167.7	0	0	112.3	R75 Q180 V182 E188 I232	R75-E184 IonicContact CZ-OE2 3.6Å; R75-E184 IonicContact NH1-OE2 3.32Å; R75-E184 PolarHBondContact NH1-OE2 3.19Å; R75-E184 IonicContact NH2-OE2 2.77Å; Q180-E184 PolarHBondContact O-N 2.74Å; V182-E184 VanDerWaalsContact C-N 3.34Å; V182-E184 PolarHBondContact O-N 3.42Å; E184-E188 WeakPolarHBondContact O-CG 3.32Å; E184-E188 PolarHBondContact O-N 3.42Å; E184-E188 VanDerWaalsContact O-N 3.08Å; E184-I232 HydrophobicContact CB-CD1 3.5Å; E184-I232 VanDerWaalsContact CB-CD1 3.5Å
185	L	91.1	Very high	83.7	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-42.8	-180	-171.4	154	0	0	0	110.9	E181 V182 D183 E188 D189 V229 Q230 I232 R311 V312	E181-L185 WeakPolarHBondContact O-CB 3.49Å; E181-L185 PolarHBondContact O-N 3.23Å; V182-L185 PolarHBondContact O-N 2.73Å; V182-L185 VanDerWaalsContact O-N 3.14Å; D183-L185 VanDerWaalsContact C-N 3.3Å; D183-L185 PolarHBondContact O-N 3.1Å; L185-E188 PolarHBondContact O-N 2.78Å; L185-D189 PolarHBondContact O-N 3.49Å; L185-V229 HydrophobicContact CD1-CG1 3.89Å; L185-V229 HydrophobicContact CD2-CG1 4.09Å; L185-V229 HydrophobicContact CG-CG1 4.46Å; L185-Q230 WeakPolarHBondContact CD1-O 3.5Å; L185-I232 HydrophobicContact CB-CD1 4.04Å; L185-I232 HydrophobicContact CB-CG1 4.42Å; L185-I232 HydrophobicContact CD1-CB 4.46Å; L185-R311 HydrophobicContact CD1-CB 4.18Å; L185-R311 HydrophobicContact CD2-CB 4.1Å; L185-R311 HydrophobicContact CG-CB 4.41Å; L185-V312 HydrophobicContact CD2-CG2 3.19Å
186	F	93.9	Very high	85.5	Confident	1 Å²	1	68.2 Å²	68.2	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-42.5	177.2	-93.9	-94	0	0	0	112.4	V182 D183 E188 D189 F190 Q191 A192 P194 L197 F198 F201 V227 V229 V312	V182-F186 HydrophobicContact CG1-CD2 3.74Å; V182-F186 HydrophobicContact CG1-CE2 3.86Å; V182-F186 WeakPolarHBondContact O-CD2 3.31Å; V182-F186 PolarHBondContact O-N 3.47Å; D183-F186 PolarHBondContact O-N 3.48Å; F186-E188 VanDerWaalsContact C-N 3.31Å; F186-E188 PolarHBondContact O-N 2.71Å; F186-D189 PolarHBondContact O-N 3.49Å; F186-F190 AromaticContact CD1-CD2 3.64Å; F186-F190 HydrophobicContact CD1-CD2 3.64Å; F186-F190 HydrophobicContact CD1-CE2 4.05Å; F186-F190 HydrophobicContact CE1-CD2 4.01Å; F186-F190 AromaticContact CE1-CE2 3.98Å; F186-F190 HydrophobicContact CE1-CE2 3.98Å; F186-F190 HydrophobicContact CG-CD2 4.32Å; F186-F190 WeakPolarHBondContact O-CA 3.39Å; F186-F190 WeakPolarHBondContact O-CB 3.32Å; F186-F190 PolarHBondContact O-N 2.74Å; F186-Q191 PolarHBondContact O-N 3.45Å; F186-A192 CarbonylContact C-O 3.48Å; F186-A192 WeakPolarHBondContact CB-O 3.23Å; F186-P194 HydrophobicContact CB-CG 4.2Å; F186-P194 HydrophobicContact CD1-CG 4.17Å; F186-P194 HydrophobicContact CD2-CG 3.86Å; F186-P194 HydrophobicContact CE2-CG 4.25Å; F186-P194 HydrophobicContact CG-CG 3.8Å; F186-L197 HydrophobicContact CD1-CD1 3.49Å; F186-L197 VanDerWaalsContact CD1-CD1 3.49Å; F186-L197 HydrophobicContact CE1-CD1 3.78Å; F186-F198 AromaticContact CE1-CE2 3.79Å; F186-F198 HydrophobicContact CE1-CE2 3.79Å; F186-F198 AromaticContact CZ-CE2 4Å; F186-F198 HydrophobicContact CZ-CE2 4Å; F186-F201 HydrophobicContact CZ-CE2 4.35Å; F186-V227 HydrophobicContact CZ-CG1 3.94Å; F186-V229 HydrophobicContact CE2-CG2 3.85Å; F186-V312 HydrophobicContact CE1-CG1 4.42Å; F186-V312 HydrophobicContact CE2-CG1 4.31Å; F186-V312 HydrophobicContact CE2-CG2 4.08Å; F186-V312 HydrophobicContact CZ-CG1 3.79Å; F186-V312 HydrophobicContact CZ-CG2 4.22Å
187	L	92.8	Very high	87.4	Confident	87 Å²	87	62.2 Å²	62.2	46%	0.455	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-38.9	173.2	-74.4	170.9	0	0	0	112.3	D183 Q191 A192 L193	D183-L187 WeakPolarHBondContact O-CB 3.37Å; D183-L187 WeakPolarHBondContact O-CG 3.3Å; D183-L187 PolarHBondContact O-N 2.94Å; L187-Q191 VanDerWaalsContact O-CA 3.23Å; L187-Q191 WeakPolarHBondContact O-CA 3.44Å; L187-Q191 PolarHBondContact O-N 3.01Å; L187-Q191 VanDerWaalsContact O-N 3.12Å; L187-A192 PolarHBondContact N-O 2.8Å; L187-L193 HydrophobicContact CD1-CD2 3.94Å; L187-L193 HydrophobicContact CD2-CD2 4.07Å; L187-L193 HydrophobicContact CD2-CG 4.06Å; L187-L193 HydrophobicContact CG-CD2 3.78Å; L187-L193 HydrophobicContact CG-CG 4.33Å
188	E	91.3	Very high	88.9	Confident	54 Å²	54	59.1 Å²	59.1	25%	0.252	29%	0.294	S	S	.	.	H	α-helix	trans	-71.4	-37.4	178.1	-73.9	-172.6	168.5	0	0	113.7	R72 R75 E184 L185 F186 R311	R72-E188 IonicContact NE-OE1 3.87Å; R75-E188 IonicContact CZ-OE1 3.97Å; R75-E188 IonicContact NH2-OE1 3.27Å; R75-E188 PolarHBondContact NH2-OE1 2.69Å; E184-E188 WeakPolarHBondContact O-CG 3.32Å; E184-E188 PolarHBondContact O-N 3.42Å; E184-E188 VanDerWaalsContact O-N 3.08Å; L185-E188 PolarHBondContact O-N 2.78Å; F186-E188 VanDerWaalsContact C-N 3.31Å; F186-E188 PolarHBondContact O-N 2.71Å; E188-R311 IonicContact OE2-CZ 3.12Å; E188-R311 VanDerWaalsContact OE2-CZ 3.28Å; E188-R311 IonicContact OE2-NH1 2.91Å; E188-R311 PolarHBondContact OE2-NH1 3.18Å; E188-R311 IonicContact OE2-NH2 2.61Å; E188-R311 PolarHBondContact OE2-NH2 3.31Å
189	D	93.4	Very high	90.6	Very high	49 Å²	49	61.9 Å²	61.9	26%	0.262	30%	0.297	S	S	.	.	H	α-helix	trans	-91.2	-33.3	-174.7	-86.8	4.3	0	0	0	114	L185 F186 S309 R311	L185-D189 PolarHBondContact O-N 3.49Å; F186-D189 PolarHBondContact O-N 3.49Å; D189-S309 WeakPolarHBondContact OD2-CB 3.5Å; D189-S309 PolarHBondContact OD2-OG 2.9Å; D189-R311 IonicContact OD1-CZ 2.63Å; D189-R311 IonicContact OD1-NE 3.35Å; D189-R311 PolarHBondContact OD1-NE 2.81Å; D189-R311 IonicContact OD1-NH2 3.12Å; D189-R311 PolarHBondContact OD1-NH2 3.07Å; D189-R311 WeakPolarHBondContact OD2-CB 3.5Å; D189-R311 IonicContact OD2-NE 3.52Å; D189-R311 PolarHBondContact OD2-NE 2.82Å
190	F	95.1	Very high	92.1	Very high	42 Å²	42	60.4 Å²	60.4	18%	0.184	29%	0.292	C	S	.	.	H	α-helix	trans	-120.9	-6.7	-173.3	-58.6	-77.9	0	0	0	113.7	F186 A192 L197 V312	F186-F190 AromaticContact CD1-CD2 3.64Å; F186-F190 HydrophobicContact CD1-CD2 3.64Å; F186-F190 HydrophobicContact CD1-CE2 4.05Å; F186-F190 HydrophobicContact CE1-CD2 4.01Å; F186-F190 AromaticContact CE1-CE2 3.98Å; F186-F190 HydrophobicContact CE1-CE2 3.98Å; F186-F190 HydrophobicContact CG-CD2 4.32Å; F186-F190 WeakPolarHBondContact O-CA 3.39Å; F186-F190 WeakPolarHBondContact O-CB 3.32Å; F186-F190 PolarHBondContact O-N 2.74Å; F190-A192 PolarHBondContact O-N 3.27Å; F190-A192 VanDerWaalsContact O-N 3.15Å; F190-L197 HydrophobicContact CB-CD1 3.88Å; F190-L197 HydrophobicContact CD2-CD1 4.23Å; F190-L197 HydrophobicContact CG-CD1 4.04Å; F190-V312 HydrophobicContact CE2-CB 3.79Å; F190-V312 HydrophobicContact CE2-CG1 4.15Å; F190-V312 HydrophobicContact CE2-CG2 3.76Å; F190-V312 HydrophobicContact CZ-CB 4Å; F190-V312 HydrophobicContact CZ-CG1 4.33Å; F190-V312 HydrophobicContact CZ-CG2 4.46Å
191	Q	95.2	Very high	93.2	Very high	180 Å²	180	54.5 Å²	54.5	84%	0.841	26%	0.264	S	S	*	.	S	Bend	trans	55.9	24.9	-172.7	-55.1	-176.6	-44.5	0	0	113.4	F186 L187	F186-Q191 PolarHBondContact O-N 3.45Å; L187-Q191 VanDerWaalsContact O-CA 3.23Å; L187-Q191 WeakPolarHBondContact O-CA 3.44Å; L187-Q191 PolarHBondContact O-N 3.01Å; L187-Q191 VanDerWaalsContact O-N 3.12Å
192	A	94.6	Very high	93.7	Very high	16 Å²	16	55.4 Å²	55.4	13%	0.132	27%	0.27	C	S	.	.	S	Bend	trans	-148.3	154.2	-176.8	0	0	0	0	0	109.5	F186 L187 F190 E196 L197	F186-A192 CarbonylContact C-O 3.48Å; F186-A192 WeakPolarHBondContact CB-O 3.23Å; L187-A192 PolarHBondContact N-O 2.8Å; F190-A192 PolarHBondContact O-N 3.27Å; F190-A192 VanDerWaalsContact O-N 3.15Å; A192-E196 WeakPolarHBondContact CA-OE2 3.13Å; A192-E196 HydrophobicContact CB-CB 4.25Å; A192-L197 HydrophobicContact CB-CD1 4.13Å; A192-L197 HydrophobicContact CB-CG 4.25Å
193	L	94.8	Very high	93.9	Very high	42 Å²	42	58.6 Å²	58.6	22%	0.22	28%	0.283	C	S	.	.			trans	-83.8	159.4	175.3	-68.9	168.3	0	0	0	111.3	D183 L187 H195 E196 L197	D183-L193 HydrophobicContact CB-CD2 3.67Å; L187-L193 HydrophobicContact CD1-CD2 3.94Å; L187-L193 HydrophobicContact CD2-CD2 4.07Å; L187-L193 HydrophobicContact CD2-CG 4.06Å; L187-L193 HydrophobicContact CG-CD2 3.78Å; L187-L193 HydrophobicContact CG-CG 4.33Å; L193-H195 VanDerWaalsContact C-N 3.26Å; L193-H195 VanDerWaalsContact CB-CE1 3.47Å; L193-H195 WeakPolarHBondContact CB-CE1 3.47Å; L193-H195 VanDerWaalsContact CD1-CE1 3.4Å; L193-H195 WeakPolarHBondContact CD1-CE1 3.43Å; L193-H195 PolarHBondContact O-N 3.44Å; L193-E196 HydrophobicContact CB-CG 4.42Å; L193-E196 PolarHBondContact N-OE2 3.01Å; L193-E196 WeakPolarHBondContact O-CB 3.49Å; L193-E196 PolarHBondContact O-N 3.24Å; L193-L197 PolarHBondContact O-N 3.49Å
194	P	94.4	Very high	93.8	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-54	-39.7	179.9	-27.3	34.6	0	0	0	113.9	V182 D183 F186 E196 L197 F198 F201 Y203	V182-P194 HydrophobicContact CG1-CG 4.1Å; D183-P194 VanDerWaalsContact OD1-CD 3.27Å; D183-P194 WeakPolarHBondContact OD1-CD 3.5Å; F186-P194 HydrophobicContact CB-CG 4.2Å; F186-P194 HydrophobicContact CD1-CG 4.17Å; F186-P194 HydrophobicContact CD2-CG 3.86Å; F186-P194 HydrophobicContact CE2-CG 4.25Å; F186-P194 HydrophobicContact CG-CG 3.8Å; P194-E196 PolarHBondContact O-N 3.31Å; P194-L197 PolarHBondContact O-N 3.22Å; P194-L197 VanDerWaalsContact O-N 3.17Å; P194-F198 HydrophobicContact CB-CD2 4.49Å; P194-F198 WeakPolarHBondContact O-CB 3.29Å; P194-F198 VanDerWaalsContact O-CD2 3.25Å; P194-F198 WeakPolarHBondContact O-CD2 3.37Å; P194-F198 PolarHBondContact O-N 3.19Å; P194-F201 HydrophobicContact CB-CB 4.08Å; P194-F201 HydrophobicContact CB-CD1 3.87Å; P194-F201 HydrophobicContact CB-CD2 3.82Å; P194-F201 HydrophobicContact CB-CE1 4.25Å; P194-F201 HydrophobicContact CB-CE2 4.2Å; P194-F201 HydrophobicContact CB-CG 3.64Å; P194-F201 HydrophobicContact CB-CZ 4.4Å; P194-F201 HydrophobicContact CG-CD1 4.48Å; P194-F201 HydrophobicContact CG-CE1 4.48Å; P194-Y203 HydrophobicContact CG-CE1 4.49Å
195	H	93.1	Very high	93.8	Very high	117 Å²	117	60.2 Å²	60.2	54%	0.542	29%	0.29	S	S	.	.	H	α-helix	trans	-70.4	-11.9	179.8	66.8	-97	0	0	0	114.4	L193 F198	L193-H195 VanDerWaalsContact C-N 3.26Å; L193-H195 VanDerWaalsContact CB-CE1 3.47Å; L193-H195 WeakPolarHBondContact CB-CE1 3.47Å; L193-H195 VanDerWaalsContact CD1-CE1 3.4Å; L193-H195 WeakPolarHBondContact CD1-CE1 3.43Å; L193-H195 PolarHBondContact O-N 3.44Å; H195-F198 CarbonylContact C-O 3.58Å
196	E	94.1	Very high	93.7	Very high	112 Å²	112	64.3 Å²	64.3	52%	0.523	31%	0.311	S	S	.	.	H	α-helix	trans	-88.5	-26.1	173.5	-60	179.3	95.9	0	0	111.7	A192 L193 P194	A192-E196 WeakPolarHBondContact CA-OE2 3.13Å; A192-E196 HydrophobicContact CB-CB 4.25Å; L193-E196 HydrophobicContact CB-CG 4.42Å; L193-E196 PolarHBondContact N-OE2 3.01Å; L193-E196 WeakPolarHBondContact O-CB 3.49Å; L193-E196 PolarHBondContact O-N 3.24Å; P194-E196 PolarHBondContact O-N 3.31Å
197	L	94.9	Very high	93.1	Very high	31 Å²	31	66.6 Å²	66.6	16%	0.162	33%	0.331	C	S	.	.	H	α-helix	trans	-93.5	-24.8	-179.5	-71.6	150.8	0	0	0	113.1	F186 F190 A192 L193 P194 K307	F186-L197 HydrophobicContact CD1-CD1 3.49Å; F186-L197 VanDerWaalsContact CD1-CD1 3.49Å; F186-L197 HydrophobicContact CE1-CD1 3.78Å; F190-L197 HydrophobicContact CB-CD1 3.88Å; F190-L197 HydrophobicContact CD2-CD1 4.23Å; F190-L197 HydrophobicContact CG-CD1 4.04Å; A192-L197 HydrophobicContact CB-CD1 4.13Å; A192-L197 HydrophobicContact CB-CG 4.25Å; L193-L197 PolarHBondContact O-N 3.49Å; P194-L197 PolarHBondContact O-N 3.22Å; P194-L197 VanDerWaalsContact O-N 3.17Å; L197-K307 WeakPolarHBondContact O-CE 3.36Å
198	F	97.3	Very high	92.4	Very high	1 Å²	1	63.7 Å²	63.7	0%	0.004	32%	0.319	C	S	.	.			trans	-126.2	145.3	-175	-59.3	-78.4	0	0	0	110.6	F186 P194 H195 E200 F201 A217 K218 L219 V225 V227 K307 T314	F186-F198 AromaticContact CE1-CE2 3.79Å; F186-F198 HydrophobicContact CE1-CE2 3.79Å; F186-F198 AromaticContact CZ-CE2 4Å; F186-F198 HydrophobicContact CZ-CE2 4Å; P194-F198 HydrophobicContact CB-CD2 4.49Å; P194-F198 WeakPolarHBondContact O-CB 3.29Å; P194-F198 VanDerWaalsContact O-CD2 3.25Å; P194-F198 WeakPolarHBondContact O-CD2 3.37Å; P194-F198 PolarHBondContact O-N 3.19Å; H195-F198 CarbonylContact C-O 3.58Å; F198-E200 VanDerWaalsContact C-N 3.35Å; F198-F201 HydrophobicContact CB-CB 4.44Å; F198-F201 AromaticContact CD2-CD2 3.68Å; F198-F201 HydrophobicContact CD2-CD2 3.68Å; F198-F201 HydrophobicContact CD2-CE2 4.32Å; F198-F201 HydrophobicContact CE2-CD2 4.06Å; F198-F201 HydrophobicContact CE2-CE2 4.24Å; F198-F201 HydrophobicContact CG-CD2 4.24Å; F198-A217 HydrophobicContact CB-CB 4.37Å; F198-A217 HydrophobicContact CD1-CB 3.81Å; F198-A217 HydrophobicContact CE1-CB 4.27Å; F198-A217 HydrophobicContact CG-CB 4.01Å; F198-K218 CarbonylContact C-O 3.55Å; F198-L219 HydrophobicContact CD1-CD2 3.75Å; F198-L219 HydrophobicContact CE1-CD2 3.76Å; F198-V225 HydrophobicContact CD1-CG2 4.14Å; F198-V225 HydrophobicContact CE1-CG2 3.87Å; F198-V227 HydrophobicContact CE1-CG2 3.86Å; F198-V227 HydrophobicContact CE2-CG2 4.26Å; F198-V227 HydrophobicContact CZ-CG1 4.28Å; F198-V227 HydrophobicContact CZ-CG2 3.64Å; F198-K307 HydrophobicContact CD1-CD 4.41Å; F198-K307 HydrophobicContact CE1-CB 4.5Å; F198-K307 HydrophobicContact CE1-CD 3.83Å; F198-K307 HydrophobicContact CZ-CB 4.2Å; F198-K307 HydrophobicContact CZ-CD 4.24Å; F198-T314 HydrophobicContact CE1-CG2 3.97Å; F198-T314 HydrophobicContact CZ-CG2 4.22Å
199	Q	97.3	Very high	91.5	Very high	97 Å²	97	63.4 Å²	63.4	45%	0.453	33%	0.326	S	S	.	.	S	Bend	trans	-64.1	-42.8	171.4	-175.7	-177.8	36.7	0	0	111.3	K218	Q199-K218 WeakPolarHBondContact CB-O 3.42Å; Q199-K218 PolarHBondContact N-O 2.87Å
200	E	96.8	Very high	90.5	Very high	107 Å²	107	62 Å²	62	50%	0.5	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	136	178.1	-64.4	165.6	-148.5	0	0	107.8	F198 A217 K218	F198-E200 VanDerWaalsContact C-N 3.35Å; E200-A217 CarbonylContact O-C 3.59Å; E200-A217 WeakPolarHBondContact O-CA 3.34Å; E200-A217 VanDerWaalsContact O-CB 3.28Å; E200-A217 WeakPolarHBondContact O-CB 3.44Å; E200-K218 HydrophobicContact CB-CB 3.98Å; E200-K218 PolarHBondContact N-O 3.49Å; E200-K218 PolarHBondContact O-N 3.04Å; E200-K218 IonicContact OE1-NZ 3.31Å; E200-K218 PolarHBondContact OE1-NZ 3.37Å
201	F	96.3	Very high	89.7	Confident	25 Å²	25	60.3 Å²	60.3	11%	0.11	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	117.2	175.3	-171.2	-86.2	0	0	0	109.7	V182 F186 P194 F198 Y203 H215 A217 V227	V182-F201 HydrophobicContact CG1-CE1 4.02Å; V182-F201 HydrophobicContact CG1-CZ 4.01Å; F186-F201 HydrophobicContact CZ-CE2 4.35Å; P194-F201 HydrophobicContact CB-CB 4.08Å; P194-F201 HydrophobicContact CB-CD1 3.87Å; P194-F201 HydrophobicContact CB-CD2 3.82Å; P194-F201 HydrophobicContact CB-CE1 4.25Å; P194-F201 HydrophobicContact CB-CE2 4.2Å; P194-F201 HydrophobicContact CB-CG 3.64Å; P194-F201 HydrophobicContact CB-CZ 4.4Å; P194-F201 HydrophobicContact CG-CD1 4.48Å; P194-F201 HydrophobicContact CG-CE1 4.48Å; F198-F201 HydrophobicContact CB-CB 4.44Å; F198-F201 AromaticContact CD2-CD2 3.68Å; F198-F201 HydrophobicContact CD2-CD2 3.68Å; F198-F201 HydrophobicContact CD2-CE2 4.32Å; F198-F201 HydrophobicContact CE2-CD2 4.06Å; F198-F201 HydrophobicContact CE2-CE2 4.24Å; F198-F201 HydrophobicContact CG-CD2 4.24Å; F201-Y203 HydrophobicContact CD1-CD1 4.39Å; F201-Y203 AromaticContact CD1-CD2 3.93Å; F201-Y203 HydrophobicContact CD1-CD2 3.93Å; F201-Y203 HydrophobicContact CD1-CE1 4.4Å; F201-Y203 AromaticContact CD1-CE2 3.92Å; F201-Y203 HydrophobicContact CD1-CE2 3.92Å; F201-Y203 HydrophobicContact CD1-CG 4.18Å; F201-Y203 HydrophobicContact CE1-CD1 4.28Å; F201-Y203 HydrophobicContact CE1-CE1 4.4Å; F201-Y203 HydrophobicContact CE1-CG 4.38Å; F201-Y203 PolarHBondContact O-N 2.99Å; F201-H215 HydrophobicContact CE1-CB 4.02Å; F201-H215 AromaticContact CE1-CG 3.87Å; F201-H215 AromaticContact CE1-ND1 3.86Å; F201-H215 HydrophobicContact CE2-CB 4.03Å; F201-H215 HydrophobicContact CZ-CB 3.54Å; F201-H215 AromaticContact CZ-CG 3.62Å; F201-A217 HydrophobicContact CB-CB 4.49Å; F201-A217 HydrophobicContact CD2-CB 3.68Å; F201-A217 HydrophobicContact CE2-CB 4.34Å; F201-A217 HydrophobicContact CG-CB 4.41Å; F201-V227 HydrophobicContact CE2-CB 3.99Å; F201-V227 HydrophobicContact CE2-CG1 4.03Å; F201-V227 HydrophobicContact CE2-CG2 4.09Å
202	D	94	Very high	89.3	Confident	74 Å²	74	51.9 Å²	51.9	40%	0.396	27%	0.274	S	S	.	.			trans	-84.1	107.2	177.3	-169.1	-9.4	0	0	0	110.1	Q204 H215 R216	D202-Q204 PolarHBondContact O-N 3.44Å; D202-Q204 WeakPolarHBondContact OD1-CA 3.5Å; D202-Q204 VanDerWaalsContact OD1-CB 3.28Å; D202-Q204 WeakPolarHBondContact OD1-CB 3.07Å; D202-Q204 PolarHBondContact OD1-N 2.81Å; D202-H215 WeakPolarHBondContact O-CB 3.35Å; D202-H215 PolarHBondContact O-ND1 2.94Å; D202-R216 HydrophobicContact CB-CB 4.44Å; D202-R216 VanDerWaalsContact CB-O 3.28Å; D202-R216 WeakPolarHBondContact CB-O 3.39Å; D202-R216 PolarHBondContact N-O 3.32Å
203	Y	90.8	Very high	89	Confident	68 Å²	68	51.4 Å²	51.4	27%	0.267	27%	0.269	S	S	.	.	S	Bend	trans	-68.3	-14.8	176.5	-78.2	-91.6	0	0	0	113	F179 V182 D183 P194 F201 P205 H215	F179-Y203 HydrophobicContact CB-CD1 3.85Å; F179-Y203 HydrophobicContact CB-CG 4.46Å; V182-Y203 HydrophobicContact CB-CE1 4.45Å; V182-Y203 HydrophobicContact CG1-CE1 4.47Å; D183-Y203 VanDerWaalsContact OD1-CE1 3.26Å; D183-Y203 WeakPolarHBondContact OD1-CE1 3.42Å; D183-Y203 PolarHBondContact OD1-OH 2.9Å; P194-Y203 HydrophobicContact CG-CE1 4.49Å; F201-Y203 HydrophobicContact CD1-CD1 4.39Å; F201-Y203 AromaticContact CD1-CD2 3.93Å; F201-Y203 HydrophobicContact CD1-CD2 3.93Å; F201-Y203 HydrophobicContact CD1-CE1 4.4Å; F201-Y203 AromaticContact CD1-CE2 3.92Å; F201-Y203 HydrophobicContact CD1-CE2 3.92Å; F201-Y203 HydrophobicContact CD1-CG 4.18Å; F201-Y203 HydrophobicContact CE1-CD1 4.28Å; F201-Y203 HydrophobicContact CE1-CE1 4.4Å; F201-Y203 HydrophobicContact CE1-CG 4.38Å; F201-Y203 PolarHBondContact O-N 2.99Å; Y203-P205 WeakPolarHBondContact O-CD 3.4Å; Y203-H215 PolarHBondContact O-CE1 3.14Å; Y203-H215 VanDerWaalsContact O-CE1 3.25Å
204	Q	90	Very high	88.9	Confident	140 Å²	140	51 Å²	51	65%	0.654	27%	0.268	S	S	*	.	S	Bend	trans	-79.6	116	169.4	-168.8	171	11.4	0	0	109.2	D202 I206	D202-Q204 PolarHBondContact O-N 3.44Å; D202-Q204 WeakPolarHBondContact OD1-CA 3.5Å; D202-Q204 VanDerWaalsContact OD1-CB 3.28Å; D202-Q204 WeakPolarHBondContact OD1-CB 3.07Å; D202-Q204 PolarHBondContact OD1-N 2.81Å; Q204-I206 PolarHBondContact O-N 3.49Å
205	P	89.6	Confident	88.9	Confident	21 Å²	21	51 Å²	51	14%	0.136	27%	0.268	C	S	.	.			trans	-68.7	132	-179.4	27.7	-33.9	0	0	0	110.6	Y203 A207 Q213 V214	Y203-P205 WeakPolarHBondContact O-CD 3.4Å; P205-A207 VanDerWaalsContact C-N 3.31Å; P205-Q213 HydrophobicContact CB-CB 4.06Å; P205-V214 CarbonylContact C-O 3.51Å; P205-V214 VanDerWaalsContact CA-O 3.27Å; P205-V214 WeakPolarHBondContact CA-O 3.33Å
206	I	88.3	Confident	89	Confident	86 Å²	86	51.1 Å²	51.1	44%	0.441	26%	0.264	S	S	.	.	S	Bend	trans	-73.8	-27.2	174.1	57.9	166.9	0	0	0	111.7	Q204 V214 R216 F317	Q204-I206 PolarHBondContact O-N 3.49Å; I206-V214 HydrophobicContact CD1-CG1 4.04Å; I206-V214 HydrophobicContact CG1-CB 4.22Å; I206-V214 HydrophobicContact CG1-CG1 4.04Å; I206-V214 VanDerWaalsContact CG1-O 3.25Å; I206-V214 WeakPolarHBondContact CG1-O 3.47Å; I206-V214 PolarHBondContact N-O 2.94Å; I206-R216 HydrophobicContact CG2-CB 3.96Å; I206-F317 HydrophobicContact CD1-CD2 4.32Å; I206-F317 HydrophobicContact CD1-CE2 3.74Å
207	A	82	Confident	89.2	Confident	50 Å²	50	46 Å²	46	41%	0.413	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	149.6	174.3	0	0	0	0	0	109.5	P205 V214	P205-A207 VanDerWaalsContact C-N 3.31Å; A207-V214 HydrophobicContact CB-CB 4.22Å; A207-V214 HydrophobicContact CB-CG2 4.42Å; A207-V214 PolarHBondContact N-O 3.26Å; A207-V214 PolarHBondContact O-N 3.47Å
208	A	77.6	Confident	89.3	Confident	25 Å²	25	47.3 Å²	47.3	21%	0.207	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.2	171.1	0	0	0	0	0	108	A174 K176	A174-A208 HydrophobicContact CB-CB 3.81Å; A174-A208 WeakPolarHBondContact CB-O 3.37Å; K176-A208 HydrophobicContact CG-CB 4.35Å
209	A	72.6	Confident	89.3	Confident	49 Å²	49	47.6 Å²	47.6	41%	0.405	25%	0.247	S	C	.	.			trans	-125.4	-173.8	177.6	0	0	0	0	0	109.3	A212 Y231	A209-A212 WeakPolarHBondContact CA-O 3.24Å; A209-A212 PolarHBondContact N-O 3.47Å; A209-Y231 WeakPolarHBondContact O-CE2 3.5Å; A209-Y231 PolarHBondContact O-OH 2.8Å
210	S	71.1	Confident	89.2	Confident	18 Å²	18	48.6 Å²	48.6	13%	0.126	25%	0.251	C	S	.	.	S	Bend	trans	-69.6	-32.2	-177	41.5	0	0	0	0	113.9	K147 Q150	K147-S210 WeakPolarHBondContact CD-OG 3.48Å; Q150-S210 VanDerWaalsContact OE1-CB 3.31Å; Q150-S210 PolarHBondContact OE1-OG 3.11Å
211	L	79.1	Confident	89.1	Confident	8 Å²	8	49 Å²	49	4%	0.042	26%	0.257	C	S	.	.	S	Bend	trans	-111.1	-17	-178.2	-59.9	176.7	0	0	0	115	K147 Q230 Y231 L234 L272 E275 L276	K147-L211 HydrophobicContact CB-CD2 4.21Å; K147-L211 HydrophobicContact CG-CD1 4.23Å; K147-L211 HydrophobicContact CG-CD2 4.21Å; K147-L211 HydrophobicContact CG-CG 4.22Å; L211-Q230 WeakPolarHBondContact O-CA 3.24Å; L211-Y231 WeakPolarHBondContact O-CD2 3.3Å; L211-Y231 PolarHBondContact O-N 2.85Å; L211-Y231 VanDerWaalsContact O-N 3.08Å; L211-L234 HydrophobicContact CB-CD1 4.03Å; L211-L234 HydrophobicContact CD2-CD1 3.77Å; L211-L234 HydrophobicContact CD2-CD2 4.29Å; L211-L234 WeakPolarHBondContact O-CD1 3.41Å; L211-L272 HydrophobicContact CD1-CD1 3.75Å; L211-L272 HydrophobicContact CD2-CD1 4.25Å; L211-E275 HydrophobicContact CD1-CB 3.88Å; L211-L276 HydrophobicContact CD1-CD2 4.19Å; L211-L276 HydrophobicContact CD2-CD2 4.28Å
212	A	86.6	Confident	89.1	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	165.1	-169.8	0	0	0	0	0	111.9	A209 K228 V229 Y231 F278	A209-A212 WeakPolarHBondContact CA-O 3.24Å; A209-A212 PolarHBondContact N-O 3.47Å; A212-K228 HydrophobicContact CB-CG 3.93Å; A212-V229 CarbonylContact C-O 3.59Å; A212-V229 WeakPolarHBondContact CA-O 3.39Å; A212-V229 WeakPolarHBondContact CB-O 3.49Å; A212-Y231 PolarHBondContact O-OH 2.91Å; A212-F278 HydrophobicContact CB-CE2 4.19Å; A212-F278 HydrophobicContact CB-CZ 3.67Å
213	Q	88.3	Confident	89.2	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.023	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.1	172.1	55.4	-173.3	32.6	0	0	109.8	P205 H215 K228 V229 Y231	P205-Q213 HydrophobicContact CB-CB 4.06Å; Q213-H215 WeakPolarHBondContact CG-NE2 3.38Å; Q213-H215 PolarHBondContact NE2-NE2 2.82Å; Q213-K228 CarbonylContact O-C 3.49Å; Q213-K228 WeakPolarHBondContact O-CA 3.37Å; Q213-V229 HydrophobicContact CG-CB 4.39Å; Q213-V229 PolarHBondContact N-O 2.91Å; Q213-V229 PolarHBondContact O-N 3.47Å; Q213-Y231 HydrophobicContact CB-CE1 4.34Å; Q213-Y231 HydrophobicContact CG-CE1 4.32Å
214	V	91.9	Very high	89.6	Confident	33 Å²	33	46.8 Å²	46.8	20%	0.2	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.9	-179	-173.6	0	0	0	0	108.4	P205 I206 A207 A226 V227 K228	P205-V214 CarbonylContact C-O 3.51Å; P205-V214 VanDerWaalsContact CA-O 3.27Å; P205-V214 WeakPolarHBondContact CA-O 3.33Å; I206-V214 HydrophobicContact CD1-CG1 4.04Å; I206-V214 HydrophobicContact CG1-CB 4.22Å; I206-V214 HydrophobicContact CG1-CG1 4.04Å; I206-V214 VanDerWaalsContact CG1-O 3.25Å; I206-V214 WeakPolarHBondContact CG1-O 3.47Å; I206-V214 PolarHBondContact N-O 2.94Å; A207-V214 HydrophobicContact CB-CB 4.22Å; A207-V214 HydrophobicContact CB-CG2 4.42Å; A207-V214 PolarHBondContact N-O 3.26Å; A207-V214 PolarHBondContact O-N 3.47Å; V214-A226 HydrophobicContact CG1-CB 3.97Å; V214-V227 WeakPolarHBondContact CA-O 3.23Å; V214-K228 HydrophobicContact CG2-CB 4.28Å; V214-K228 HydrophobicContact CG2-CG 4.13Å
215	H	94.4	Very high	90	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	149.2	177.3	-66	-92.4	0	0	0	110.1	F201 D202 Y203 Q213 A226 V227	F201-H215 HydrophobicContact CE1-CB 4.02Å; F201-H215 AromaticContact CE1-CG 3.87Å; F201-H215 AromaticContact CE1-ND1 3.86Å; F201-H215 HydrophobicContact CE2-CB 4.03Å; F201-H215 HydrophobicContact CZ-CB 3.54Å; F201-H215 AromaticContact CZ-CG 3.62Å; D202-H215 WeakPolarHBondContact O-CB 3.35Å; D202-H215 PolarHBondContact O-ND1 2.94Å; Y203-H215 PolarHBondContact O-CE1 3.14Å; Y203-H215 VanDerWaalsContact O-CE1 3.25Å; Q213-H215 WeakPolarHBondContact CG-NE2 3.38Å; Q213-H215 PolarHBondContact NE2-NE2 2.82Å; H215-A226 WeakPolarHBondContact O-CA 3.3Å; H215-V227 HydrophobicContact CB-CB 4.45Å; H215-V227 PolarHBondContact N-O 3.39Å; H215-V227 PolarHBondContact O-N 3.24Å
216	R	96.2	Very high	90.3	Very high	120 Å²	120	40.2 Å²	40.2	45%	0.453	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	133.9	168.2	-172.2	176.1	-178.6	-168.2	-1.4	108.3	D202 I206 F317	D202-R216 HydrophobicContact CB-CB 4.44Å; D202-R216 VanDerWaalsContact CB-O 3.28Å; D202-R216 WeakPolarHBondContact CB-O 3.39Å; D202-R216 PolarHBondContact N-O 3.32Å; I206-R216 HydrophobicContact CG2-CB 3.96Å; R216-F317 HydrophobicContact CG-CD2 4.49Å
217	A	97.4	Very high	90.7	Very high	6 Å²	6	36.1 Å²	36.1	5%	0.05	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	172.9	175.2	0	0	0	0	0	110.8	F198 E200 F201 V225 V227	F198-A217 HydrophobicContact CB-CB 4.37Å; F198-A217 HydrophobicContact CD1-CB 3.81Å; F198-A217 HydrophobicContact CE1-CB 4.27Å; F198-A217 HydrophobicContact CG-CB 4.01Å; E200-A217 CarbonylContact O-C 3.59Å; E200-A217 WeakPolarHBondContact O-CA 3.34Å; E200-A217 VanDerWaalsContact O-CB 3.28Å; E200-A217 WeakPolarHBondContact O-CB 3.44Å; F201-A217 HydrophobicContact CB-CB 4.49Å; F201-A217 HydrophobicContact CD2-CB 3.68Å; F201-A217 HydrophobicContact CE2-CB 4.34Å; F201-A217 HydrophobicContact CG-CB 4.41Å; A217-V225 HydrophobicContact CB-CG2 3.91Å; A217-V225 PolarHBondContact N-O 3.24Å; A217-V225 PolarHBondContact O-N 3.4Å; A217-V227 HydrophobicContact CB-CG2 3.75Å
218	K	98.1	Very high	91.3	Very high	58 Å²	58	35.4 Å²	35.4	25%	0.252	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.5	178.1	-165.7	176.4	170.2	-169.6	0	109.5	F198 Q199 E200 G222 T223	F198-K218 CarbonylContact C-O 3.55Å; Q199-K218 WeakPolarHBondContact CB-O 3.42Å; Q199-K218 PolarHBondContact N-O 2.87Å; E200-K218 HydrophobicContact CB-CB 3.98Å; E200-K218 PolarHBondContact N-O 3.49Å; E200-K218 PolarHBondContact O-N 3.04Å; E200-K218 IonicContact OE1-NZ 3.31Å; E200-K218 PolarHBondContact OE1-NZ 3.37Å; K218-G222 WeakPolarHBondContact CE-O 3.38Å; K218-T223 WeakPolarHBondContact CA-O 3.41Å
219	L	97.1	Very high	92.1	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.031	19%	0.192	C	C	.	.			trans	-73.2	163.3	174.9	-58.8	-173.3	0	0	0	110.8	F198 D221 G222 T223 V225 H304 K307	F198-L219 HydrophobicContact CD1-CD2 3.75Å; F198-L219 HydrophobicContact CE1-CD2 3.76Å; L219-D221 VanDerWaalsContact CB-OD1 3.29Å; L219-D221 WeakPolarHBondContact CB-OD1 3.42Å; L219-D221 PolarHBondContact O-N 3.43Å; L219-G222 WeakPolarHBondContact O-CA 3.49Å; L219-G222 PolarHBondContact O-N 3.19Å; L219-T223 HydrophobicContact CD1-CG2 4.43Å; L219-T223 PolarHBondContact N-O 3.05Å; L219-V225 HydrophobicContact CD1-CG1 3.93Å; L219-V225 HydrophobicContact CD2-CG1 4.13Å; L219-V225 HydrophobicContact CD2-CG2 4.01Å; L219-V225 HydrophobicContact CG-CG1 3.77Å; L219-V225 HydrophobicContact CG-CG2 4.26Å; L219-H304 VanDerWaalsContact CD1-CE1 3.42Å; L219-H304 WeakPolarHBondContact CD1-CE1 3.44Å; L219-H304 WeakPolarHBondContact CD1-ND1 3.49Å; L219-K307 HydrophobicContact CD2-CD 3.41Å; L219-K307 VanDerWaalsContact CD2-CD 3.41Å
220	H	95.1	Very high	92.9	Very high	119 Å²	119	32.2 Å²	32.2	55%	0.551	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.1	176.6	-64.8	-68.9	0	0	0	114.1	G222	H220-G222 PolarHBondContact O-N 2.91Å
221	D	95.2	Very high	93.7	Very high	115 Å²	115	31.7 Å²	31.7	62%	0.615	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-0.8	172.7	68.7	6.6	0	0	0	113.4	L219 T223	L219-D221 VanDerWaalsContact CB-OD1 3.29Å; L219-D221 WeakPolarHBondContact CB-OD1 3.42Å; L219-D221 PolarHBondContact O-N 3.43Å; D221-T223 VanDerWaalsContact CG-OG1 3.27Å; D221-T223 WeakPolarHBondContact OD1-CB 3.38Å; D221-T223 PolarHBondContact OD1-N 2.86Å; D221-T223 PolarHBondContact OD1-OG1 3.25Å; D221-T223 PolarHBondContact OD2-OG1 2.83Å
222	G	95.5	Very high	93.8	Very high	33 Å²	33	31.7 Å²	31.7	34%	0.34	17%	0.17	S	C	.	.	S	Bend	trans	90.5	-5.2	-179.1	0	0	0	0	0	115.2	K218 L219 H220 S224	K218-G222 WeakPolarHBondContact CE-O 3.38Å; L219-G222 WeakPolarHBondContact O-CA 3.49Å; L219-G222 PolarHBondContact O-N 3.19Å; H220-G222 PolarHBondContact O-N 2.91Å; G222-S224 PolarHBondContact O-N 2.92Å
223	T	96.8	Very high	93.3	Very high	43 Å²	43	32.4 Å²	32.4	26%	0.264	17%	0.173	S	C	.	.			trans	-63.7	128.7	179	-55.8	0	0	0	0	110.8	K218 L219 D221 V225	K218-T223 WeakPolarHBondContact CA-O 3.41Å; L219-T223 HydrophobicContact CD1-CG2 4.43Å; L219-T223 PolarHBondContact N-O 3.05Å; D221-T223 VanDerWaalsContact CG-OG1 3.27Å; D221-T223 WeakPolarHBondContact OD1-CB 3.38Å; D221-T223 PolarHBondContact OD1-N 2.86Å; D221-T223 PolarHBondContact OD1-OG1 3.25Å; D221-T223 PolarHBondContact OD2-OG1 2.83Å; T223-V225 HydrophobicContact CG2-CG1 4.3Å
224	S	98.1	Very high	92.7	Very high	45 Å²	45	32.2 Å²	32.2	32%	0.315	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.8	172.9	-67.3	0	0	0	0	110.9	G222 F317	G222-S224 PolarHBondContact O-N 2.92Å; S224-F317 WeakPolarHBondContact O-CB 3.49Å; S224-F317 PolarHBondContact O-N 3.38Å
225	V	98.2	Very high	91.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151.7	-178.4	-64.8	0	0	0	0	111.8	F198 A217 L219 T223 V227 T314 A315	F198-V225 HydrophobicContact CD1-CG2 4.14Å; F198-V225 HydrophobicContact CE1-CG2 3.87Å; A217-V225 HydrophobicContact CB-CG2 3.91Å; A217-V225 PolarHBondContact N-O 3.24Å; A217-V225 PolarHBondContact O-N 3.4Å; L219-V225 HydrophobicContact CD1-CG1 3.93Å; L219-V225 HydrophobicContact CD2-CG1 4.13Å; L219-V225 HydrophobicContact CD2-CG2 4.01Å; L219-V225 HydrophobicContact CG-CG1 3.77Å; L219-V225 HydrophobicContact CG-CG2 4.26Å; T223-V225 HydrophobicContact CG2-CG1 4.3Å; V225-V227 HydrophobicContact CG2-CG2 4.1Å; V225-T314 HydrophobicContact CB-CG2 3.9Å; V225-T314 HydrophobicContact CG1-CG2 4.21Å; V225-T314 HydrophobicContact CG2-CG2 3.93Å; V225-A315 CarbonylContact C-O 3.2Å; V225-A315 VanDerWaalsContact CA-O 3.27Å; V225-A315 WeakPolarHBondContact CA-O 3.37Å; V225-A315 WeakPolarHBondContact CB-O 3.45Å
226	A	97.4	Very high	91	Very high	22 Å²	22	37.5 Å²	37.5	18%	0.182	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	128	166.7	0	0	0	0	0	108.5	V214 H215 A315 F317	V214-A226 HydrophobicContact CG1-CB 3.97Å; H215-A226 WeakPolarHBondContact O-CA 3.3Å; A226-A315 PolarHBondContact N-O 3.17Å; A226-A315 PolarHBondContact O-N 3.19Å; A226-F317 HydrophobicContact CB-CD2 4.28Å
227	V	97	Very high	90.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	102.9	-177.9	-171.3	0	0	0	0	108.6	F186 F198 F201 V214 H215 A217 V225 V229 V312 T314	F186-V227 HydrophobicContact CZ-CG1 3.94Å; F198-V227 HydrophobicContact CE1-CG2 3.86Å; F198-V227 HydrophobicContact CE2-CG2 4.26Å; F198-V227 HydrophobicContact CZ-CG1 4.28Å; F198-V227 HydrophobicContact CZ-CG2 3.64Å; F201-V227 HydrophobicContact CE2-CB 3.99Å; F201-V227 HydrophobicContact CE2-CG1 4.03Å; F201-V227 HydrophobicContact CE2-CG2 4.09Å; V214-V227 WeakPolarHBondContact CA-O 3.23Å; H215-V227 HydrophobicContact CB-CB 4.45Å; H215-V227 PolarHBondContact N-O 3.39Å; H215-V227 PolarHBondContact O-N 3.24Å; A217-V227 HydrophobicContact CB-CG2 3.75Å; V225-V227 HydrophobicContact CG2-CG2 4.1Å; V227-V229 HydrophobicContact CG1-CG2 3.93Å; V227-V312 HydrophobicContact CG1-CG1 3.65Å; V227-T314 HydrophobicContact CG2-CG2 4.22Å
228	K	94.6	Very high	89.3	Confident	36 Å²	36	33.1 Å²	33.1	16%	0.157	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.2	177	-170.5	-173.5	-170.8	-176.3	0	108.3	A212 Q213 V214 F278 E281 V312 L313 D382	A212-K228 HydrophobicContact CB-CG 3.93Å; Q213-K228 CarbonylContact O-C 3.49Å; Q213-K228 WeakPolarHBondContact O-CA 3.37Å; V214-K228 HydrophobicContact CG2-CB 4.28Å; V214-K228 HydrophobicContact CG2-CG 4.13Å; K228-F278 HydrophobicContact CB-CE2 4.18Å; K228-F278 HydrophobicContact CD-CE1 4.02Å; K228-F278 HydrophobicContact CD-CE2 3.87Å; K228-F278 HydrophobicContact CD-CZ 3.55Å; K228-F278 HydrophobicContact CG-CE2 3.66Å; K228-F278 HydrophobicContact CG-CZ 3.68Å; K228-F278 WeakPolarHBondContact O-CE2 3.15Å; K228-E281 IonicContact NZ-OE1 2.78Å; K228-E281 PolarHBondContact NZ-OE1 3.3Å; K228-E281 IonicContact NZ-OE2 3.89Å; K228-E281 PolarHBondContact NZ-OE2 3.4Å; K228-V312 CarbonylContact O-C 3.46Å; K228-V312 VanDerWaalsContact O-CA 3.31Å; K228-V312 WeakPolarHBondContact O-CA 3.49Å; K228-L313 HydrophobicContact CB-CB 4.22Å; K228-L313 PolarHBondContact N-O 3.35Å; K228-L313 PolarHBondContact O-N 3.45Å; K228-D382 IonicContact NZ-OD1 3.98Å
229	V	93.2	Very high	88.5	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.3	-174.8	-175.9	0	0	0	0	108.9	L185 F186 A212 Q213 V227 V312	L185-V229 HydrophobicContact CD1-CG1 3.89Å; L185-V229 HydrophobicContact CD2-CG1 4.09Å; L185-V229 HydrophobicContact CG-CG1 4.46Å; F186-V229 HydrophobicContact CE2-CG2 3.85Å; A212-V229 CarbonylContact C-O 3.59Å; A212-V229 WeakPolarHBondContact CA-O 3.39Å; A212-V229 WeakPolarHBondContact CB-O 3.49Å; Q213-V229 HydrophobicContact CG-CB 4.39Å; Q213-V229 PolarHBondContact N-O 2.91Å; Q213-V229 PolarHBondContact O-N 3.47Å; V227-V229 HydrophobicContact CG1-CG2 3.93Å; V229-V312 HydrophobicContact CG1-CG2 4.5Å
230	Q	90.6	Very high	87.7	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.019	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	152.5	175.5	-66.2	-178.1	10.9	0	0	111.6	L185 L211 I232 L276 F278 K310 R311	L185-Q230 WeakPolarHBondContact CD1-O 3.5Å; L211-Q230 WeakPolarHBondContact O-CA 3.24Å; Q230-I232 PolarHBondContact O-N 3.41Å; Q230-L276 VanDerWaalsContact NE2-C 3.31Å; Q230-L276 PolarHBondContact NE2-O 3.47Å; Q230-F278 HydrophobicContact CB-CE2 4.48Å; Q230-F278 HydrophobicContact CG-CD2 3.95Å; Q230-F278 HydrophobicContact CG-CE1 4.04Å; Q230-F278 HydrophobicContact CG-CE2 3.36Å; Q230-F278 HydrophobicContact CG-CZ 3.41Å; Q230-F278 VanDerWaalsContact CG-CZ 3.41Å; Q230-K310 PolarHBondContact NE2-O 2.92Å; Q230-K310 VanDerWaalsContact NE2-O 3.08Å; Q230-R311 HydrophobicContact CB-CB 4.31Å; Q230-R311 HydrophobicContact CG-CB 4.4Å; Q230-R311 PolarHBondContact N-O 2.88Å
231	Y	86.3	Confident	87.2	Confident	8 Å²	8	32.3 Å²	32.3	3%	0.031	19%	0.187	C	C	.	.			trans	-67.3	131.3	167.6	-55.5	-60.7	0	0	0	110	L175 R177 A209 L211 A212 Q213 D233 L234	L175-Y231 PolarHBondContact O-OH 3.14Å; R177-Y231 HydrophobicContact CB-CD1 4.28Å; R177-Y231 HydrophobicContact CB-CE1 4.15Å; R177-Y231 HydrophobicContact CG-CD1 4.03Å; R177-Y231 HydrophobicContact CG-CE1 3.91Å; A209-Y231 WeakPolarHBondContact O-CE2 3.5Å; A209-Y231 PolarHBondContact O-OH 2.8Å; L211-Y231 WeakPolarHBondContact O-CD2 3.3Å; L211-Y231 PolarHBondContact O-N 2.85Å; L211-Y231 VanDerWaalsContact O-N 3.08Å; A212-Y231 PolarHBondContact O-OH 2.91Å; Q213-Y231 HydrophobicContact CB-CE1 4.34Å; Q213-Y231 HydrophobicContact CG-CE1 4.32Å; Y231-D233 PolarHBondContact O-N 2.88Å; Y231-D233 VanDerWaalsContact O-N 3.14Å; Y231-L234 HydrophobicContact CD2-CD1 3.7Å; Y231-L234 HydrophobicContact CD2-CG 4.48Å; Y231-L234 HydrophobicContact CG-CD1 4.25Å; Y231-L234 WeakPolarHBondContact O-CB 3.33Å; Y231-L234 PolarHBondContact O-N 3.38Å; Y231-L234 VanDerWaalsContact O-N 3.12Å
232	I	82	Confident	86.6	Confident	8 Å²	8	27 Å²	27	4%	0.041	16%	0.158	C	C	.	.	H	α-helix	trans	-61.7	-28.5	-167.5	-165.4	160.8	0	0	0	114	E181 E184 L185 Q230	E181-I232 HydrophobicContact CB-CG2 4.01Å; E181-I232 HydrophobicContact CG-CG2 3.94Å; E184-I232 HydrophobicContact CB-CD1 3.5Å; E184-I232 VanDerWaalsContact CB-CD1 3.5Å; L185-I232 HydrophobicContact CB-CD1 4.04Å; L185-I232 HydrophobicContact CB-CG1 4.42Å; L185-I232 HydrophobicContact CD1-CB 4.46Å; Q230-I232 PolarHBondContact O-N 3.41Å
233	D	75.2	Confident	86	Confident	17 Å²	17	30.9 Å²	30.9	9%	0.091	17%	0.167	C	C	.	.	H	α-helix	trans	-82.9	-18.6	-178.5	67.4	-40.7	0	0	0	114.1	L79 R177 Y231 R235 D236 R237	L79-D233 HydrophobicContact CD1-CB 4.23Å; L79-D233 HydrophobicContact CD2-CB 3.81Å; R177-D233 IonicContact CZ-OD1 2.9Å; R177-D233 IonicContact CZ-OD2 2.72Å; R177-D233 VanDerWaalsContact NH1-CG 3.3Å; R177-D233 IonicContact NH1-OD1 3.6Å; R177-D233 PolarHBondContact NH1-OD1 2.8Å; R177-D233 IonicContact NH1-OD2 3.95Å; R177-D233 IonicContact NH2-OD1 2.92Å; R177-D233 PolarHBondContact NH2-OD1 3.49Å; R177-D233 IonicContact NH2-OD2 3.71Å; R177-D233 PolarHBondContact NH2-OD2 3.29Å; Y231-D233 PolarHBondContact O-N 2.88Å; Y231-D233 VanDerWaalsContact O-N 3.14Å; D233-R235 PolarHBondContact O-N 3.2Å; D233-D236 PolarHBondContact O-N 3.08Å; D233-R237 WeakPolarHBondContact O-CD 3.27Å; D233-R237 VanDerWaalsContact O-CG 3.23Å; D233-R237 WeakPolarHBondContact O-CG 3.25Å; D233-R237 PolarHBondContact O-N 2.95Å; D233-R237 VanDerWaalsContact O-N 3.08Å; D233-R237 IonicContact OD2-CZ 3.66Å; D233-R237 IonicContact OD2-NE 3.72Å; D233-R237 IonicContact OD2-NH1 2.74Å; D233-R237 PolarHBondContact OD2-NH1 3.48Å
234	L	76.1	Confident	85.4	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-64.7	-45.7	-169.1	-81.8	173.6	0	0	0	112.9	L211 Y231 R237 F238 L276	L211-L234 HydrophobicContact CB-CD1 4.03Å; L211-L234 HydrophobicContact CD2-CD1 3.77Å; L211-L234 HydrophobicContact CD2-CD2 4.29Å; L211-L234 WeakPolarHBondContact O-CD1 3.41Å; Y231-L234 HydrophobicContact CD2-CD1 3.7Å; Y231-L234 HydrophobicContact CD2-CG 4.48Å; Y231-L234 HydrophobicContact CG-CD1 4.25Å; Y231-L234 WeakPolarHBondContact O-CB 3.33Å; Y231-L234 PolarHBondContact O-N 3.38Å; Y231-L234 VanDerWaalsContact O-N 3.12Å; L234-R237 WeakPolarHBondContact O-CG 3.39Å; L234-R237 PolarHBondContact O-N 3.46Å; L234-F238 WeakPolarHBondContact O-CB 3.42Å; L234-F238 PolarHBondContact O-N 2.86Å; L234-L276 HydrophobicContact CB-CD2 4.42Å
235	R	74.6	Confident	84.6	Confident	103 Å²	103	28.9 Å²	28.9	39%	0.389	15%	0.152	S	C	.	.	H	α-helix	trans	-69.9	-39.6	-179.1	-167.9	174.1	-175.4	163.2	6.5	111.9	D233 R237 F238 K310	D233-R235 PolarHBondContact O-N 3.2Å; R235-R237 VanDerWaalsContact C-N 3.25Å; R235-R237 PolarHBondContact O-N 2.63Å; R235-F238 PolarHBondContact O-N 3.12Å; R235-K310 VanDerWaalsContact NH1-CB 3.27Å
236	D	75.5	Confident	83.9	Confident	42 Å²	42	31.1 Å²	31.1	23%	0.225	16%	0.163	C	C	.	.	H	α-helix	trans	-65.8	-28.9	178.7	-82.2	-31	0	0	0	112.3	R75 R76 L79 D233	R75-D236 IonicContact NE-OD2 3.83Å; R76-D236 IonicContact CZ-OD1 3.3Å; R76-D236 IonicContact NE-OD1 3.88Å; R76-D236 PolarHBondContact NE-OD1 3.46Å; R76-D236 IonicContact NH2-OD1 3.48Å; R76-D236 PolarHBondContact NH2-OD1 3.41Å; L79-D236 HydrophobicContact CD1-CB 3.55Å; D233-D236 PolarHBondContact O-N 3.08Å
237	R	78.5	Confident	83.3	Confident	16 Å²	16	33.4 Å²	33.4	6%	0.06	17%	0.171	C	C	.	.	H	α-helix	trans	-98	-10.4	178.5	79.6	-167.1	-149.4	178.4	16.3	114.7	G142 G143 D233 L234 R235 D239 G240 D241	G142-R237 VanDerWaalsContact C-NH2 3.34Å; G142-R237 PolarHBondContact O-NH2 3.28Å; G143-R237 VanDerWaalsContact CA-NH2 3.32Å; D233-R237 WeakPolarHBondContact O-CD 3.27Å; D233-R237 VanDerWaalsContact O-CG 3.23Å; D233-R237 WeakPolarHBondContact O-CG 3.25Å; D233-R237 PolarHBondContact O-N 2.95Å; D233-R237 VanDerWaalsContact O-N 3.08Å; D233-R237 IonicContact OD2-CZ 3.66Å; D233-R237 IonicContact OD2-NE 3.72Å; D233-R237 IonicContact OD2-NH1 2.74Å; D233-R237 PolarHBondContact OD2-NH1 3.48Å; L234-R237 WeakPolarHBondContact O-CG 3.39Å; L234-R237 PolarHBondContact O-N 3.46Å; R235-R237 VanDerWaalsContact C-N 3.25Å; R235-R237 PolarHBondContact O-N 2.63Å; R237-D239 PolarHBondContact O-N 3.12Å; R237-G240 PolarHBondContact O-N 3.35Å; R237-D241 IonicContact CZ-OD2 3.1Å; R237-D241 IonicContact NE-OD2 2.63Å; R237-D241 PolarHBondContact NE-OD2 3.36Å; R237-D241 IonicContact NH2-OD2 2.72Å; R237-D241 WeakPolarHBondContact O-CB 3.47Å; R237-D241 PolarHBondContact O-N 3.35Å
238	F	80.9	Confident	82.6	Confident	18 Å²	18	34.1 Å²	34.1	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-53.7	-56.6	-173.2	177.1	-100.9	0	0	0	112.4	L144 L234 R235 G240 D241 I242 L272 A273 L276	L144-F238 HydrophobicContact CD1-CD2 3.49Å; L144-F238 VanDerWaalsContact CD1-CD2 3.49Å; L144-F238 HydrophobicContact CD1-CE2 3.85Å; L234-F238 WeakPolarHBondContact O-CB 3.42Å; L234-F238 PolarHBondContact O-N 2.86Å; R235-F238 PolarHBondContact O-N 3.12Å; F238-G240 VanDerWaalsContact C-N 3.33Å; F238-G240 PolarHBondContact O-N 3.39Å; F238-D241 PolarHBondContact O-N 3.02Å; F238-I242 HydrophobicContact CD1-CG1 4.42Å; F238-I242 HydrophobicContact CD2-CG1 4.14Å; F238-I242 HydrophobicContact CE1-CG1 4.11Å; F238-I242 HydrophobicContact CE2-CD1 4.13Å; F238-I242 HydrophobicContact CE2-CG1 3.79Å; F238-I242 HydrophobicContact CG-CG1 4.45Å; F238-I242 HydrophobicContact CZ-CD1 4.28Å; F238-I242 HydrophobicContact CZ-CG1 3.79Å; F238-I242 WeakPolarHBondContact O-CB 3.33Å; F238-I242 VanDerWaalsContact O-CG1 3.31Å; F238-I242 WeakPolarHBondContact O-CG1 3.48Å; F238-I242 PolarHBondContact O-N 3.41Å; F238-L272 HydrophobicContact CE2-CB 4.18Å; F238-L272 HydrophobicContact CE2-CD2 4.05Å; F238-L272 HydrophobicContact CE2-CG 3.78Å; F238-A273 HydrophobicContact CE1-CB 4.5Å; F238-A273 HydrophobicContact CZ-CB 4.15Å; F238-L276 HydrophobicContact CB-CD1 4.15Å; F238-L276 HydrophobicContact CD2-CD1 3.22Å; F238-L276 HydrophobicContact CE2-CD1 3.67Å; F238-L276 HydrophobicContact CG-CD1 3.72Å; F238-L276 HydrophobicContact CZ-CD1 4.45Å
239	D	79.9	Confident	81.8	Confident	120 Å²	120	34 Å²	34	64%	0.642	18%	0.176	S	C	*	.	H	α-helix	trans	-63	-40.2	-175.9	-67.4	-41.1	0	0	0	112	R237 H243	R237-D239 PolarHBondContact O-N 3.12Å; D239-H243 VanDerWaalsContact O-CB 3.27Å; D239-H243 WeakPolarHBondContact O-CB 3.44Å; D239-H243 PolarHBondContact O-N 2.94Å
240	G	81.3	Confident	81.2	Confident	43 Å²	43	41.3 Å²	41.3	44%	0.443	20%	0.203	S	C	.	.	H	α-helix	trans	-68.6	-42.1	178.8	0	0	0	0	0	113.3	R237 F238 T244	R237-G240 PolarHBondContact O-N 3.35Å; F238-G240 VanDerWaalsContact C-N 3.33Å; F238-G240 PolarHBondContact O-N 3.39Å; G240-T244 WeakPolarHBondContact O-CB 3.44Å; G240-T244 PolarHBondContact O-N 3.43Å; G240-T244 PolarHBondContact O-OG1 2.71Å
241	D	84.2	Confident	80.8	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.011	22%	0.222	C	C	.	.	H	α-helix	trans	-69.1	-39.4	176.9	-75.8	-6.7	0	0	0	110.7	R86 L144 Y145 R237 F238 T244 L245	R86-D241 IonicContact CZ-OD1 3.39Å; R86-D241 IonicContact NE-OD1 3.63Å; R86-D241 PolarHBondContact NE-OD1 2.88Å; R86-D241 IonicContact NE-OD2 3.98Å; R86-D241 PolarHBondContact NE-OD2 3.37Å; R86-D241 IonicContact NH2-OD1 3.59Å; R86-D241 PolarHBondContact NH2-OD1 3.35Å; R86-D241 IonicContact NH2-OD2 3.76Å; L144-D241 HydrophobicContact CD2-CB 3.46Å; L144-D241 VanDerWaalsContact CD2-CB 3.46Å; Y145-D241 HydrophobicContact CE2-CB 4.2Å; R237-D241 IonicContact CZ-OD2 3.1Å; R237-D241 IonicContact NE-OD2 2.63Å; R237-D241 PolarHBondContact NE-OD2 3.36Å; R237-D241 IonicContact NH2-OD2 2.72Å; R237-D241 WeakPolarHBondContact O-CB 3.47Å; R237-D241 PolarHBondContact O-N 3.35Å; F238-D241 PolarHBondContact O-N 3.02Å; D241-T244 WeakPolarHBondContact O-CB 2.77Å; D241-T244 PolarHBondContact O-N 3.08Å; D241-L245 WeakPolarHBondContact O-CD1 3.15Å; D241-L245 WeakPolarHBondContact O-CG 3.2Å; D241-L245 PolarHBondContact O-N 2.73Å; D241-L245 VanDerWaalsContact O-N 3.1Å
242	I	82.7	Confident	80.4	Confident	4 Å²	4	46 Å²	46	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-45.5	173.9	-71.2	-66.2	0	0	0	111.3	L144 F238 T244 L245 E246 K269	L144-I242 HydrophobicContact CD2-CD1 3.86Å; L144-I242 HydrophobicContact CD2-CG1 3.93Å; F238-I242 HydrophobicContact CD1-CG1 4.42Å; F238-I242 HydrophobicContact CD2-CG1 4.14Å; F238-I242 HydrophobicContact CE1-CG1 4.11Å; F238-I242 HydrophobicContact CE2-CD1 4.13Å; F238-I242 HydrophobicContact CE2-CG1 3.79Å; F238-I242 HydrophobicContact CG-CG1 4.45Å; F238-I242 HydrophobicContact CZ-CD1 4.28Å; F238-I242 HydrophobicContact CZ-CG1 3.79Å; F238-I242 WeakPolarHBondContact O-CB 3.33Å; F238-I242 VanDerWaalsContact O-CG1 3.31Å; F238-I242 WeakPolarHBondContact O-CG1 3.48Å; F238-I242 PolarHBondContact O-N 3.41Å; I242-T244 VanDerWaalsContact C-N 3.26Å; I242-T244 PolarHBondContact O-N 3.27Å; I242-L245 PolarHBondContact O-N 2.71Å; I242-L245 VanDerWaalsContact O-N 3.1Å; I242-E246 HydrophobicContact CG2-CG 4.33Å; I242-E246 WeakPolarHBondContact O-CG 3.49Å; I242-E246 PolarHBondContact O-N 2.9Å; I242-K269 HydrophobicContact CD1-CB 4.47Å; I242-K269 HydrophobicContact CD1-CG 4.34Å; I242-K269 HydrophobicContact CG2-CD 3.67Å; I242-K269 HydrophobicContact CG2-CG 4.04Å
243	H	83.3	Confident	80.2	Confident	115 Å²	115	49.1 Å²	49.1	53%	0.532	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-38	178.4	-170.8	66.5	0	0	0	111.9	D239 E246 L247	D239-H243 VanDerWaalsContact O-CB 3.27Å; D239-H243 WeakPolarHBondContact O-CB 3.44Å; D239-H243 PolarHBondContact O-N 2.94Å; H243-E246 PolarHBondContact O-N 3.33Å; H243-L247 WeakPolarHBondContact O-CB 3.47Å; H243-L247 PolarHBondContact O-N 2.82Å
244	T	84	Confident	80.4	Confident	17 Å²	17	54 Å²	54	10%	0.104	27%	0.273	C	S	.	.	H	α-helix	trans	-57.2	-48.9	172	-67.8	0	0	0	0	111.3	F87 G240 D241 I242 L247 L248	F87-T244 HydrophobicContact CB-CG2 4.33Å; F87-T244 HydrophobicContact CD2-CG2 3.42Å; F87-T244 VanDerWaalsContact CD2-CG2 3.42Å; F87-T244 HydrophobicContact CE2-CG2 4.1Å; F87-T244 HydrophobicContact CG-CG2 4.3Å; G240-T244 WeakPolarHBondContact O-CB 3.44Å; G240-T244 PolarHBondContact O-N 3.43Å; G240-T244 PolarHBondContact O-OG1 2.71Å; D241-T244 WeakPolarHBondContact O-CB 2.77Å; D241-T244 PolarHBondContact O-N 3.08Å; I242-T244 VanDerWaalsContact C-N 3.26Å; I242-T244 PolarHBondContact O-N 3.27Å; T244-L247 PolarHBondContact O-N 2.88Å; T244-L248 HydrophobicContact CG2-CD1 4Å; T244-L248 VanDerWaalsContact O-CG 3.3Å; T244-L248 WeakPolarHBondContact O-CG 3.22Å; T244-L248 PolarHBondContact O-N 3.12Å
245	L	81.8	Confident	80.4	Confident	28 Å²	28	57.3 Å²	57.3	15%	0.147	29%	0.289	C	S	.	.	H	α-helix	trans	-66.3	-40.5	-179.4	-69.9	162.4	0	0	0	112.5	L144 Y145 L148 D241 I242 L247 L248 L249 L265	L144-L245 HydrophobicContact CD2-CD1 4.36Å; Y145-L245 HydrophobicContact CD1-CD2 4.25Å; Y145-L245 HydrophobicContact CE1-CD2 3.72Å; Y145-L245 HydrophobicContact CE1-CG 4.26Å; L148-L245 HydrophobicContact CD1-CD1 3.1Å; L148-L245 HydrophobicContact CD1-CG 4.47Å; D241-L245 WeakPolarHBondContact O-CD1 3.15Å; D241-L245 WeakPolarHBondContact O-CG 3.2Å; D241-L245 PolarHBondContact O-N 2.73Å; D241-L245 VanDerWaalsContact O-N 3.1Å; I242-L245 PolarHBondContact O-N 2.71Å; I242-L245 VanDerWaalsContact O-N 3.1Å; L245-L247 VanDerWaalsContact C-N 3.32Å; L245-L247 PolarHBondContact O-N 2.9Å; L245-L248 PolarHBondContact O-N 3.46Å; L245-L249 PolarHBondContact O-N 3.08Å; L245-L265 HydrophobicContact CB-CD2 4.2Å
246	E	83.3	Confident	80.4	Confident	48 Å²	48	53.9 Å²	53.9	22%	0.224	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-43.2	173.9	-73.1	175.6	176.5	0	0	111.4	I242 H243 L249 R250 L265 K269	I242-E246 HydrophobicContact CG2-CG 4.33Å; I242-E246 WeakPolarHBondContact O-CG 3.49Å; I242-E246 PolarHBondContact O-N 2.9Å; H243-E246 PolarHBondContact O-N 3.33Å; E246-L249 PolarHBondContact O-N 3.41Å; E246-R250 WeakPolarHBondContact O-CG 3.31Å; E246-R250 PolarHBondContact O-N 2.82Å; E246-R250 VanDerWaalsContact O-N 3.09Å; E246-L265 HydrophobicContact CG-CD2 4.07Å; E246-K269 IonicContact OE1-NZ 3.29Å; E246-K269 PolarHBondContact OE1-NZ 3.19Å
247	L	84.1	Confident	80.1	Confident	70 Å²	70	57.4 Å²	57.4	37%	0.366	30%	0.303	S	S	.	.	H	α-helix	trans	-64.6	-44.6	176.7	180	60.7	0	0	0	111.8	F87 H243 T244 L245 L249 R250 L251	F87-L247 HydrophobicContact CE2-CD2 3.95Å; F87-L247 HydrophobicContact CZ-CD2 4.13Å; H243-L247 WeakPolarHBondContact O-CB 3.47Å; H243-L247 PolarHBondContact O-N 2.82Å; T244-L247 PolarHBondContact O-N 2.88Å; L245-L247 VanDerWaalsContact C-N 3.32Å; L245-L247 PolarHBondContact O-N 2.9Å; L247-L249 VanDerWaalsContact C-N 3.34Å; L247-L249 PolarHBondContact O-N 3.31Å; L247-R250 PolarHBondContact O-N 3.41Å; L247-L251 WeakPolarHBondContact O-CG 3.15Å; L247-L251 PolarHBondContact O-N 2.87Å; L247-L251 VanDerWaalsContact O-N 3.1Å
248	L	82.1	Confident	79.4	Confident	15 Å²	15	62.4 Å²	62.4	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-62.3	-41.2	178.1	-69.7	174	0	0	0	111.9	S90 L91 T244 L245 L251 I252	S90-L248 VanDerWaalsContact CB-CD1 3.46Å; L91-L248 HydrophobicContact CB-CD2 3.97Å; L91-L248 HydrophobicContact CD1-CD2 3.58Å; L91-L248 HydrophobicContact CG-CD2 4.39Å; T244-L248 HydrophobicContact CG2-CD1 4Å; T244-L248 VanDerWaalsContact O-CG 3.3Å; T244-L248 WeakPolarHBondContact O-CG 3.22Å; T244-L248 PolarHBondContact O-N 3.12Å; L245-L248 PolarHBondContact O-N 3.46Å; L248-L251 WeakPolarHBondContact O-CB 3.42Å; L248-L251 PolarHBondContact O-N 3.29Å; L248-I252 VanDerWaalsContact O-CG1 3.3Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 3.3Å
249	L	78.3	Confident	78.7	Confident	33 Å²	33	65.1 Å²	65.1	17%	0.173	35%	0.352	C	S	.	.	H	α-helix	trans	-64.2	-42.3	175.8	-75.4	-168.7	0	0	0	112.4	L245 E246 L247 L251 I252 E253 L265	L245-L249 PolarHBondContact O-N 3.08Å; E246-L249 PolarHBondContact O-N 3.41Å; L247-L249 VanDerWaalsContact C-N 3.34Å; L247-L249 PolarHBondContact O-N 3.31Å; L249-L251 PolarHBondContact O-N 2.85Å; L249-I252 HydrophobicContact CD2-CD1 4.26Å; L249-I252 CarbonylContact O-C 3.56Å; L249-I252 WeakPolarHBondContact O-CA 3.26Å; L249-I252 WeakPolarHBondContact O-CB 3.42Å; L249-I252 PolarHBondContact O-N 3.46Å; L249-E253 WeakPolarHBondContact O-CG 3.46Å; L249-E253 PolarHBondContact O-N 3.16Å; L249-L265 HydrophobicContact CD1-CB 3.49Å; L249-L265 VanDerWaalsContact CD1-CB 3.49Å; L249-L265 HydrophobicContact CD1-CD2 3.29Å; L249-L265 HydrophobicContact CD1-CG 3.88Å; L249-L265 HydrophobicContact CG-CD2 4.08Å
250	R	81.3	Confident	77.8	Confident	155 Å²	155	61.4 Å²	61.4	59%	0.585	34%	0.342	S	S	*	.	H	α-helix	trans	-59	-38.3	175.1	-72	176.5	-173	-179.9	4.1	112.1	E246 L247 V254	E246-R250 WeakPolarHBondContact O-CG 3.31Å; E246-R250 PolarHBondContact O-N 2.82Å; E246-R250 VanDerWaalsContact O-N 3.09Å; L247-R250 PolarHBondContact O-N 3.41Å; R250-V254 WeakPolarHBondContact O-CG2 3.32Å; R250-V254 PolarHBondContact O-N 2.87Å
251	L	80.9	Confident	77	Confident	80 Å²	80	61 Å²	61	42%	0.419	33%	0.328	S	S	.	.	H	α-helix	trans	-66	-39.9	174.8	-68.1	170.6	0	0	0	111.8	L91 L247 L248 L249 V254 M255	L91-L251 HydrophobicContact CD1-CD1 4.25Å; L247-L251 WeakPolarHBondContact O-CG 3.15Å; L247-L251 PolarHBondContact O-N 2.87Å; L247-L251 VanDerWaalsContact O-N 3.1Å; L248-L251 WeakPolarHBondContact O-CB 3.42Å; L248-L251 PolarHBondContact O-N 3.29Å; L249-L251 PolarHBondContact O-N 2.85Å; L251-V254 PolarHBondContact O-N 3.37Å; L251-M255 PolarHBondContact O-N 3.02Å
252	I	77.7	Confident	76.3	Confident	31 Å²	31	62.3 Å²	62.3	16%	0.159	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-43.5	176.5	-68.8	164.5	0	0	0	110.8	L248 L249 V254 M255 H256 F259	L248-I252 VanDerWaalsContact O-CG1 3.3Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 3.3Å; L249-I252 HydrophobicContact CD2-CD1 4.26Å; L249-I252 CarbonylContact O-C 3.56Å; L249-I252 WeakPolarHBondContact O-CA 3.26Å; L249-I252 WeakPolarHBondContact O-CB 3.42Å; L249-I252 PolarHBondContact O-N 3.46Å; I252-V254 PolarHBondContact O-N 2.85Å; I252-M255 CarbonylContact O-C 3.5Å; I252-M255 PolarHBondContact O-N 2.9Å; I252-H256 PolarHBondContact O-N 2.88Å; I252-F259 HydrophobicContact CG2-CD1 3.84Å; I252-F259 HydrophobicContact CG2-CE1 4.17Å; I252-F259 HydrophobicContact CG2-CG 4.33Å
253	E	78.4	Confident	75.7	Confident	73 Å²	73	63.7 Å²	63.7	34%	0.341	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-35.9	176.7	-74.5	-178.8	148.6	0	0	112.5	L249 H256 P257 S262	L249-E253 WeakPolarHBondContact O-CG 3.46Å; L249-E253 PolarHBondContact O-N 3.16Å; E253-H256 CarbonylContact O-C 3.6Å; E253-P257 WeakPolarHBondContact O-CA 3.49Å; E253-S262 WeakPolarHBondContact OE1-CB 3.48Å; E253-S262 PolarHBondContact OE1-OG 2.9Å
254	V	78.7	Confident	75	Confident	119 Å²	119	58.4 Å²	58.4	72%	0.721	32%	0.318	S	S	*	.	H	α-helix	trans	-66.7	-39.8	174.9	171.2	0	0	0	0	111.4	R250 L251 I252	R250-V254 WeakPolarHBondContact O-CG2 3.32Å; R250-V254 PolarHBondContact O-N 2.87Å; L251-V254 PolarHBondContact O-N 3.37Å; I252-V254 PolarHBondContact O-N 2.85Å
255	M	76.2	Confident	74.4	Confident	71 Å²	71	58.7 Å²	58.7	35%	0.35	32%	0.319	S	S	.	.	H	α-helix	trans	-79.7	-29	179.1	-67.2	-166.7	-66.2	0	0	113.3	L95 S98 L251 I252	L95-M255 HydrophobicContact CD2-CE 4.17Å; S98-M255 VanDerWaalsContact OG-CE 3.27Å; S98-M255 WeakPolarHBondContact OG-CE 3.23Å; L251-M255 PolarHBondContact O-N 3.02Å; I252-M255 CarbonylContact O-C 3.5Å; I252-M255 PolarHBondContact O-N 2.9Å
256	H	75	Confident	74	Confident	31 Å²	31	63.9 Å²	63.9	14%	0.144	34%	0.342	C	S	.	.			trans	-132.8	78.6	-176.5	-57	-79.9	0	0	0	110.3	S98 I252 E253 S258 F259	S98-H256 VanDerWaalsContact CA-NE2 3.31Å; S98-H256 WeakPolarHBondContact CA-NE2 3.27Å; S98-H256 VanDerWaalsContact CB-NE2 3.33Å; S98-H256 WeakPolarHBondContact CB-NE2 3.45Å; S98-H256 PolarHBondContact O-CE1 3.18Å; S98-H256 PolarHBondContact O-NE2 2.78Å; S98-H256 VanDerWaalsContact O-NE2 3.13Å; I252-H256 PolarHBondContact O-N 2.88Å; E253-H256 CarbonylContact O-C 3.6Å; H256-S258 PolarHBondContact O-N 3.44Å; H256-S258 VanDerWaalsContact O-N 3.12Å; H256-F259 HydrophobicContact CB-CB 3.91Å; H256-F259 WeakPolarHBondContact O-CB 3.12Å; H256-F259 PolarHBondContact O-N 2.85Å
257	P	69.1	Low	73.5	Confident	116 Å²	116	63.8 Å²	63.8	75%	0.753	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.6	-175.8	-24.8	35.2	0	0	0	114.8	E253 F259	E253-P257 WeakPolarHBondContact O-CA 3.49Å; P257-F259 PolarHBondContact O-N 3.1Å
258	S	64.1	Low	73.1	Confident	121 Å²	121	61 Å²	61	85%	0.846	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-8.9	173.7	50.8	0	0	0	0	113.5	H256 G260	H256-S258 PolarHBondContact O-N 3.44Å; H256-S258 VanDerWaalsContact O-N 3.12Å; S258-G260 PolarHBondContact O-N 2.85Å; S258-G260 VanDerWaalsContact O-N 3.11Å
259	F	66.1	Low	72.9	Confident	76 Å²	76	63.8 Å²	63.8	33%	0.333	34%	0.34	S	S	.	.			trans	-81.3	90.1	-176.2	-166	-103.4	0	0	0	111.9	I252 H256 P257 F261	I252-F259 HydrophobicContact CG2-CD1 3.84Å; I252-F259 HydrophobicContact CG2-CE1 4.17Å; I252-F259 HydrophobicContact CG2-CG 4.33Å; H256-F259 HydrophobicContact CB-CB 3.91Å; H256-F259 WeakPolarHBondContact O-CB 3.12Å; H256-F259 PolarHBondContact O-N 2.85Å; P257-F259 PolarHBondContact O-N 3.1Å; F259-F261 HydrophobicContact CD1-CB 4.17Å; F259-F261 HydrophobicContact CD1-CD2 4.03Å; F259-F261 AromaticContact CD2-CD2 3.67Å; F259-F261 HydrophobicContact CD2-CD2 3.67Å; F259-F261 HydrophobicContact CD2-CE2 4.03Å; F259-F261 HydrophobicContact CE1-CB 3.64Å; F259-F261 AromaticContact CE1-CD2 3.69Å; F259-F261 HydrophobicContact CE1-CD2 3.69Å; F259-F261 HydrophobicContact CE1-CG 4.01Å; F259-F261 AromaticContact CE2-CD2 3.29Å; F259-F261 HydrophobicContact CE2-CD2 3.29Å; F259-F261 AromaticContact CE2-CE2 3.6Å; F259-F261 HydrophobicContact CE2-CE2 3.6Å; F259-F261 HydrophobicContact CE2-CG 4.26Å; F259-F261 HydrophobicContact CG-CD2 4.02Å; F259-F261 HydrophobicContact CZ-CB 3.96Å; F259-F261 AromaticContact CZ-CD2 3.3Å; F259-F261 HydrophobicContact CZ-CD2 3.3Å; F259-F261 AromaticContact CZ-CE2 4Å; F259-F261 HydrophobicContact CZ-CE2 4Å; F259-F261 AromaticContact CZ-CG 3.82Å; F259-F261 HydrophobicContact CZ-CG 3.82Å; F259-F261 PolarHBondContact O-N 3.21Å
260	G	60.7	Low	72.9	Confident	41 Å²	41	63.9 Å²	63.9	42%	0.423	35%	0.349	S	S	.	.			trans	-89.4	46.6	-175.3	0	0	0	0	0	116.1	S258 W263	S258-G260 PolarHBondContact O-N 2.85Å; S258-G260 VanDerWaalsContact O-N 3.11Å; G260-W263 PolarHBondContact O-NE1 3.49Å
261	F	65.6	Low	72.8	Confident	35 Å²	35	57.5 Å²	57.5	15%	0.154	33%	0.327	C	S	.	.			trans	-102.2	-3.1	-176.2	-76.4	-88.4	0	0	0	115.6	L158 L159 F259 W263 V264 L265 M467	L158-F261 HydrophobicContact CB-CE1 4.48Å; L159-F261 HydrophobicContact CD2-CE1 3.71Å; L159-F261 HydrophobicContact CD2-CZ 4.01Å; F259-F261 HydrophobicContact CD1-CB 4.17Å; F259-F261 HydrophobicContact CD1-CD2 4.03Å; F259-F261 AromaticContact CD2-CD2 3.67Å; F259-F261 HydrophobicContact CD2-CD2 3.67Å; F259-F261 HydrophobicContact CD2-CE2 4.03Å; F259-F261 HydrophobicContact CE1-CB 3.64Å; F259-F261 AromaticContact CE1-CD2 3.69Å; F259-F261 HydrophobicContact CE1-CD2 3.69Å; F259-F261 HydrophobicContact CE1-CG 4.01Å; F259-F261 AromaticContact CE2-CD2 3.29Å; F259-F261 HydrophobicContact CE2-CD2 3.29Å; F259-F261 AromaticContact CE2-CE2 3.6Å; F259-F261 HydrophobicContact CE2-CE2 3.6Å; F259-F261 HydrophobicContact CE2-CG 4.26Å; F259-F261 HydrophobicContact CG-CD2 4.02Å; F259-F261 HydrophobicContact CZ-CB 3.96Å; F259-F261 AromaticContact CZ-CD2 3.3Å; F259-F261 HydrophobicContact CZ-CD2 3.3Å; F259-F261 AromaticContact CZ-CE2 4Å; F259-F261 HydrophobicContact CZ-CE2 4Å; F259-F261 AromaticContact CZ-CG 3.82Å; F259-F261 HydrophobicContact CZ-CG 3.82Å; F259-F261 PolarHBondContact O-N 3.21Å; F261-W263 PolarHBondContact O-N 3.36Å; F261-W263 VanDerWaalsContact O-N 3.15Å; F261-V264 HydrophobicContact CD1-CB 4.43Å; F261-V264 HydrophobicContact CD1-CG2 3.85Å; F261-V264 WeakPolarHBondContact O-CA 3.16Å; F261-V264 VanDerWaalsContact O-CB 3.29Å; F261-V264 WeakPolarHBondContact O-CB 3.25Å; F261-V264 PolarHBondContact O-N 3.28Å; F261-L265 PolarHBondContact O-N 3.04Å; F261-M467 HydrophobicContact CZ-CE 4.49Å
262	S	68.1	Low	72.7	Confident	29 Å²	29	53.9 Å²	53.9	20%	0.203	31%	0.308	C	S	.	.	H	α-helix	trans	-59.6	-30.9	-177.1	-76.3	0	0	0	0	114.4	E253 V264 L265 Q266	E253-S262 WeakPolarHBondContact OE1-CB 3.48Å; E253-S262 PolarHBondContact OE1-OG 2.9Å; S262-V264 VanDerWaalsContact C-N 3.3Å; S262-V264 PolarHBondContact O-N 3.4Å; S262-L265 PolarHBondContact O-N 2.86Å; S262-Q266 WeakPolarHBondContact O-CG 3.34Å; S262-Q266 PolarHBondContact O-N 2.97Å
263	W	70.4	Confident	73	Confident	34 Å²	34	54.6 Å²	54.6	13%	0.129	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-34	172.8	67.5	-94.6	0	0	0	112.3	L158 G260 F261 L265 Q266 D267 R475 L478	L158-W263 HydrophobicContact CD1-CH2 3.62Å; L158-W263 HydrophobicContact CD1-CZ2 4.08Å; L158-W263 HydrophobicContact CD1-CZ3 4.46Å; L158-W263 HydrophobicContact CD2-CH2 4.26Å; L158-W263 HydrophobicContact CD2-CZ2 4.31Å; G260-W263 PolarHBondContact O-NE1 3.49Å; F261-W263 PolarHBondContact O-N 3.36Å; F261-W263 VanDerWaalsContact O-N 3.15Å; W263-L265 VanDerWaalsContact C-N 3.33Å; W263-L265 PolarHBondContact O-N 2.94Å; W263-Q266 PolarHBondContact O-N 3.43Å; W263-D267 PolarHBondContact O-N 2.91Å; W263-R475 VanDerWaalsContact CZ3-NH1 3.31Å; W263-L478 HydrophobicContact CH2-CD1 4.05Å; W263-L478 HydrophobicContact CZ3-CD1 3.64Å
264	V	69.6	Low	73.2	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.024	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-40.8	177.9	-178.7	0	0	0	0	109.8	L152 F155 L158 F261 S262 D267 L268	L152-V264 HydrophobicContact CD2-CG1 4.25Å; F155-V264 HydrophobicContact CD2-CG1 4.07Å; F155-V264 HydrophobicContact CE2-CG1 4Å; F155-V264 HydrophobicContact CZ-CG1 4.44Å; L158-V264 HydrophobicContact CD1-CG2 4.06Å; F261-V264 HydrophobicContact CD1-CB 4.43Å; F261-V264 HydrophobicContact CD1-CG2 3.85Å; F261-V264 WeakPolarHBondContact O-CA 3.16Å; F261-V264 VanDerWaalsContact O-CB 3.29Å; F261-V264 WeakPolarHBondContact O-CB 3.25Å; F261-V264 PolarHBondContact O-N 3.28Å; S262-V264 VanDerWaalsContact C-N 3.3Å; S262-V264 PolarHBondContact O-N 3.4Å; V264-D267 PolarHBondContact O-N 3.41Å; V264-L268 HydrophobicContact CG1-CD1 4.03Å; V264-L268 HydrophobicContact CG1-CG 4.31Å; V264-L268 WeakPolarHBondContact O-CB 3.14Å; V264-L268 VanDerWaalsContact O-CG 3.27Å; V264-L268 WeakPolarHBondContact O-CG 3.45Å; V264-L268 PolarHBondContact O-N 2.94Å
265	L	70.7	Confident	73.5	Confident	23 Å²	23	49.2 Å²	49.2	12%	0.12	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-39.7	176.5	-173.3	70.4	0	0	0	111.8	L148 L245 E246 L249 F261 S262 W263 D267 L268 K269	L148-L265 HydrophobicContact CD2-CD1 4.39Å; L245-L265 HydrophobicContact CB-CD2 4.2Å; E246-L265 HydrophobicContact CG-CD2 4.07Å; L249-L265 HydrophobicContact CD1-CB 3.49Å; L249-L265 VanDerWaalsContact CD1-CB 3.49Å; L249-L265 HydrophobicContact CD1-CD2 3.29Å; L249-L265 HydrophobicContact CD1-CG 3.88Å; L249-L265 HydrophobicContact CG-CD2 4.08Å; F261-L265 PolarHBondContact O-N 3.04Å; S262-L265 PolarHBondContact O-N 2.86Å; W263-L265 VanDerWaalsContact C-N 3.33Å; W263-L265 PolarHBondContact O-N 2.94Å; L265-D267 VanDerWaalsContact C-N 3.32Å; L265-D267 PolarHBondContact O-N 3.47Å; L265-L268 PolarHBondContact O-N 3.19Å; L265-K269 WeakPolarHBondContact O-CB 3.38Å; L265-K269 PolarHBondContact O-N 3.07Å
266	Q	74.2	Confident	74	Confident	137 Å²	137	46.3 Å²	46.3	64%	0.64	27%	0.272	S	S	*	.	H	α-helix	trans	-60.8	-43.8	176	-70.8	179.4	-7.1	0	0	111.4	S262 W263 K269 G270	S262-Q266 WeakPolarHBondContact O-CG 3.34Å; S262-Q266 PolarHBondContact O-N 2.97Å; W263-Q266 PolarHBondContact O-N 3.43Å; Q266-K269 PolarHBondContact O-N 2.92Å; Q266-G270 PolarHBondContact O-N 3.33Å; Q266-G270 VanDerWaalsContact O-N 3.12Å
267	D	73	Confident	74.8	Confident	45 Å²	45	46.7 Å²	46.7	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-65.9	-41.6	176.4	-71.3	-17	0	0	0	111.6	W263 V264 L265 G270 T271 R475	W263-D267 PolarHBondContact O-N 2.91Å; V264-D267 PolarHBondContact O-N 3.41Å; L265-D267 VanDerWaalsContact C-N 3.32Å; L265-D267 PolarHBondContact O-N 3.47Å; D267-G270 PolarHBondContact O-N 2.81Å; D267-T271 WeakPolarHBondContact O-CB 3.35Å; D267-T271 PolarHBondContact O-N 3.1Å; D267-T271 PolarHBondContact O-OG1 2.9Å; D267-R475 WeakPolarHBondContact OD2-CD 3.48Å; D267-R475 IonicContact OD2-CZ 2.77Å; D267-R475 IonicContact OD2-NE 2.69Å; D267-R475 IonicContact OD2-NH1 2.7Å; D267-R475 PolarHBondContact OD2-NH1 2.88Å
268	L	74.3	Confident	76	Confident	13 Å²	13	41.3 Å²	41.3	7%	0.068	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-40.6	174.9	-77.2	174.6	0	0	0	112.3	L148 L152 F155 V264 L265 T271 L272	L148-L268 HydrophobicContact CD2-CB 3.97Å; L148-L268 HydrophobicContact CD2-CD1 4.26Å; L152-L268 HydrophobicContact CD2-CD1 3.91Å; L152-L268 HydrophobicContact CG-CD1 4.14Å; F155-L268 HydrophobicContact CE2-CD2 3.8Å; F155-L268 HydrophobicContact CE2-CG 4.12Å; V264-L268 HydrophobicContact CG1-CD1 4.03Å; V264-L268 HydrophobicContact CG1-CG 4.31Å; V264-L268 WeakPolarHBondContact O-CB 3.14Å; V264-L268 VanDerWaalsContact O-CG 3.27Å; V264-L268 WeakPolarHBondContact O-CG 3.45Å; V264-L268 PolarHBondContact O-N 2.94Å; L265-L268 PolarHBondContact O-N 3.19Å; L268-T271 WeakPolarHBondContact O-CB 3.06Å; L268-T271 PolarHBondContact O-N 3.29Å; L268-L272 VanDerWaalsContact O-CB 3.22Å; L268-L272 WeakPolarHBondContact O-CB 3.3Å; L268-L272 PolarHBondContact O-N 3.39Å
269	K	78.9	Confident	77.5	Confident	73 Å²	73	37.9 Å²	37.9	32%	0.317	21%	0.21	S	C	.	.	H	α-helix	trans	-60.7	-47	176.3	176.9	-176.1	-179.8	171.4	0	111	I242 E246 L265 Q266 L272 A273	I242-K269 HydrophobicContact CD1-CB 4.47Å; I242-K269 HydrophobicContact CD1-CG 4.34Å; I242-K269 HydrophobicContact CG2-CD 3.67Å; I242-K269 HydrophobicContact CG2-CG 4.04Å; E246-K269 IonicContact OE1-NZ 3.29Å; E246-K269 PolarHBondContact OE1-NZ 3.19Å; L265-K269 WeakPolarHBondContact O-CB 3.38Å; L265-K269 PolarHBondContact O-N 3.07Å; Q266-K269 PolarHBondContact O-N 2.92Å; K269-L272 PolarHBondContact O-N 3.45Å; K269-A273 WeakPolarHBondContact O-CB 3.48Å; K269-A273 PolarHBondContact O-N 3.02Å
270	G	78.6	Confident	78.9	Confident	35 Å²	35	36.4 Å²	36.4	36%	0.361	21%	0.206	S	C	.	.	H	α-helix	trans	-61.1	-46.2	177.3	0	0	0	0	0	112.1	Q266 D267 L272 A273 Q274	Q266-G270 PolarHBondContact O-N 3.33Å; Q266-G270 VanDerWaalsContact O-N 3.12Å; D267-G270 PolarHBondContact O-N 2.81Å; G270-L272 PolarHBondContact O-N 3.1Å; G270-A273 PolarHBondContact O-N 2.77Å; G270-Q274 WeakPolarHBondContact O-CG 3.47Å; G270-Q274 PolarHBondContact O-N 3.44Å; G270-Q274 VanDerWaalsContact O-N 3.17Å
271	T	78.1	Confident	80.6	Confident	20 Å²	20	34.9 Å²	34.9	12%	0.123	19%	0.188	C	C	.	.	H	α-helix	trans	-57.2	-47.8	175.3	-59.9	0	0	0	0	111.2	D267 L268 A273 Q274 E275 L385	D267-T271 WeakPolarHBondContact O-CB 3.35Å; D267-T271 PolarHBondContact O-N 3.1Å; D267-T271 PolarHBondContact O-OG1 2.9Å; L268-T271 WeakPolarHBondContact O-CB 3.06Å; L268-T271 PolarHBondContact O-N 3.29Å; T271-A273 PolarHBondContact O-N 3.44Å; T271-Q274 WeakPolarHBondContact O-CB 3.45Å; T271-Q274 PolarHBondContact O-N 3.48Å; T271-E275 PolarHBondContact O-N 3.29Å; T271-E275 VanDerWaalsContact O-N 3.08Å; T271-L385 HydrophobicContact CG2-CD1 3.33Å; T271-L385 HydrophobicContact CG2-CD2 3.7Å; T271-L385 HydrophobicContact CG2-CG 4.11Å
272	L	79.9	Confident	82.1	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-70.7	-33.9	-176.1	-166.9	49.7	0	0	0	113	L144 K147 L148 L211 F238 L268 K269 G270 Q274 E275 L276	L144-L272 HydrophobicContact CD1-CD1 4.48Å; L144-L272 HydrophobicContact CD1-CD2 3.22Å; L144-L272 HydrophobicContact CD1-CG 3.9Å; L144-L272 HydrophobicContact CG-CD2 3.79Å; K147-L272 HydrophobicContact CB-CD1 4.28Å; K147-L272 HydrophobicContact CG-CD1 3.39Å; L148-L272 HydrophobicContact CD2-CD2 3.94Å; L148-L272 HydrophobicContact CG-CD2 4.03Å; L211-L272 HydrophobicContact CD1-CD1 3.75Å; L211-L272 HydrophobicContact CD2-CD1 4.25Å; F238-L272 HydrophobicContact CE2-CB 4.18Å; F238-L272 HydrophobicContact CE2-CD2 4.05Å; F238-L272 HydrophobicContact CE2-CG 3.78Å; L268-L272 VanDerWaalsContact O-CB 3.22Å; L268-L272 WeakPolarHBondContact O-CB 3.3Å; L268-L272 PolarHBondContact O-N 3.39Å; K269-L272 PolarHBondContact O-N 3.45Å; G270-L272 PolarHBondContact O-N 3.1Å; L272-Q274 VanDerWaalsContact C-N 3.31Å; L272-E275 PolarHBondContact O-N 3.09Å; L272-L276 WeakPolarHBondContact O-CG 3.28Å; L272-L276 PolarHBondContact O-N 2.93Å; L272-L276 VanDerWaalsContact O-N 3.13Å
273	A	82.8	Confident	83.5	Confident	47 Å²	47	38.4 Å²	38.4	39%	0.388	20%	0.196	S	C	.	.	H	α-helix	trans	-63.3	-38.4	171.9	0	0	0	0	0	111.8	F238 K269 G270 T271 L276	F238-A273 HydrophobicContact CE1-CB 4.5Å; F238-A273 HydrophobicContact CZ-CB 4.15Å; K269-A273 WeakPolarHBondContact O-CB 3.48Å; K269-A273 PolarHBondContact O-N 3.02Å; G270-A273 PolarHBondContact O-N 2.77Å; T271-A273 PolarHBondContact O-N 3.44Å; A273-L276 PolarHBondContact O-N 3.18Å
274	Q	84.2	Confident	84.8	Confident	57 Å²	57	37.6 Å²	37.6	27%	0.266	19%	0.194	S	C	.	.	H	α-helix	trans	-65.4	-41.3	174.6	-67.7	175.1	14.5	0	0	111.8	G270 T271 L272 L276 D277	G270-Q274 WeakPolarHBondContact O-CG 3.47Å; G270-Q274 PolarHBondContact O-N 3.44Å; G270-Q274 VanDerWaalsContact O-N 3.17Å; T271-Q274 WeakPolarHBondContact O-CB 3.45Å; T271-Q274 PolarHBondContact O-N 3.48Å; L272-Q274 VanDerWaalsContact C-N 3.31Å; Q274-L276 VanDerWaalsContact C-N 3.26Å; Q274-L276 PolarHBondContact O-N 3Å; Q274-D277 PolarHBondContact O-N 3.39Å; Q274-D277 VanDerWaalsContact O-N 3.13Å
275	E	83.5	Confident	86.1	Confident	21 Å²	21	37.7 Å²	37.7	10%	0.098	20%	0.195	C	C	.	.	H	α-helix	trans	-68.5	-22.4	178.4	-72.6	-163.2	-138.1	0	0	114.2	K147 L211 T271 L272 D277 F278	K147-E275 WeakPolarHBondContact CE-OE1 3.4Å; K147-E275 WeakPolarHBondContact CE-OE2 3.36Å; K147-E275 VanDerWaalsContact NZ-CD 3.28Å; K147-E275 IonicContact NZ-OE1 3.36Å; K147-E275 PolarHBondContact NZ-OE1 3.12Å; K147-E275 VanDerWaalsContact NZ-OE1 3.12Å; K147-E275 IonicContact NZ-OE2 3.97Å; K147-E275 PolarHBondContact NZ-OE2 2.79Å; L211-E275 HydrophobicContact CD1-CB 3.88Å; T271-E275 PolarHBondContact O-N 3.29Å; T271-E275 VanDerWaalsContact O-N 3.08Å; L272-E275 PolarHBondContact O-N 3.09Å; E275-D277 VanDerWaalsContact C-N 3.31Å; E275-F278 WeakPolarHBondContact O-CE1 3.42Å
276	L	86.6	Confident	87.4	Confident	10 Å²	10	40 Å²	40	5%	0.052	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-2.1	173.7	-71	174.1	0	0	0	113.4	L211 Q230 L234 F238 L272 A273 Q274	L211-L276 HydrophobicContact CD1-CD2 4.19Å; L211-L276 HydrophobicContact CD2-CD2 4.28Å; Q230-L276 VanDerWaalsContact NE2-C 3.31Å; Q230-L276 PolarHBondContact NE2-O 3.47Å; L234-L276 HydrophobicContact CB-CD2 4.42Å; F238-L276 HydrophobicContact CB-CD1 4.15Å; F238-L276 HydrophobicContact CD2-CD1 3.22Å; F238-L276 HydrophobicContact CE2-CD1 3.67Å; F238-L276 HydrophobicContact CG-CD1 3.72Å; F238-L276 HydrophobicContact CZ-CD1 4.45Å; L272-L276 WeakPolarHBondContact O-CG 3.28Å; L272-L276 PolarHBondContact O-N 2.93Å; L272-L276 VanDerWaalsContact O-N 3.13Å; A273-L276 PolarHBondContact O-N 3.18Å; Q274-L276 VanDerWaalsContact C-N 3.26Å; Q274-L276 PolarHBondContact O-N 3Å
277	D	91.8	Very high	88.5	Confident	40 Å²	40	38.3 Å²	38.3	21%	0.214	19%	0.193	C	C	.	.			trans	-109	94.1	174.5	-164.3	-30.6	0	0	0	110.5	Q274 E275 E279 N280 E281	Q274-D277 PolarHBondContact O-N 3.39Å; Q274-D277 VanDerWaalsContact O-N 3.13Å; E275-D277 VanDerWaalsContact C-N 3.31Å; D277-E279 PolarHBondContact O-N 2.82Å; D277-E279 WeakPolarHBondContact OD1-CB 3.29Å; D277-E279 PolarHBondContact OD1-N 2.82Å; D277-E279 VanDerWaalsContact OD1-N 3.1Å; D277-N280 HydrophobicContact CB-CB 4.03Å; D277-N280 WeakPolarHBondContact O-CB 3.28Å; D277-N280 PolarHBondContact O-N 2.71Å; D277-N280 VanDerWaalsContact O-N 3.1Å; D277-N280 PolarHBondContact OD1-N 2.86Å; D277-E281 PolarHBondContact O-N 3Å; D277-E281 VanDerWaalsContact O-N 3.14Å
278	F	95.3	Very high	89.7	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-70.5	-17.2	-179.4	-79.4	0.6	0	0	0	114.2	A212 K228 Q230 E275 E281 G282 K310 R311 L313	A212-F278 HydrophobicContact CB-CE2 4.19Å; A212-F278 HydrophobicContact CB-CZ 3.67Å; K228-F278 HydrophobicContact CB-CE2 4.18Å; K228-F278 HydrophobicContact CD-CE1 4.02Å; K228-F278 HydrophobicContact CD-CE2 3.87Å; K228-F278 HydrophobicContact CD-CZ 3.55Å; K228-F278 HydrophobicContact CG-CE2 3.66Å; K228-F278 HydrophobicContact CG-CZ 3.68Å; K228-F278 WeakPolarHBondContact O-CE2 3.15Å; Q230-F278 HydrophobicContact CB-CE2 4.48Å; Q230-F278 HydrophobicContact CG-CD2 3.95Å; Q230-F278 HydrophobicContact CG-CE1 4.04Å; Q230-F278 HydrophobicContact CG-CE2 3.36Å; Q230-F278 HydrophobicContact CG-CZ 3.41Å; Q230-F278 VanDerWaalsContact CG-CZ 3.41Å; E275-F278 WeakPolarHBondContact O-CE1 3.42Å; F278-E281 WeakPolarHBondContact CD1-OE2 3.5Å; F278-E281 WeakPolarHBondContact CE1-OE2 3.48Å; F278-G282 PolarHBondContact O-N 3.47Å; F278-K310 PolarHBondContact N-O 3.4Å; F278-K310 VanDerWaalsContact N-O 3.09Å; F278-R311 WeakPolarHBondContact CD2-O 3.37Å; F278-L313 HydrophobicContact CB-CB 4.03Å; F278-L313 HydrophobicContact CD2-CB 3.91Å; F278-L313 HydrophobicContact CG-CB 4.11Å
279	E	95.6	Very high	90.7	Very high	50 Å²	50	37.4 Å²	37.4	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-70.9	-38.5	169.1	-63.2	173.3	180	0	0	110.4	D277 G282 R283 W305 K310	D277-E279 PolarHBondContact O-N 2.82Å; D277-E279 WeakPolarHBondContact OD1-CB 3.29Å; D277-E279 PolarHBondContact OD1-N 2.82Å; D277-E279 VanDerWaalsContact OD1-N 3.1Å; E279-G282 PolarHBondContact O-N 3.09Å; E279-R283 WeakPolarHBondContact O-CG 3.29Å; E279-R283 PolarHBondContact O-N 3.19Å; E279-R283 IonicContact OE2-NH2 3.33Å; E279-R283 PolarHBondContact OE2-NH2 3.34Å; E279-W305 HydrophobicContact CB-CZ3 4.28Å; E279-W305 WeakPolarHBondContact O-CH2 3.27Å; E279-K310 VanDerWaalsContact CD-CG 3.46Å; E279-K310 HydrophobicContact CG-CG 3.97Å; E279-K310 WeakPolarHBondContact OE1-CG 3.5Å; E279-K310 WeakPolarHBondContact OE2-CE 3.35Å
280	N	95.3	Very high	91.6	Very high	44 Å²	44	40.8 Å²	40.8	24%	0.235	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-43.8	173.8	-174.2	64	0	0	0	111	D277 G282 R283 N284	D277-N280 HydrophobicContact CB-CB 4.03Å; D277-N280 WeakPolarHBondContact O-CB 3.28Å; D277-N280 PolarHBondContact O-N 2.71Å; D277-N280 VanDerWaalsContact O-N 3.1Å; D277-N280 PolarHBondContact OD1-N 2.86Å; N280-G282 PolarHBondContact O-N 3.35Å; N280-R283 PolarHBondContact O-N 3.1Å; N280-N284 PolarHBondContact ND2-ND2 2.92Å; N280-N284 WeakPolarHBondContact O-CB 3.21Å; N280-N284 PolarHBondContact O-N 3.18Å; N280-N284 PolarHBondContact O-ND2 3.12Å
281	E	95.7	Very high	92.4	Very high	9 Å²	9	41 Å²	41	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-56.9	-46.7	173.3	179.4	169.7	172.6	0	0	112	K228 D277 F278 R283 N284 A285 L313 H383	K228-E281 IonicContact NZ-OE1 2.78Å; K228-E281 PolarHBondContact NZ-OE1 3.3Å; K228-E281 IonicContact NZ-OE2 3.89Å; K228-E281 PolarHBondContact NZ-OE2 3.4Å; D277-E281 PolarHBondContact O-N 3Å; D277-E281 VanDerWaalsContact O-N 3.14Å; F278-E281 WeakPolarHBondContact CD1-OE2 3.5Å; F278-E281 WeakPolarHBondContact CE1-OE2 3.48Å; E281-R283 PolarHBondContact O-N 3.35Å; E281-N284 WeakPolarHBondContact O-CB 3.36Å; E281-N284 PolarHBondContact O-N 3.4Å; E281-A285 PolarHBondContact O-N 3.16Å; E281-L313 HydrophobicContact CB-CD2 4.26Å; E281-L313 HydrophobicContact CG-CD2 3.66Å; E281-H383 HydrophobicContact CG-CB 4.04Å; E281-H383 WeakPolarHBondContact O-CB 3.4Å; E281-H383 PolarHBondContact OE1-N 3.28Å
282	G	97.2	Very high	93.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.9	-43.1	177.4	0	0	0	0	0	113.2	F278 E279 N280 N284 A285 E286	F278-G282 PolarHBondContact O-N 3.47Å; E279-G282 PolarHBondContact O-N 3.09Å; N280-G282 PolarHBondContact O-N 3.35Å; G282-N284 VanDerWaalsContact C-N 3.34Å; G282-N284 PolarHBondContact O-N 3.25Å; G282-A285 WeakPolarHBondContact O-CB 3.03Å; G282-A285 PolarHBondContact O-N 2.86Å; G282-E286 PolarHBondContact O-N 3.42Å; G282-E286 VanDerWaalsContact O-N 3.07Å
283	R	97.6	Very high	94.1	Very high	139 Å²	139	43.4 Å²	43.4	53%	0.525	23%	0.225	S	C	.	.	H	α-helix	trans	-66	-37.5	176.7	-68.6	177.4	-145.9	156.5	8.8	111.7	E279 N280 E281 A285 R287 W305	E279-R283 WeakPolarHBondContact O-CG 3.29Å; E279-R283 PolarHBondContact O-N 3.19Å; E279-R283 IonicContact OE2-NH2 3.33Å; E279-R283 PolarHBondContact OE2-NH2 3.34Å; N280-R283 PolarHBondContact O-N 3.1Å; E281-R283 PolarHBondContact O-N 3.35Å; R283-A285 VanDerWaalsContact C-N 3.33Å; R283-R287 WeakPolarHBondContact O-CB 3.38Å; R283-R287 PolarHBondContact O-N 2.98Å; R283-W305 HydrophobicContact CG-CH2 3.79Å; R283-W305 HydrophobicContact CG-CZ2 4.08Å
284	N	97.3	Very high	94.6	Very high	17 Å²	17	45.5 Å²	45.5	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-39.8	174.3	-70.2	-23.1	0	0	0	111.5	N280 E281 G282 R287 C288 F356 H383 Y386	N280-N284 PolarHBondContact ND2-ND2 2.92Å; N280-N284 WeakPolarHBondContact O-CB 3.21Å; N280-N284 PolarHBondContact O-N 3.18Å; N280-N284 PolarHBondContact O-ND2 3.12Å; E281-N284 WeakPolarHBondContact O-CB 3.36Å; E281-N284 PolarHBondContact O-N 3.4Å; G282-N284 VanDerWaalsContact C-N 3.34Å; G282-N284 PolarHBondContact O-N 3.25Å; N284-R287 PolarHBondContact O-N 2.9Å; N284-C288 VanDerWaalsContact O-CB 3.23Å; N284-C288 WeakPolarHBondContact O-CB 3.46Å; N284-C288 PolarHBondContact O-N 3.32Å; N284-F356 HydrophobicContact CB-CZ 4.05Å; N284-H383 HydrophobicContact CB-CB 3.93Å; N284-H383 VanDerWaalsContact CB-O 3.32Å; N284-H383 WeakPolarHBondContact CB-O 3.37Å; N284-H383 PolarHBondContact ND2-O 2.9Å; N284-Y386 HydrophobicContact CB-CD2 3.96Å; N284-Y386 HydrophobicContact CB-CE2 4.4Å; N284-Y386 HydrophobicContact CB-CG 4.3Å
285	A	97.4	Very high	95.2	Very high	6 Å²	6	43.5 Å²	43.5	5%	0.05	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-51.7	176.1	0	0	0	0	0	111.3	E281 G282 R283 R287 C288 A289 V300 V303 H383	E281-A285 PolarHBondContact O-N 3.16Å; G282-A285 WeakPolarHBondContact O-CB 3.03Å; G282-A285 PolarHBondContact O-N 2.86Å; R283-A285 VanDerWaalsContact C-N 3.33Å; A285-R287 VanDerWaalsContact C-N 3.33Å; A285-R287 PolarHBondContact O-N 3.44Å; A285-C288 WeakPolarHBondContact O-CB 3.26Å; A285-C288 PolarHBondContact O-N 2.92Å; A285-A289 PolarHBondContact O-N 2.82Å; A285-V300 HydrophobicContact CB-CG1 3.91Å; A285-V300 WeakPolarHBondContact O-CG1 3.4Å; A285-V303 HydrophobicContact CB-CG2 4.22Å; A285-H383 HydrophobicContact CB-CB 3.99Å
286	E	97.9	Very high	95.8	Very high	70 Å²	70	47.7 Å²	47.7	33%	0.327	25%	0.246	S	C	.	.	H	α-helix	trans	-60.5	-42.4	178.7	-69.2	-174.7	148.2	0	0	112.5	G282 A289 Q290 V303 W305	G282-E286 PolarHBondContact O-N 3.42Å; G282-E286 VanDerWaalsContact O-N 3.07Å; E286-A289 WeakPolarHBondContact O-CB 3.41Å; E286-A289 PolarHBondContact O-N 2.87Å; E286-Q290 VanDerWaalsContact O-CG 3.29Å; E286-Q290 WeakPolarHBondContact O-CG 3.34Å; E286-Q290 PolarHBondContact O-N 2.98Å; E286-V303 HydrophobicContact CG-CG2 4.45Å; E286-W305 VanDerWaalsContact CD-NE1 3.3Å; E286-W305 PolarHBondContact OE1-NE1 3.35Å; E286-W305 PolarHBondContact OE2-NE1 2.78Å
287	R	97.6	Very high	96.2	Very high	102 Å²	102	48.8 Å²	48.8	39%	0.385	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-43.9	175.8	-178.1	172.8	-179	154	2.7	112	R283 N284 A285 A289 Q290 E291 F356 F388	R283-R287 WeakPolarHBondContact O-CB 3.38Å; R283-R287 PolarHBondContact O-N 2.98Å; N284-R287 PolarHBondContact O-N 2.9Å; A285-R287 VanDerWaalsContact C-N 3.33Å; A285-R287 PolarHBondContact O-N 3.44Å; R287-A289 VanDerWaalsContact C-N 3.3Å; R287-A289 PolarHBondContact O-N 3.31Å; R287-Q290 PolarHBondContact O-N 2.93Å; R287-E291 HydrophobicContact CG-CG 4.36Å; R287-E291 IonicContact CZ-OE1 3.35Å; R287-E291 IonicContact NE-OE1 3.91Å; R287-E291 PolarHBondContact NE-OE1 2.8Å; R287-E291 IonicContact NH2-OE1 3.58Å; R287-E291 PolarHBondContact NH2-OE1 3.39Å; R287-E291 WeakPolarHBondContact O-CG 3.39Å; R287-E291 PolarHBondContact O-N 3.32Å; R287-F356 HydrophobicContact CB-CE1 3.84Å; R287-F356 HydrophobicContact CB-CZ 4.29Å; R287-F356 HydrophobicContact CG-CD1 3.91Å; R287-F356 HydrophobicContact CG-CE1 3.67Å; R287-F356 HydrophobicContact CG-CZ 4.24Å; R287-F388 VanDerWaalsContact NH2-CZ 3.34Å
288	C	97.4	Very high	96.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-43.9	175.9	-177.7	0	0	0	0	110.9	N284 A285 Q290 E291 L292 Q350 F356 Y386	N284-C288 VanDerWaalsContact O-CB 3.23Å; N284-C288 WeakPolarHBondContact O-CB 3.46Å; N284-C288 PolarHBondContact O-N 3.32Å; A285-C288 WeakPolarHBondContact O-CB 3.26Å; A285-C288 PolarHBondContact O-N 2.92Å; C288-Q290 VanDerWaalsContact C-N 3.34Å; C288-Q290 PolarHBondContact O-N 2.77Å; C288-E291 PolarHBondContact O-N 3.37Å; C288-L292 WeakPolarHBondContact O-CB 3.18Å; C288-L292 WeakPolarHBondContact O-CG 3.47Å; C288-L292 PolarHBondContact O-N 3.17Å; C288-Q350 PolarHBondContact SG-NE2 3.43Å; C288-F356 HydrophobicContact CB-CE1 4.37Å; C288-Y386 HydrophobicContact CB-CE1 4.29Å; C288-Y386 PolarHBondContact SG-OH 3.46Å
289	A	97.3	Very high	96.6	Very high	39 Å²	39	49 Å²	49	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-58.6	-44.5	175.5	0	0	0	0	0	112	A285 E286 R287 A293 V300	A285-A289 PolarHBondContact O-N 2.82Å; E286-A289 WeakPolarHBondContact O-CB 3.41Å; E286-A289 PolarHBondContact O-N 2.87Å; R287-A289 VanDerWaalsContact C-N 3.3Å; R287-A289 PolarHBondContact O-N 3.31Å; A289-A293 WeakPolarHBondContact O-CA 3.31Å; A289-A293 WeakPolarHBondContact O-CB 3.34Å; A289-A293 PolarHBondContact O-N 3.23Å; A289-V300 HydrophobicContact CB-CB 3.82Å; A289-V300 HydrophobicContact CB-CG1 4.26Å; A289-V300 HydrophobicContact CB-CG2 4.13Å
290	Q	97.1	Very high	96.7	Very high	144 Å²	144	47.8 Å²	47.8	67%	0.673	25%	0.247	S	C	*	.	H	α-helix	trans	-65.2	-47.6	178	-70.8	169	8.7	0	0	112.3	E286 R287 C288 L292 A293	E286-Q290 VanDerWaalsContact O-CG 3.29Å; E286-Q290 WeakPolarHBondContact O-CG 3.34Å; E286-Q290 PolarHBondContact O-N 2.98Å; R287-Q290 PolarHBondContact O-N 2.93Å; C288-Q290 VanDerWaalsContact C-N 3.34Å; C288-Q290 PolarHBondContact O-N 2.77Å; Q290-L292 VanDerWaalsContact C-N 3.33Å; Q290-L292 PolarHBondContact O-N 2.86Å; Q290-A293 WeakPolarHBondContact O-CB 3.41Å; Q290-A293 PolarHBondContact O-N 3.28Å
291	E	95.1	Very high	96.8	Very high	39 Å²	39	46.4 Å²	46.4	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-34	-177.7	-73.3	-172	-175.9	0	0	112.4	R287 C288 H294 T354 F356	R287-E291 HydrophobicContact CG-CG 4.36Å; R287-E291 IonicContact CZ-OE1 3.35Å; R287-E291 IonicContact NE-OE1 3.91Å; R287-E291 PolarHBondContact NE-OE1 2.8Å; R287-E291 IonicContact NH2-OE1 3.58Å; R287-E291 PolarHBondContact NH2-OE1 3.39Å; R287-E291 WeakPolarHBondContact O-CG 3.39Å; R287-E291 PolarHBondContact O-N 3.32Å; C288-E291 PolarHBondContact O-N 3.37Å; E291-H294 PolarHBondContact O-CE1 3.48Å; E291-H294 VanDerWaalsContact O-CE1 3.24Å; E291-H294 PolarHBondContact O-ND1 3.02Å; E291-H294 VanDerWaalsContact O-ND1 3.07Å; E291-T354 HydrophobicContact CB-CG2 4.2Å; E291-T354 WeakPolarHBondContact OE2-CB 3.45Å; E291-T354 PolarHBondContact OE2-OG1 2.94Å; E291-F356 WeakPolarHBondContact OE2-CB 3.28Å
292	L	96.6	Very high	96.9	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	5.3	179.4	-59.5	-178.1	0	0	0	114.1	C288 Q290 H294 F295 I298 E349 Q350 L380	C288-L292 WeakPolarHBondContact O-CB 3.18Å; C288-L292 WeakPolarHBondContact O-CG 3.47Å; C288-L292 PolarHBondContact O-N 3.17Å; Q290-L292 VanDerWaalsContact C-N 3.33Å; Q290-L292 PolarHBondContact O-N 2.86Å; L292-H294 PolarHBondContact O-N 3.14Å; L292-F295 HydrophobicContact CD2-CD2 4Å; L292-F295 HydrophobicContact CD2-CE2 4.13Å; L292-F295 WeakPolarHBondContact O-CB 3.45Å; L292-F295 PolarHBondContact O-N 3.09Å; L292-I298 HydrophobicContact CB-CG2 4.17Å; L292-I298 HydrophobicContact CD1-CG2 4.03Å; L292-E349 HydrophobicContact CD2-CB 4.34Å; L292-E349 HydrophobicContact CD2-CG 4.31Å; L292-Q350 HydrophobicContact CD2-CG 4.33Å; L292-L380 HydrophobicContact CD1-CD1 3.86Å
293	A	96	Very high	97	Very high	74 Å²	74	53 Å²	53	61%	0.612	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.2	-177.5	0	0	0	0	0	114.1	A289 Q290 F295	A289-A293 WeakPolarHBondContact O-CA 3.31Å; A289-A293 WeakPolarHBondContact O-CB 3.34Å; A289-A293 PolarHBondContact O-N 3.23Å; Q290-A293 WeakPolarHBondContact O-CB 3.41Å; Q290-A293 PolarHBondContact O-N 3.28Å; A293-F295 PolarHBondContact O-N 2.85Å
294	H	94.9	Very high	97	Very high	91 Å²	91	46.9 Å²	46.9	42%	0.421	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-7.8	176.7	68.3	-85.2	0	0	0	113.8	E291 L292 P296 E349	E291-H294 PolarHBondContact O-CE1 3.48Å; E291-H294 VanDerWaalsContact O-CE1 3.24Å; E291-H294 PolarHBondContact O-ND1 3.02Å; E291-H294 VanDerWaalsContact O-ND1 3.07Å; L292-H294 PolarHBondContact O-N 3.14Å; H294-P296 WeakPolarHBondContact O-CD 3.45Å; H294-E349 IonicContact CE1-OE1 3.39Å; H294-E349 IonicContact NE2-OE1 2.86Å
295	F	96.4	Very high	97	Very high	15 Å²	15	50.5 Å²	50.5	7%	0.066	26%	0.256	C	S	.	.			trans	-101.2	96.2	168.3	-64.7	-42.5	0	0	0	109.8	L292 A293 Y297 I298 E349	L292-F295 HydrophobicContact CD2-CD2 4Å; L292-F295 HydrophobicContact CD2-CE2 4.13Å; L292-F295 WeakPolarHBondContact O-CB 3.45Å; L292-F295 PolarHBondContact O-N 3.09Å; A293-F295 PolarHBondContact O-N 2.85Å; F295-Y297 HydrophobicContact CB-CD1 4.34Å; F295-Y297 HydrophobicContact CB-CD2 4.4Å; F295-Y297 HydrophobicContact CB-CE1 3.91Å; F295-Y297 HydrophobicContact CB-CE2 3.96Å; F295-Y297 AromaticContact CD1-CE1 3.83Å; F295-Y297 HydrophobicContact CD1-CE1 3.83Å; F295-Y297 AromaticContact CD1-CZ 3.67Å; F295-Y297 VanDerWaalsContact CD1-OH 3.24Å; F295-Y297 WeakPolarHBondContact CD1-OH 3.23Å; F295-Y297 HydrophobicContact CG-CE1 4.1Å; F295-Y297 HydrophobicContact CG-CE2 4.22Å; F295-Y297 AromaticContact CG-CZ 3.68Å; F295-Y297 WeakPolarHBondContact CG-OH 3.41Å; F295-Y297 PolarHBondContact O-N 3.13Å; F295-I298 HydrophobicContact CB-CB 4.28Å; F295-I298 HydrophobicContact CB-CG1 3.72Å; F295-I298 HydrophobicContact CD2-CG1 4.38Å; F295-I298 HydrophobicContact CG-CG1 4.49Å; F295-I298 PolarHBondContact O-N 3.3Å; F295-E349 HydrophobicContact CE2-CB 3.77Å; F295-E349 HydrophobicContact CE2-CG 3.86Å; F295-E349 HydrophobicContact CZ-CB 4.2Å; F295-E349 HydrophobicContact CZ-CG 4.19Å
296	P	94.9	Very high	96.9	Very high	109 Å²	109	55.3 Å²	55.3	71%	0.708	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-9.9	-175.7	28.9	-36.9	0	0	0	113.7	H294	H294-P296 WeakPolarHBondContact O-CD 3.45Å
297	Y	96.3	Very high	96.8	Very high	33 Å²	33	53.4 Å²	53.4	13%	0.129	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-5.1	175.5	58.3	-102.1	0	0	0	113.4	F295 K342 Q377 L378	F295-Y297 HydrophobicContact CB-CD1 4.34Å; F295-Y297 HydrophobicContact CB-CD2 4.4Å; F295-Y297 HydrophobicContact CB-CE1 3.91Å; F295-Y297 HydrophobicContact CB-CE2 3.96Å; F295-Y297 AromaticContact CD1-CE1 3.83Å; F295-Y297 HydrophobicContact CD1-CE1 3.83Å; F295-Y297 AromaticContact CD1-CZ 3.67Å; F295-Y297 VanDerWaalsContact CD1-OH 3.24Å; F295-Y297 WeakPolarHBondContact CD1-OH 3.23Å; F295-Y297 HydrophobicContact CG-CE1 4.1Å; F295-Y297 HydrophobicContact CG-CE2 4.22Å; F295-Y297 AromaticContact CG-CZ 3.68Å; F295-Y297 WeakPolarHBondContact CG-OH 3.41Å; F295-Y297 PolarHBondContact O-N 3.13Å; Y297-K342 HydrophobicContact CD1-CD 4.17Å; Y297-K342 HydrophobicContact CD1-CG 4.04Å; Y297-K342 HydrophobicContact CD2-CB 3.64Å; Y297-K342 HydrophobicContact CD2-CD 3.72Å; Y297-K342 HydrophobicContact CD2-CG 3.57Å; Y297-K342 HydrophobicContact CE1-CG 4.05Å; Y297-K342 HydrophobicContact CE2-CB 3.46Å; Y297-K342 VanDerWaalsContact CE2-CB 3.46Å; Y297-K342 HydrophobicContact CE2-CD 4.28Å; Y297-K342 HydrophobicContact CE2-CG 3.6Å; Y297-K342 HydrophobicContact CG-CB 4.38Å; Y297-K342 HydrophobicContact CG-CD 3.65Å; Y297-K342 HydrophobicContact CG-CG 3.8Å; Y297-Q377 CarbonylContact O-C 3.47Å; Y297-Q377 WeakPolarHBondContact O-CA 3.17Å; Y297-L378 PolarHBondContact O-N 2.91Å
298	I	97.5	Very high	96.8	Very high	20 Å²	20	49.2 Å²	49.2	10%	0.103	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.6	173.9	-61.1	-57.7	0	0	0	108.8	L292 F295 V300 A346 L378 L380	L292-I298 HydrophobicContact CB-CG2 4.17Å; L292-I298 HydrophobicContact CD1-CG2 4.03Å; F295-I298 HydrophobicContact CB-CB 4.28Å; F295-I298 HydrophobicContact CB-CG1 3.72Å; F295-I298 HydrophobicContact CD2-CG1 4.38Å; F295-I298 HydrophobicContact CG-CG1 4.49Å; F295-I298 PolarHBondContact O-N 3.3Å; I298-V300 HydrophobicContact CG2-CG2 4.37Å; I298-A346 HydrophobicContact CD1-CB 3.81Å; I298-A346 HydrophobicContact CG1-CB 4.24Å; I298-L378 WeakPolarHBondContact CA-O 3.46Å; I298-L378 HydrophobicContact CD1-CB 3.91Å; I298-L378 HydrophobicContact CD1-CD1 4.01Å; I298-L378 HydrophobicContact CD1-CG 4.34Å; I298-L380 HydrophobicContact CG2-CD1 3.83Å; I298-L380 HydrophobicContact CG2-CG 4.12Å
299	V	97.4	Very high	96.7	Very high	27 Å²	27	49.8 Å²	49.8	16%	0.164	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.2	175.9	-179.6	0	0	0	0	107.3	Q377 L378 V379 L380	V299-Q377 HydrophobicContact CG2-CB 4.36Å; V299-L378 PolarHBondContact N-O 3.29Å; V299-V379 HydrophobicContact CB-CG2 4.2Å; V299-V379 HydrophobicContact CG1-CG1 4.43Å; V299-V379 HydrophobicContact CG1-CG2 4.49Å; V299-V379 CarbonylContact O-C 3.59Å; V299-V379 VanDerWaalsContact O-CA 3.27Å; V299-V379 WeakPolarHBondContact O-CA 3.1Å; V299-L380 PolarHBondContact O-N 3.17Å
300	V	97.8	Very high	96.5	Very high	23 Å²	23	51.7 Å²	51.7	14%	0.139	26%	0.263	C	S	.	.			trans	-116.2	124.7	168.7	178.9	0	0	0	0	106.5	A285 A289 I298 R302 L380	A285-V300 HydrophobicContact CB-CG1 3.91Å; A285-V300 WeakPolarHBondContact O-CG1 3.4Å; A289-V300 HydrophobicContact CB-CB 3.82Å; A289-V300 HydrophobicContact CB-CG1 4.26Å; A289-V300 HydrophobicContact CB-CG2 4.13Å; I298-V300 HydrophobicContact CG2-CG2 4.37Å; V300-R302 PolarHBondContact O-N 3.5Å; V300-L380 HydrophobicContact CG2-CB 4.41Å
301	P	97.5	Very high	96.4	Very high	16 Å²	16	45.7 Å²	45.7	10%	0.104	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-54.3	133.5	177.8	-28.4	36.6	0	0	0	112.1	A315 D316 V379 L380 L381	P301-A315 HydrophobicContact CB-CB 3.9Å; P301-D316 HydrophobicContact CB-CB 4.31Å; P301-D316 WeakPolarHBondContact CB-O 3.34Å; P301-V379 HydrophobicContact CG-CG1 4.12Å; P301-L380 VanDerWaalsContact CD-O 3.24Å; P301-L380 WeakPolarHBondContact CD-O 3.13Å; P301-L381 HydrophobicContact CG-CD2 3.66Å
302	R	97.8	Very high	96.4	Very high	138 Å²	138	43.9 Å²	43.9	52%	0.521	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-68	135.2	175.2	-175.6	179	61.2	130.6	-5.1	109.8	V300 H304 A315 D316	V300-R302 PolarHBondContact O-N 3.5Å; R302-H304 PolarHBondContact NH2-CE1 3.35Å; R302-A315 CarbonylContact O-C 3.58Å; R302-A315 WeakPolarHBondContact O-CA 3.45Å; R302-A315 WeakPolarHBondContact O-CB 3.47Å; R302-D316 VanDerWaalsContact CB-OD2 3.24Å; R302-D316 WeakPolarHBondContact CB-OD2 3.5Å; R302-D316 IonicContact NE-OD1 3.96Å; R302-D316 IonicContact NE-OD2 3.44Å; R302-D316 IonicContact NH2-OD1 3.96Å; R302-D316 PolarHBondContact O-N 2.77Å
303	V	98.3	Very high	96.5	Very high	8 Å²	8	44.4 Å²	44.4	5%	0.048	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-82.7	138.2	175.8	-179	0	0	0	0	110.1	A285 E286 W305 L313	A285-V303 HydrophobicContact CB-CG2 4.22Å; E286-V303 HydrophobicContact CG-CG2 4.45Å; V303-W305 HydrophobicContact CB-CZ2 4.42Å; V303-W305 HydrophobicContact CG1-CD2 3.84Å; V303-W305 HydrophobicContact CG1-CE3 4.18Å; V303-W305 HydrophobicContact CG1-CG 4.29Å; V303-W305 HydrophobicContact CG1-CH2 4.28Å; V303-W305 HydrophobicContact CG1-CZ2 3.98Å; V303-W305 HydrophobicContact CG1-CZ3 4.39Å; V303-L313 HydrophobicContact CG1-CD1 3.8Å; V303-L313 HydrophobicContact CG2-CD1 4.37Å
304	H	97.9	Very high	96.6	Very high	12 Å²	12	40.9 Å²	40.9	6%	0.056	20%	0.199	C	C	.	.			trans	-104.7	90.1	173.9	-63.9	-97.2	0	0	0	109	L219 R302 D306 K307 S308 T314 D316	L219-H304 VanDerWaalsContact CD1-CE1 3.42Å; L219-H304 WeakPolarHBondContact CD1-CE1 3.44Å; L219-H304 WeakPolarHBondContact CD1-ND1 3.49Å; R302-H304 PolarHBondContact NH2-CE1 3.35Å; H304-D306 VanDerWaalsContact C-N 3.31Å; H304-D306 PolarHBondContact O-N 3.41Å; H304-K307 CarbonylContact O-C 3.44Å; H304-K307 PolarHBondContact O-N 3.48Å; H304-K307 VanDerWaalsContact O-N 3.12Å; H304-S308 WeakPolarHBondContact O-CB 3.33Å; H304-S308 PolarHBondContact O-N 3.44Å; H304-S308 PolarHBondContact O-OG 2.9Å; H304-T314 HydrophobicContact CB-CG2 3.92Å; H304-T314 PolarHBondContact N-O 3.46Å; H304-D316 IonicContact CD2-OD1 3.82Å; H304-D316 IonicContact CE1-OD1 3.57Å; H304-D316 IonicContact NE2-OD1 2.75Å; H304-D316 PolarHBondContact NE2-OD1 3.1Å
305	W	97.4	Very high	96.7	Very high	93 Å²	93	37.3 Å²	37.3	35%	0.352	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-63.9	-31.9	-172	-71.7	110.1	0	0	0	114.3	E279 R283 E286 V303 K307 S308	E279-W305 HydrophobicContact CB-CZ3 4.28Å; E279-W305 WeakPolarHBondContact O-CH2 3.27Å; R283-W305 HydrophobicContact CG-CH2 3.79Å; R283-W305 HydrophobicContact CG-CZ2 4.08Å; E286-W305 VanDerWaalsContact CD-NE1 3.3Å; E286-W305 PolarHBondContact OE1-NE1 3.35Å; E286-W305 PolarHBondContact OE2-NE1 2.78Å; V303-W305 HydrophobicContact CB-CZ2 4.42Å; V303-W305 HydrophobicContact CG1-CD2 3.84Å; V303-W305 HydrophobicContact CG1-CE3 4.18Å; V303-W305 HydrophobicContact CG1-CG 4.29Å; V303-W305 HydrophobicContact CG1-CH2 4.28Å; V303-W305 HydrophobicContact CG1-CZ2 3.98Å; V303-W305 HydrophobicContact CG1-CZ3 4.39Å; W305-K307 PolarHBondContact O-N 3.1Å; W305-S308 PolarHBondContact O-N 3.02Å
306	D	95.4	Very high	96.8	Very high	107 Å²	107	38.8 Å²	38.8	57%	0.572	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-67.2	-15.3	176.8	64.7	-45	0	0	0	113.2	H304	H304-D306 VanDerWaalsContact C-N 3.31Å; H304-D306 PolarHBondContact O-N 3.41Å
307	K	96.3	Very high	96.9	Very high	30 Å²	30	36.7 Å²	36.7	13%	0.13	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-123	23.7	177.5	-62.2	170.5	-177.5	78.7	0	111.3	L197 F198 L219 H304 W305 T314	L197-K307 WeakPolarHBondContact O-CE 3.36Å; F198-K307 HydrophobicContact CD1-CD 4.41Å; F198-K307 HydrophobicContact CE1-CB 4.5Å; F198-K307 HydrophobicContact CE1-CD 3.83Å; F198-K307 HydrophobicContact CZ-CB 4.2Å; F198-K307 HydrophobicContact CZ-CD 4.24Å; L219-K307 HydrophobicContact CD2-CD 3.41Å; L219-K307 VanDerWaalsContact CD2-CD 3.41Å; H304-K307 CarbonylContact O-C 3.44Å; H304-K307 PolarHBondContact O-N 3.48Å; H304-K307 VanDerWaalsContact O-N 3.12Å; W305-K307 PolarHBondContact O-N 3.1Å; K307-T314 HydrophobicContact CB-CG2 4.21Å; K307-T314 WeakPolarHBondContact O-CB 3.38Å; K307-T314 PolarHBondContact O-OG1 2.83Å
308	S	97.2	Very high	96.8	Very high	14 Å²	14	36 Å²	36	10%	0.098	17%	0.173	C	C	.	.			trans	-126.3	150.3	178	-58.9	0	0	0	0	110.2	H304 W305 V312 T314	H304-S308 WeakPolarHBondContact O-CB 3.33Å; H304-S308 PolarHBondContact O-N 3.44Å; H304-S308 PolarHBondContact O-OG 2.9Å; W305-S308 PolarHBondContact O-N 3.02Å; S308-V312 CarbonylContact C-O 3.55Å; S308-V312 VanDerWaalsContact CA-O 3.22Å; S308-V312 WeakPolarHBondContact CA-O 3.31Å; S308-T314 PolarHBondContact OG-N 3.17Å
309	S	96	Very high	96.6	Very high	12 Å²	12	38.1 Å²	38.1	8%	0.084	19%	0.194	C	C	.	.			trans	-145	-175.6	179.3	74.5	0	0	0	0	108.4	D189 R311 V312	D189-S309 WeakPolarHBondContact OD2-CB 3.5Å; D189-S309 PolarHBondContact OD2-OG 2.9Å; S309-R311 PolarHBondContact O-N 3.19Å; S309-R311 VanDerWaalsContact O-N 3.16Å; S309-R311 PolarHBondContact OG-N 3.33Å; S309-V312 PolarHBondContact N-O 2.92Å; S309-V312 PolarHBondContact OG-N 2.99Å
310	K	93.6	Very high	96.4	Very high	79 Å²	79	38.6 Å²	38.6	34%	0.343	21%	0.205	S	C	.	.	S	Bend	trans	-61.4	-20.7	171.4	-63.1	-164.8	175.6	-161.2	0	114.4	Q230 R235 F278 E279	Q230-K310 PolarHBondContact NE2-O 2.92Å; Q230-K310 VanDerWaalsContact NE2-O 3.08Å; R235-K310 VanDerWaalsContact NH1-CB 3.27Å; F278-K310 PolarHBondContact N-O 3.4Å; F278-K310 VanDerWaalsContact N-O 3.09Å; E279-K310 VanDerWaalsContact CD-CG 3.46Å; E279-K310 HydrophobicContact CG-CG 3.97Å; E279-K310 WeakPolarHBondContact OE1-CG 3.5Å; E279-K310 WeakPolarHBondContact OE2-CE 3.35Å
311	R	93.6	Very high	96.2	Very high	18 Å²	18	38.3 Å²	38.3	7%	0.068	20%	0.203	C	C	.	.	S	Bend	trans	-119.1	-8.8	-175.8	-53.2	-178.7	-78.5	178.8	-6	114.1	L185 E188 D189 Q230 F278 S309	L185-R311 HydrophobicContact CD1-CB 4.18Å; L185-R311 HydrophobicContact CD2-CB 4.1Å; L185-R311 HydrophobicContact CG-CB 4.41Å; E188-R311 IonicContact OE2-CZ 3.12Å; E188-R311 VanDerWaalsContact OE2-CZ 3.28Å; E188-R311 IonicContact OE2-NH1 2.91Å; E188-R311 PolarHBondContact OE2-NH1 3.18Å; E188-R311 IonicContact OE2-NH2 2.61Å; E188-R311 PolarHBondContact OE2-NH2 3.31Å; D189-R311 IonicContact OD1-CZ 2.63Å; D189-R311 IonicContact OD1-NE 3.35Å; D189-R311 PolarHBondContact OD1-NE 2.81Å; D189-R311 IonicContact OD1-NH2 3.12Å; D189-R311 PolarHBondContact OD1-NH2 3.07Å; D189-R311 WeakPolarHBondContact OD2-CB 3.5Å; D189-R311 IonicContact OD2-NE 3.52Å; D189-R311 PolarHBondContact OD2-NE 2.82Å; Q230-R311 HydrophobicContact CB-CB 4.31Å; Q230-R311 HydrophobicContact CG-CB 4.4Å; Q230-R311 PolarHBondContact N-O 2.88Å; F278-R311 WeakPolarHBondContact CD2-O 3.37Å; S309-R311 PolarHBondContact O-N 3.19Å; S309-R311 VanDerWaalsContact O-N 3.16Å; S309-R311 PolarHBondContact OG-N 3.33Å
312	V	95.9	Very high	95.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.9	175.1	-178.5	0	0	0	0	109.5	L185 F186 F190 V227 K228 V229 S308 S309	L185-V312 HydrophobicContact CD2-CG2 3.19Å; F186-V312 HydrophobicContact CE1-CG1 4.42Å; F186-V312 HydrophobicContact CE2-CG1 4.31Å; F186-V312 HydrophobicContact CE2-CG2 4.08Å; F186-V312 HydrophobicContact CZ-CG1 3.79Å; F186-V312 HydrophobicContact CZ-CG2 4.22Å; F190-V312 HydrophobicContact CE2-CB 3.79Å; F190-V312 HydrophobicContact CE2-CG1 4.15Å; F190-V312 HydrophobicContact CE2-CG2 3.76Å; F190-V312 HydrophobicContact CZ-CB 4Å; F190-V312 HydrophobicContact CZ-CG1 4.33Å; F190-V312 HydrophobicContact CZ-CG2 4.46Å; V227-V312 HydrophobicContact CG1-CG1 3.65Å; K228-V312 CarbonylContact O-C 3.46Å; K228-V312 VanDerWaalsContact O-CA 3.31Å; K228-V312 WeakPolarHBondContact O-CA 3.49Å; V229-V312 HydrophobicContact CG1-CG2 4.5Å; S308-V312 CarbonylContact C-O 3.55Å; S308-V312 VanDerWaalsContact CA-O 3.22Å; S308-V312 WeakPolarHBondContact CA-O 3.31Å; S309-V312 PolarHBondContact N-O 2.92Å; S309-V312 PolarHBondContact OG-N 2.99Å
313	L	97.5	Very high	95.7	Very high	14 Å²	14	36.6 Å²	36.6	7%	0.073	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	118	171.5	179.6	62.8	0	0	0	109.1	K228 F278 E281 V303	K228-L313 HydrophobicContact CB-CB 4.22Å; K228-L313 PolarHBondContact N-O 3.35Å; K228-L313 PolarHBondContact O-N 3.45Å; F278-L313 HydrophobicContact CB-CB 4.03Å; F278-L313 HydrophobicContact CD2-CB 3.91Å; F278-L313 HydrophobicContact CG-CB 4.11Å; E281-L313 HydrophobicContact CB-CD2 4.26Å; E281-L313 HydrophobicContact CG-CD2 3.66Å; V303-L313 HydrophobicContact CG1-CD1 3.8Å; V303-L313 HydrophobicContact CG2-CD1 4.37Å
314	T	98.1	Very high	95.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.9	174.7	-61.4	0	0	0	0	109.3	F198 V225 V227 H304 K307 S308	F198-T314 HydrophobicContact CE1-CG2 3.97Å; F198-T314 HydrophobicContact CZ-CG2 4.22Å; V225-T314 HydrophobicContact CB-CG2 3.9Å; V225-T314 HydrophobicContact CG1-CG2 4.21Å; V225-T314 HydrophobicContact CG2-CG2 3.93Å; V227-T314 HydrophobicContact CG2-CG2 4.22Å; H304-T314 HydrophobicContact CB-CG2 3.92Å; H304-T314 PolarHBondContact N-O 3.46Å; K307-T314 HydrophobicContact CB-CG2 4.21Å; K307-T314 WeakPolarHBondContact O-CB 3.38Å; K307-T314 PolarHBondContact O-OG1 2.83Å; S308-T314 PolarHBondContact OG-N 3.17Å
315	A	98.1	Very high	95.1	Very high	16 Å²	16	42.1 Å²	42.1	13%	0.132	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	161.1	178.5	0	0	0	0	0	112	V225 A226 P301 R302 F317	V225-A315 CarbonylContact C-O 3.2Å; V225-A315 VanDerWaalsContact CA-O 3.27Å; V225-A315 WeakPolarHBondContact CA-O 3.37Å; V225-A315 WeakPolarHBondContact CB-O 3.45Å; A226-A315 PolarHBondContact N-O 3.17Å; A226-A315 PolarHBondContact O-N 3.19Å; P301-A315 HydrophobicContact CB-CB 3.9Å; R302-A315 CarbonylContact O-C 3.58Å; R302-A315 WeakPolarHBondContact O-CA 3.45Å; R302-A315 WeakPolarHBondContact O-CB 3.47Å; A315-F317 PolarHBondContact O-N 2.86Å
316	D	98.1	Very high	94.9	Very high	45 Å²	45	39.3 Å²	39.3	24%	0.241	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	131.4	177.4	-74.4	-13.6	0	0	0	111.8	P301 R302 H304 C318	P301-D316 HydrophobicContact CB-CB 4.31Å; P301-D316 WeakPolarHBondContact CB-O 3.34Å; R302-D316 VanDerWaalsContact CB-OD2 3.24Å; R302-D316 WeakPolarHBondContact CB-OD2 3.5Å; R302-D316 IonicContact NE-OD1 3.96Å; R302-D316 IonicContact NE-OD2 3.44Å; R302-D316 IonicContact NH2-OD1 3.96Å; R302-D316 PolarHBondContact O-N 2.77Å; H304-D316 IonicContact CD2-OD1 3.82Å; H304-D316 IonicContact CE1-OD1 3.57Å; H304-D316 IonicContact NE2-OD1 2.75Å; H304-D316 PolarHBondContact NE2-OD1 3.1Å; D316-C318 PolarHBondContact O-N 2.95Å
317	F	97	Very high	94.8	Very high	66 Å²	66	42 Å²	42	29%	0.289	23%	0.23	S	C	.	.			trans	-72.8	123	176.4	179.5	-97.7	0	0	0	110.2	I206 R216 S224 A226 A315 A319	I206-F317 HydrophobicContact CD1-CD2 4.32Å; I206-F317 HydrophobicContact CD1-CE2 3.74Å; R216-F317 HydrophobicContact CG-CD2 4.49Å; S224-F317 WeakPolarHBondContact O-CB 3.49Å; S224-F317 PolarHBondContact O-N 3.38Å; A226-F317 HydrophobicContact CB-CD2 4.28Å; A315-F317 PolarHBondContact O-N 2.86Å; F317-A319 HydrophobicContact CE1-CB 4.33Å
318	C	94.8	Very high	94.7	Very high	17 Å²	17	41.6 Å²	41.6	12%	0.115	23%	0.232	C	C	.	.			trans	-114.2	120.1	177.2	-70.6	0	0	0	0	111.1	D316 L367 V379	D316-C318 PolarHBondContact O-N 2.95Å; C318-L367 WeakPolarHBondContact O-CD1 3.35Å; C318-V379 HydrophobicContact CB-CB 4.49Å; C318-V379 HydrophobicContact CB-CG1 3.69Å; C318-V379 HydrophobicContact CB-CG2 4.23Å
319	A	92.3	Very high	94.6	Very high	65 Å²	65	40.9 Å²	40.9	54%	0.537	23%	0.227	S	C	.	.			trans	-80.5	147.6	169.8	0	0	0	0	0	111.4	F317	F317-A319 HydrophobicContact CE1-CB 4.33Å
320	G	93.2	Very high	94.5	Very high	38 Å²	38	48.8 Å²	48.8	39%	0.392	26%	0.255	S	S	.	.			trans	170.4	168.9	175.7	0	0	0	0	0	111.6	V368	G320-V368 CarbonylContact C-O 3.47Å; G320-V368 WeakPolarHBondContact CA-O 3.38Å
321	C	93.6	Very high	94.5	Very high	16 Å²	16	49.8 Å²	49.8	11%	0.108	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	162.1	169.1	65.5	0	0	0	0	110.4	A328 Q332 L367 V368	C321-A328 HydrophobicContact CB-CB 3.57Å; C321-Q332 PolarHBondContact SG-NE2 3.2Å; C321-L367 CarbonylContact O-C 3.58Å; C321-L367 VanDerWaalsContact O-CA 3.26Å; C321-L367 WeakPolarHBondContact O-CA 3.47Å; C321-V368 PolarHBondContact N-O 3.2Å; C321-V368 PolarHBondContact O-N 3.4Å
322	K	92.9	Very high	94.5	Very high	119 Å²	119	51.6 Å²	51.6	52%	0.517	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	147.9	176.1	-62.9	-177.9	179.3	177.5	0	110.5	N324 D325	K322-N324 WeakPolarHBondContact CB-OD1 3.47Å; K322-N324 PolarHBondContact O-N 3.15Å; K322-N324 VanDerWaalsContact O-N 3.12Å; K322-D325 HydrophobicContact CB-CB 4.42Å; K322-D325 WeakPolarHBondContact O-CB 3.48Å; K322-D325 PolarHBondContact O-N 3.26Å
323	V	93.4	Very high	94.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.1	-178.6	70.9	0	0	0	0	114.1	I329 I339 L343 P363 V366 V368 I490 L494	V323-I329 WeakPolarHBondContact O-CD1 3.36Å; V323-I339 HydrophobicContact CG2-CG2 3.77Å; V323-L343 HydrophobicContact CG2-CD1 4.42Å; V323-P363 HydrophobicContact CG1-CB 4Å; V323-V366 HydrophobicContact CB-CB 4.02Å; V323-V366 HydrophobicContact CB-CG1 3.95Å; V323-V366 HydrophobicContact CG1-CB 3.95Å; V323-V366 HydrophobicContact CG1-CG1 4.37Å; V323-V366 HydrophobicContact CG2-CG1 4.16Å; V323-V366 PolarHBondContact N-O 3.06Å; V323-V368 HydrophobicContact CB-CG2 4.1Å; V323-V368 HydrophobicContact CG2-CG2 4.01Å; V323-I490 HydrophobicContact CB-CG2 4.45Å; V323-I490 HydrophobicContact CG1-CD1 4.06Å; V323-I490 HydrophobicContact CG1-CG1 4.15Å; V323-I490 HydrophobicContact CG1-CG2 3.82Å; V323-I490 HydrophobicContact CG2-CG2 3.79Å; V323-L494 WeakPolarHBondContact O-CD2 3.32Å
324	N	89.6	Confident	94.4	Very high	69 Å²	69	54.4 Å²	54.4	37%	0.369	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	0.6	177.3	64.9	-20.2	0	0	0	113.9	K322 V326 P363 A493	K322-N324 WeakPolarHBondContact CB-OD1 3.47Å; K322-N324 PolarHBondContact O-N 3.15Å; K322-N324 VanDerWaalsContact O-N 3.12Å; N324-V326 PolarHBondContact O-N 3.4Å; N324-V326 VanDerWaalsContact O-N 3.16Å; N324-P363 HydrophobicContact CB-CB 4.03Å; N324-A493 HydrophobicContact CB-CB 4.24Å
325	D	92.8	Very high	94.2	Very high	67 Å²	67	57.3 Å²	57.3	36%	0.358	34%	0.335	S	S	.	.			trans	-86.8	81.3	177.8	-169.6	-19.9	0	0	0	110.5	K322 E327 A328 I329	K322-D325 HydrophobicContact CB-CB 4.42Å; K322-D325 WeakPolarHBondContact O-CB 3.48Å; K322-D325 PolarHBondContact O-N 3.26Å; D325-E327 PolarHBondContact O-N 3.44Å; D325-E327 PolarHBondContact OD1-N 3.04Å; D325-A328 HydrophobicContact CB-CB 4.1Å; D325-A328 PolarHBondContact O-N 3.04Å; D325-A328 WeakPolarHBondContact OD1-CB 3.47Å; D325-A328 PolarHBondContact OD1-N 3.23Å; D325-A328 WeakPolarHBondContact OD2-CB 3.42Å; D325-I329 WeakPolarHBondContact O-CB 3.09Å; D325-I329 WeakPolarHBondContact O-CD1 3.49Å; D325-I329 WeakPolarHBondContact O-CG1 3.46Å; D325-I329 PolarHBondContact O-N 3.32Å
326	V	93.5	Very high	94.1	Very high	34 Å²	34	57.4 Å²	57.4	21%	0.206	33%	0.334	C	S	.	.	H	α-helix	trans	-61	-33.8	-176	179	0	0	0	0	112	N324 R330 V336 L494	N324-V326 PolarHBondContact O-N 3.4Å; N324-V326 VanDerWaalsContact O-N 3.16Å; V326-R330 WeakPolarHBondContact O-CB 3.28Å; V326-R330 VanDerWaalsContact O-CG 3.28Å; V326-R330 WeakPolarHBondContact O-CG 3.28Å; V326-R330 PolarHBondContact O-N 2.91Å; V326-V336 HydrophobicContact CG1-CG2 4.26Å; V326-L494 HydrophobicContact CG2-CD2 4.01Å
327	E	94	Very high	93.9	Very high	163 Å²	163	60.9 Å²	60.9	76%	0.762	35%	0.347	S	S	*	.	H	α-helix	trans	-69	-49.2	179.4	-172.8	175.6	178.5	0	0	110.9	D325 I329 R330 S331	D325-E327 PolarHBondContact O-N 3.44Å; D325-E327 PolarHBondContact OD1-N 3.04Å; E327-I329 VanDerWaalsContact C-N 3.28Å; E327-I329 PolarHBondContact O-N 3.2Å; E327-R330 PolarHBondContact O-N 3.45Å; E327-S331 PolarHBondContact O-N 3.31Å
328	A	94.3	Very high	93.8	Very high	21 Å²	21	59.7 Å²	59.7	17%	0.174	34%	0.344	C	S	.	.	H	α-helix	trans	-65.7	-30.2	176.9	0	0	0	0	0	113.2	C321 D325 S331 Q332	C321-A328 HydrophobicContact CB-CB 3.57Å; D325-A328 HydrophobicContact CB-CB 4.1Å; D325-A328 PolarHBondContact O-N 3.04Å; D325-A328 WeakPolarHBondContact OD1-CB 3.47Å; D325-A328 PolarHBondContact OD1-N 3.23Å; D325-A328 WeakPolarHBondContact OD2-CB 3.42Å; A328-S331 WeakPolarHBondContact CA-OG 3.47Å; A328-S331 PolarHBondContact O-OG 3.32Å; A328-Q332 WeakPolarHBondContact O-CG 3.23Å; A328-Q332 PolarHBondContact O-N 3.39Å; A328-Q332 PolarHBondContact O-NE2 3Å; A328-Q332 VanDerWaalsContact O-NE2 3.07Å
329	I	95.1	Very high	93.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-47.2	173	-74.1	164.9	0	0	0	110.4	V323 D325 E327 Q332 L334 V336 I339 V368 L494	V323-I329 WeakPolarHBondContact O-CD1 3.36Å; D325-I329 WeakPolarHBondContact O-CB 3.09Å; D325-I329 WeakPolarHBondContact O-CD1 3.49Å; D325-I329 WeakPolarHBondContact O-CG1 3.46Å; D325-I329 PolarHBondContact O-N 3.32Å; E327-I329 VanDerWaalsContact C-N 3.28Å; E327-I329 PolarHBondContact O-N 3.2Å; I329-Q332 PolarHBondContact O-N 2.94Å; I329-L334 HydrophobicContact CG2-CB 4.01Å; I329-L334 PolarHBondContact O-N 3.3Å; I329-V336 HydrophobicContact CG2-CG2 3.97Å; I329-I339 HydrophobicContact CB-CD1 4.3Å; I329-I339 HydrophobicContact CD1-CD1 3.85Å; I329-I339 HydrophobicContact CG1-CD1 3.94Å; I329-I339 HydrophobicContact CG2-CD1 3.36Å; I329-V368 HydrophobicContact CG1-CG1 4.41Å; I329-L494 HydrophobicContact CD1-CD2 4.05Å
330	R	93.3	Very high	94.1	Very high	177 Å²	177	55.8 Å²	55.8	67%	0.668	31%	0.313	S	S	*	.	H	α-helix	trans	-66.7	-38.7	-179.6	-74.7	175.6	-178.9	179.3	2.4	111.9	V326 E327 Q332 G333	V326-R330 WeakPolarHBondContact O-CB 3.28Å; V326-R330 VanDerWaalsContact O-CG 3.28Å; V326-R330 WeakPolarHBondContact O-CG 3.28Å; V326-R330 PolarHBondContact O-N 2.91Å; E327-R330 PolarHBondContact O-N 3.45Å; R330-Q332 PolarHBondContact O-N 3.05Å; R330-G333 WeakPolarHBondContact O-CA 3.31Å; R330-G333 PolarHBondContact O-N 2.89Å
331	S	94.6	Very high	94.2	Very high	100 Å²	100	56.6 Å²	56.6	70%	0.699	31%	0.306	S	S	*	.	H	α-helix	trans	-64.5	-27	177.6	70.9	0	0	0	0	113	E327 A328 G333	E327-S331 PolarHBondContact O-N 3.31Å; A328-S331 WeakPolarHBondContact CA-OG 3.47Å; A328-S331 PolarHBondContact O-OG 3.32Å; S331-G333 PolarHBondContact O-N 3.41Å
332	Q	93.6	Very high	94.3	Very high	57 Å²	57	56.5 Å²	56.5	27%	0.266	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-4.7	171.3	-71	175.2	67.5	0	0	113.9	C321 A328 I329 R330 L334	C321-Q332 PolarHBondContact SG-NE2 3.2Å; A328-Q332 WeakPolarHBondContact O-CG 3.23Å; A328-Q332 PolarHBondContact O-N 3.39Å; A328-Q332 PolarHBondContact O-NE2 3Å; A328-Q332 VanDerWaalsContact O-NE2 3.07Å; I329-Q332 PolarHBondContact O-N 2.94Å; R330-Q332 PolarHBondContact O-N 3.05Å; Q332-L334 VanDerWaalsContact C-N 3.34Å; Q332-L334 HydrophobicContact CB-CD1 4.12Å; Q332-L334 HydrophobicContact CB-CG 4.05Å
333	G	94.2	Very high	94.5	Very high	63 Å²	63	50.9 Å²	50.9	65%	0.649	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	23.2	-176.2	0	0	0	0	0	113.7	R330 S331	R330-G333 WeakPolarHBondContact O-CA 3.31Å; R330-G333 PolarHBondContact O-N 2.89Å; S331-G333 PolarHBondContact O-N 3.41Å
334	L	96	Very high	94.6	Very high	10 Å²	10	50.9 Å²	50.9	5%	0.052	28%	0.28	C	S	.	.			trans	-92.8	142.2	-178.3	-64.2	176.8	0	0	0	111.4	I329 Q332 I339 V368 K370 A376	I329-L334 HydrophobicContact CG2-CB 4.01Å; I329-L334 PolarHBondContact O-N 3.3Å; Q332-L334 VanDerWaalsContact C-N 3.34Å; Q332-L334 HydrophobicContact CB-CD1 4.12Å; Q332-L334 HydrophobicContact CB-CG 4.05Å; L334-I339 HydrophobicContact CB-CD1 4.35Å; L334-V368 HydrophobicContact CD1-CG1 3.67Å; L334-K370 HydrophobicContact CD2-CB 4.45Å; L334-K370 HydrophobicContact CD2-CG 4.2Å; L334-A376 HydrophobicContact CD1-CB 4.27Å; L334-A376 HydrophobicContact CD2-CB 4.31Å
335	A	94.7	Very high	94.9	Very high	60 Å²	60	50.1 Å²	50.1	50%	0.496	27%	0.273	S	S	.	.			trans	-82.9	122.6	177.6	0	0	0	0	0	111	K337 D338 I339	A335-K337 PolarHBondContact O-N 3.44Å; A335-D338 HydrophobicContact CB-CB 4.16Å; A335-D338 WeakPolarHBondContact O-CB 3.39Å; A335-D338 PolarHBondContact O-N 3.46Å; A335-I339 PolarHBondContact O-N 3.24Å
336	V	95	Very high	95.1	Very high	19 Å²	19	47 Å²	47	12%	0.115	26%	0.256	C	S	.	.	H	α-helix	trans	-57.7	-35.6	177.8	176	0	0	0	0	112.3	V326 I329 I339 A340 L494 P497	V326-V336 HydrophobicContact CG1-CG2 4.26Å; I329-V336 HydrophobicContact CG2-CG2 3.97Å; V336-I339 PolarHBondContact O-N 2.96Å; V336-A340 PolarHBondContact O-N 3.03Å; V336-L494 HydrophobicContact CG1-CB 3.47Å; V336-L494 VanDerWaalsContact CG1-CB 3.47Å; V336-L494 HydrophobicContact CG1-CD1 4.19Å; V336-L494 HydrophobicContact CG1-CD2 3.68Å; V336-L494 HydrophobicContact CG1-CG 3.95Å; V336-L494 WeakPolarHBondContact CG1-O 3.41Å; V336-P497 HydrophobicContact CG1-CG 4.15Å
337	K	94.3	Very high	95.2	Very high	117 Å²	117	45.4 Å²	45.4	51%	0.509	25%	0.247	S	C	.	.	H	α-helix	trans	-61.4	-42.7	174.4	-173	178.6	178.6	179.7	0	112.9	A335 I339 A340 E341 P497 V498	A335-K337 PolarHBondContact O-N 3.44Å; K337-I339 VanDerWaalsContact C-N 3.33Å; K337-I339 PolarHBondContact O-N 2.98Å; K337-A340 PolarHBondContact O-N 2.95Å; K337-E341 VanDerWaalsContact CE-OE1 3.28Å; K337-E341 WeakPolarHBondContact CE-OE1 3.45Å; K337-E341 HydrophobicContact CG-CG 4.49Å; K337-E341 WeakPolarHBondContact O-CB 3.4Å; K337-E341 WeakPolarHBondContact O-CG 3.2Å; K337-E341 PolarHBondContact O-N 3.36Å; K337-P497 HydrophobicContact CB-CB 4.01Å; K337-P497 HydrophobicContact CG-CB 4.29Å; K337-V498 HydrophobicContact CG-CG2 3.82Å
338	D	95.8	Very high	95.3	Very high	42 Å²	42	37.7 Å²	37.7	23%	0.225	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-43.2	179.2	179.7	50.4	0	0	0	110.9	A335 K342 A376	A335-D338 HydrophobicContact CB-CB 4.16Å; A335-D338 WeakPolarHBondContact O-CB 3.39Å; A335-D338 PolarHBondContact O-N 3.46Å; D338-K342 VanDerWaalsContact CG-NZ 3.29Å; D338-K342 WeakPolarHBondContact O-CB 3.36Å; D338-K342 WeakPolarHBondContact O-CD 3.41Å; D338-K342 VanDerWaalsContact O-CG 3.24Å; D338-K342 WeakPolarHBondContact O-CG 3.36Å; D338-K342 PolarHBondContact O-N 3.31Å; D338-K342 WeakPolarHBondContact OD1-CE 3.29Å; D338-K342 IonicContact OD1-NZ 3.39Å; D338-K342 PolarHBondContact OD1-NZ 2.87Å; D338-K342 VanDerWaalsContact OD1-NZ 3.1Å; D338-K342 IonicContact OD2-NZ 3.41Å; D338-K342 PolarHBondContact OD2-NZ 3.48Å; D338-A376 WeakPolarHBondContact OD2-CB 3.38Å; D338-A376 PolarHBondContact OD2-N 2.86Å
339	I	96.4	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-52.5	176.7	-66.5	160.4	0	0	0	110.7	V323 I329 L334 A335 V336 K337 E341 K342 L343 V368 A376 L378 L494	V323-I339 HydrophobicContact CG2-CG2 3.77Å; I329-I339 HydrophobicContact CB-CD1 4.3Å; I329-I339 HydrophobicContact CD1-CD1 3.85Å; I329-I339 HydrophobicContact CG1-CD1 3.94Å; I329-I339 HydrophobicContact CG2-CD1 3.36Å; L334-I339 HydrophobicContact CB-CD1 4.35Å; A335-I339 PolarHBondContact O-N 3.24Å; V336-I339 PolarHBondContact O-N 2.96Å; K337-I339 VanDerWaalsContact C-N 3.33Å; K337-I339 PolarHBondContact O-N 2.98Å; I339-E341 PolarHBondContact O-N 3.43Å; I339-K342 PolarHBondContact O-N 2.99Å; I339-L343 VanDerWaalsContact O-CB 3.28Å; I339-L343 WeakPolarHBondContact O-CB 3.25Å; I339-L343 PolarHBondContact O-N 3.41Å; I339-V368 HydrophobicContact CD1-CG1 3.67Å; I339-V368 HydrophobicContact CD1-CG2 4.31Å; I339-V368 HydrophobicContact CG1-CG1 4.02Å; I339-V368 HydrophobicContact CG1-CG2 4.46Å; I339-V368 HydrophobicContact CG2-CG2 3.99Å; I339-A376 HydrophobicContact CD1-CB 4.25Å; I339-A376 HydrophobicContact CG1-CB 3.44Å; I339-A376 VanDerWaalsContact CG1-CB 3.44Å; I339-L378 HydrophobicContact CG2-CD2 3.94Å; I339-L494 HydrophobicContact CG2-CD1 4Å
340	A	95.3	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.4	-45.2	-179.8	0	0	0	0	0	112.1	V336 K337 K342 L343 I344 L494 P497 V498	V336-A340 PolarHBondContact O-N 3.03Å; K337-A340 PolarHBondContact O-N 2.95Å; A340-K342 PolarHBondContact O-N 3.28Å; A340-L343 PolarHBondContact O-N 3.37Å; A340-I344 WeakPolarHBondContact O-CB 3.45Å; A340-I344 WeakPolarHBondContact O-CD1 3.42Å; A340-I344 VanDerWaalsContact O-CG1 3.25Å; A340-I344 WeakPolarHBondContact O-CG1 3.19Å; A340-I344 PolarHBondContact O-N 2.98Å; A340-L494 HydrophobicContact CB-CD1 3.99Å; A340-P497 HydrophobicContact CB-CG 3.59Å; A340-V498 HydrophobicContact CB-CB 4.38Å; A340-V498 HydrophobicContact CB-CG2 3.84Å
341	E	95.6	Very high	95.5	Very high	55 Å²	55	28.3 Å²	28.3	26%	0.257	17%	0.171	S	C	.	.	H	α-helix	trans	-60.9	-46	177.1	-75.9	-166.2	-161.8	0	0	112.3	K337 I339 K345 V498 L503	K337-E341 VanDerWaalsContact CE-OE1 3.28Å; K337-E341 WeakPolarHBondContact CE-OE1 3.45Å; K337-E341 HydrophobicContact CG-CG 4.49Å; K337-E341 WeakPolarHBondContact O-CB 3.4Å; K337-E341 WeakPolarHBondContact O-CG 3.2Å; K337-E341 PolarHBondContact O-N 3.36Å; I339-E341 PolarHBondContact O-N 3.43Å; E341-K345 VanDerWaalsContact O-CB 3.29Å; E341-K345 WeakPolarHBondContact O-CB 3.26Å; E341-K345 WeakPolarHBondContact O-CD 3.34Å; E341-K345 WeakPolarHBondContact O-CG 3.17Å; E341-K345 PolarHBondContact O-N 2.97Å; E341-K345 IonicContact OE2-NZ 2.79Å; E341-K345 PolarHBondContact OE2-NZ 3.11Å; E341-V498 HydrophobicContact CB-CG2 4.45Å; E341-V498 HydrophobicContact CG-CB 4.41Å; E341-V498 HydrophobicContact CG-CG1 3.94Å; E341-V498 HydrophobicContact CG-CG2 3.47Å; E341-V498 VanDerWaalsContact CG-CG2 3.47Å; E341-L503 HydrophobicContact CB-CD1 4.46Å; E341-L503 HydrophobicContact CG-CD1 4.29Å
342	K	96.8	Very high	95.5	Very high	14 Å²	14	23.6 Å²	23.6	6%	0.061	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-43.3	180	-77.8	171.4	171.8	166.6	0	111.6	Y297 D338 I339 A340 K345 A346 A376 L378	Y297-K342 HydrophobicContact CD1-CD 4.17Å; Y297-K342 HydrophobicContact CD1-CG 4.04Å; Y297-K342 HydrophobicContact CD2-CB 3.64Å; Y297-K342 HydrophobicContact CD2-CD 3.72Å; Y297-K342 HydrophobicContact CD2-CG 3.57Å; Y297-K342 HydrophobicContact CE1-CG 4.05Å; Y297-K342 HydrophobicContact CE2-CB 3.46Å; Y297-K342 VanDerWaalsContact CE2-CB 3.46Å; Y297-K342 HydrophobicContact CE2-CD 4.28Å; Y297-K342 HydrophobicContact CE2-CG 3.6Å; Y297-K342 HydrophobicContact CG-CB 4.38Å; Y297-K342 HydrophobicContact CG-CD 3.65Å; Y297-K342 HydrophobicContact CG-CG 3.8Å; D338-K342 VanDerWaalsContact CG-NZ 3.29Å; D338-K342 WeakPolarHBondContact O-CB 3.36Å; D338-K342 WeakPolarHBondContact O-CD 3.41Å; D338-K342 VanDerWaalsContact O-CG 3.24Å; D338-K342 WeakPolarHBondContact O-CG 3.36Å; D338-K342 PolarHBondContact O-N 3.31Å; D338-K342 WeakPolarHBondContact OD1-CE 3.29Å; D338-K342 IonicContact OD1-NZ 3.39Å; D338-K342 PolarHBondContact OD1-NZ 2.87Å; D338-K342 VanDerWaalsContact OD1-NZ 3.1Å; D338-K342 IonicContact OD2-NZ 3.41Å; D338-K342 PolarHBondContact OD2-NZ 3.48Å; I339-K342 PolarHBondContact O-N 2.99Å; A340-K342 PolarHBondContact O-N 3.28Å; K342-K345 PolarHBondContact O-N 3Å; K342-A346 WeakPolarHBondContact O-CB 3.41Å; K342-A346 PolarHBondContact O-N 3.3Å; K342-A376 PolarHBondContact NZ-O 2.92Å; K342-L378 HydrophobicContact CB-CD1 3.71Å; K342-L378 HydrophobicContact CB-CG 4.32Å
343	L	96.5	Very high	95.4	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-61.3	-53.9	178.6	-171.6	85.8	0	0	0	110.8	V323 I339 A340 K345 A346 F347 V366 L378 I490	V323-L343 HydrophobicContact CG2-CD1 4.42Å; I339-L343 VanDerWaalsContact O-CB 3.28Å; I339-L343 WeakPolarHBondContact O-CB 3.25Å; I339-L343 PolarHBondContact O-N 3.41Å; A340-L343 PolarHBondContact O-N 3.37Å; L343-K345 VanDerWaalsContact C-N 3.31Å; L343-K345 PolarHBondContact O-N 2.82Å; L343-A346 PolarHBondContact O-N 3.38Å; L343-F347 HydrophobicContact CD1-CD2 4.2Å; L343-F347 HydrophobicContact CD1-CE2 3.58Å; L343-F347 HydrophobicContact CG-CD2 3.99Å; L343-F347 HydrophobicContact CG-CE2 3.89Å; L343-F347 VanDerWaalsContact O-CD2 3.29Å; L343-F347 WeakPolarHBondContact O-CD2 3.21Å; L343-F347 PolarHBondContact O-N 3.09Å; L343-F347 VanDerWaalsContact O-N 3.1Å; L343-V366 HydrophobicContact CD1-CG1 3.84Å; L343-V366 HydrophobicContact CD1-CG2 4.28Å; L343-L378 HydrophobicContact CB-CD1 3.94Å; L343-L378 HydrophobicContact CD1-CD1 4.13Å; L343-I490 HydrophobicContact CD2-CB 3.9Å; L343-I490 HydrophobicContact CD2-CD1 4.08Å; L343-I490 HydrophobicContact CD2-CG2 3.44Å; L343-I490 VanDerWaalsContact CD2-CG2 3.44Å
344	I	95.6	Very high	95.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.9	-43	179.9	-66.4	161.4	0	0	0	110.1	A340 A346 A348 V487 V498 R500 L503 M504	A340-I344 WeakPolarHBondContact O-CB 3.45Å; A340-I344 WeakPolarHBondContact O-CD1 3.42Å; A340-I344 VanDerWaalsContact O-CG1 3.25Å; A340-I344 WeakPolarHBondContact O-CG1 3.19Å; A340-I344 PolarHBondContact O-N 2.98Å; I344-A346 VanDerWaalsContact C-N 3.34Å; I344-A346 PolarHBondContact O-N 2.93Å; I344-A348 WeakPolarHBondContact O-CB 3.49Å; I344-A348 PolarHBondContact O-N 3.12Å; I344-V487 HydrophobicContact CG1-CG1 3.83Å; I344-V498 HydrophobicContact CD1-CB 4.23Å; I344-V498 HydrophobicContact CD1-CG1 4Å; I344-R500 HydrophobicContact CD1-CB 3.76Å; I344-R500 HydrophobicContact CG1-CB 4.35Å; I344-R500 HydrophobicContact CG2-CB 4.37Å; I344-L503 HydrophobicContact CB-CD1 4.16Å; I344-L503 HydrophobicContact CD1-CD1 4.41Å; I344-L503 HydrophobicContact CG2-CB 3.76Å; I344-L503 HydrophobicContact CG2-CD1 3.99Å; I344-M504 HydrophobicContact CG2-CG 3.95Å
345	K	96	Very high	95.2	Very high	52 Å²	52	21 Å²	21	23%	0.226	11%	0.108	C	C	.	.	H	α-helix	trans	-61	-41.1	177.6	-76.4	166.4	-169.4	161.6	0	112.1	E341 K342 L343 E349	E341-K345 VanDerWaalsContact O-CB 3.29Å; E341-K345 WeakPolarHBondContact O-CB 3.26Å; E341-K345 WeakPolarHBondContact O-CD 3.34Å; E341-K345 WeakPolarHBondContact O-CG 3.17Å; E341-K345 PolarHBondContact O-N 2.97Å; E341-K345 IonicContact OE2-NZ 2.79Å; E341-K345 PolarHBondContact OE2-NZ 3.11Å; K342-K345 PolarHBondContact O-N 3Å; L343-K345 VanDerWaalsContact C-N 3.31Å; L343-K345 PolarHBondContact O-N 2.82Å; K345-E349 WeakPolarHBondContact O-CB 3.47Å; K345-E349 PolarHBondContact O-N 2.9Å
346	A	96.4	Very high	95.3	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-67.2	-50.2	-179.2	0	0	0	0	0	112.2	I298 K342 L343 I344 E349 Q350	I298-A346 HydrophobicContact CD1-CB 3.81Å; I298-A346 HydrophobicContact CG1-CB 4.24Å; K342-A346 WeakPolarHBondContact O-CB 3.41Å; K342-A346 PolarHBondContact O-N 3.3Å; L343-A346 PolarHBondContact O-N 3.38Å; I344-A346 VanDerWaalsContact C-N 3.34Å; I344-A346 PolarHBondContact O-N 2.93Å; A346-E349 WeakPolarHBondContact O-CB 3.27Å; A346-E349 PolarHBondContact O-N 2.91Å; A346-Q350 PolarHBondContact O-N 3.46Å; A346-Q350 VanDerWaalsContact O-N 3.14Å
347	F	96.2	Very high	95.1	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.009	8%	0.079	C	C	.	.	H	α-helix	trans	-70.8	-33.1	179.1	-69	-63.9	0	0	0	113	L343 E349 Q350 I351 H358 P361 V366 L380 N483 V487	L343-F347 HydrophobicContact CD1-CD2 4.2Å; L343-F347 HydrophobicContact CD1-CE2 3.58Å; L343-F347 HydrophobicContact CG-CD2 3.99Å; L343-F347 HydrophobicContact CG-CE2 3.89Å; L343-F347 VanDerWaalsContact O-CD2 3.29Å; L343-F347 WeakPolarHBondContact O-CD2 3.21Å; L343-F347 PolarHBondContact O-N 3.09Å; L343-F347 VanDerWaalsContact O-N 3.1Å; F347-E349 VanDerWaalsContact C-N 3.32Å; F347-E349 PolarHBondContact O-N 3.31Å; F347-Q350 WeakPolarHBondContact O-CB 3.36Å; F347-Q350 PolarHBondContact O-N 2.86Å; F347-I351 WeakPolarHBondContact O-CG1 3.33Å; F347-I351 PolarHBondContact O-N 2.96Å; F347-H358 HydrophobicContact CD1-CB 4.47Å; F347-H358 HydrophobicContact CE1-CB 4.02Å; F347-H358 AromaticContact CE1-CD2 3.91Å; F347-P361 HydrophobicContact CD1-CB 4.14Å; F347-P361 HydrophobicContact CD1-CG 4.41Å; F347-P361 HydrophobicContact CD2-CB 4.44Å; F347-P361 HydrophobicContact CE1-CB 3.41Å; F347-P361 VanDerWaalsContact CE1-CB 3.41Å; F347-P361 HydrophobicContact CE1-CG 4.14Å; F347-P361 HydrophobicContact CE2-CB 3.73Å; F347-P361 HydrophobicContact CE2-CG 4.48Å; F347-P361 HydrophobicContact CZ-CB 3.17Å; F347-P361 HydrophobicContact CZ-CG 4.18Å; F347-V366 HydrophobicContact CZ-CG2 4.49Å; F347-L380 HydrophobicContact CZ-CD2 4.15Å; F347-N483 WeakPolarHBondContact CD1-ND2 3.39Å; F347-V487 HydrophobicContact CB-CG2 3.87Å; F347-V487 HydrophobicContact CD2-CG2 3.64Å; F347-V487 HydrophobicContact CE2-CG2 4.44Å; F347-V487 HydrophobicContact CG-CG2 3.85Å
348	A	95.5	Very high	95.1	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.008	6%	0.055	C	C	.	.	H	α-helix	trans	-65.4	-35.2	171.6	0	0	0	0	0	112.1	I344 Q350 I351 F352 M504 R507	I344-A348 WeakPolarHBondContact O-CB 3.49Å; I344-A348 PolarHBondContact O-N 3.12Å; A348-Q350 VanDerWaalsContact C-N 3.35Å; A348-I351 PolarHBondContact O-N 3.21Å; A348-F352 HydrophobicContact CB-CD2 4.04Å; A348-F352 HydrophobicContact CB-CE2 4.26Å; A348-F352 WeakPolarHBondContact O-CB 3.25Å; A348-F352 VanDerWaalsContact O-CD2 3.23Å; A348-F352 WeakPolarHBondContact O-CD2 3.31Å; A348-F352 PolarHBondContact O-N 3.04Å; A348-M504 HydrophobicContact CB-CG 3.97Å; A348-R507 HydrophobicContact CB-CB 3.83Å; A348-R507 HydrophobicContact CB-CG 3.76Å
349	E	95.7	Very high	94.4	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.005	5%	0.045	C	C	.	.	I	π-helix	trans	-61.6	-44.9	172.3	-167.5	75.4	-171.6	0	0	110.7	L292 H294 F295 K345 A346 F347 Y353 T354 R507	L292-E349 HydrophobicContact CD2-CB 4.34Å; L292-E349 HydrophobicContact CD2-CG 4.31Å; H294-E349 IonicContact CE1-OE1 3.39Å; H294-E349 IonicContact NE2-OE1 2.86Å; F295-E349 HydrophobicContact CE2-CB 3.77Å; F295-E349 HydrophobicContact CE2-CG 3.86Å; F295-E349 HydrophobicContact CZ-CB 4.2Å; F295-E349 HydrophobicContact CZ-CG 4.19Å; K345-E349 WeakPolarHBondContact O-CB 3.47Å; K345-E349 PolarHBondContact O-N 2.9Å; A346-E349 WeakPolarHBondContact O-CB 3.27Å; A346-E349 PolarHBondContact O-N 2.91Å; F347-E349 VanDerWaalsContact C-N 3.32Å; F347-E349 PolarHBondContact O-N 3.31Å; E349-Y353 HydrophobicContact CG-CD1 4.4Å; E349-Y353 CarbonylContact O-C 3.53Å; E349-Y353 WeakPolarHBondContact O-CA 3.47Å; E349-Y353 VanDerWaalsContact O-CB 3.23Å; E349-Y353 WeakPolarHBondContact O-CB 3.44Å; E349-Y353 PolarHBondContact O-N 3.27Å; E349-Y353 WeakPolarHBondContact OE1-CD1 3.31Å; E349-Y353 WeakPolarHBondContact OE1-CE1 3.39Å; E349-Y353 VanDerWaalsContact OE1-CG 3.23Å; E349-T354 HydrophobicContact CG-CG2 4.36Å; E349-T354 PolarHBondContact O-N 3.44Å; E349-R507 WeakPolarHBondContact OE2-CD 3.25Å; E349-R507 IonicContact OE2-CZ 3.21Å; E349-R507 IonicContact OE2-NE 2.87Å; E349-R507 IonicContact OE2-NH1 3.28Å; E349-R507 PolarHBondContact OE2-NH1 2.92Å
350	Q	95.9	Very high	93.6	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.051	C	C	.	.	I	π-helix	trans	-61.5	-45.6	176.3	-74.6	-175.9	-36.1	0	0	112.8	C288 L292 A346 F347 A348 G355 F356	C288-Q350 PolarHBondContact SG-NE2 3.43Å; L292-Q350 HydrophobicContact CD2-CG 4.33Å; A346-Q350 PolarHBondContact O-N 3.46Å; A346-Q350 VanDerWaalsContact O-N 3.14Å; F347-Q350 WeakPolarHBondContact O-CB 3.36Å; F347-Q350 PolarHBondContact O-N 2.86Å; A348-Q350 VanDerWaalsContact C-N 3.35Å; Q350-G355 CarbonylContact O-C 3.53Å; Q350-G355 WeakPolarHBondContact O-CA 3.43Å; Q350-G355 PolarHBondContact O-N 2.91Å; Q350-F356 VanDerWaalsContact CB-O 3.3Å; Q350-F356 WeakPolarHBondContact CB-O 3.43Å; Q350-F356 WeakPolarHBondContact CG-O 3.47Å; Q350-F356 PolarHBondContact O-N 3.36Å
351	I	95.1	Very high	93	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.051	C	C	.	.	I	π-helix	trans	-68.6	-53.7	-179.2	-67.2	165.8	0	0	0	111.7	F347 A348 I357 R394 L397 V480 N483 I484 M504	F347-I351 WeakPolarHBondContact O-CG1 3.33Å; F347-I351 PolarHBondContact O-N 2.96Å; A348-I351 PolarHBondContact O-N 3.21Å; I351-I357 HydrophobicContact CG1-CG1 4.22Å; I351-I357 HydrophobicContact CG1-CG2 4.36Å; I351-R394 WeakPolarHBondContact O-CD 3.4Å; I351-L397 HydrophobicContact CG2-CD2 3.68Å; I351-V480 HydrophobicContact CD1-CG1 4.44Å; I351-V480 HydrophobicContact CG2-CG1 4.09Å; I351-N483 HydrophobicContact CD1-CB 4.49Å; I351-N483 WeakPolarHBondContact CD1-OD1 3.21Å; I351-I484 HydrophobicContact CD1-CD1 4.45Å; I351-I484 HydrophobicContact CD1-CG1 3.9Å; I351-M504 HydrophobicContact CD1-CE 4.3Å
352	F	95.1	Very high	92.3	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.057	C	C	.	.	I	π-helix	trans	-95.4	-27.4	-166.1	-61.8	-67.9	0	0	0	113.8	A348 L397 C398 W401 M504 R507 A508 G511	A348-F352 HydrophobicContact CB-CD2 4.04Å; A348-F352 HydrophobicContact CB-CE2 4.26Å; A348-F352 WeakPolarHBondContact O-CB 3.25Å; A348-F352 VanDerWaalsContact O-CD2 3.23Å; A348-F352 WeakPolarHBondContact O-CD2 3.31Å; A348-F352 PolarHBondContact O-N 3.04Å; F352-L397 HydrophobicContact CD1-CG 4.41Å; F352-L397 HydrophobicContact CE1-CD2 4.24Å; F352-L397 HydrophobicContact CE1-CG 3.96Å; F352-C398 PolarHBondContact O-SG 2.71Å; F352-W401 HydrophobicContact CE1-CB 4.12Å; F352-W401 HydrophobicContact CE1-CD2 4.21Å; F352-W401 HydrophobicContact CE1-CE3 4.13Å; F352-W401 HydrophobicContact CE1-CG 4.22Å; F352-W401 HydrophobicContact CZ-CB 4.41Å; F352-W401 AromaticContact CZ-CD2 3.67Å; F352-W401 HydrophobicContact CZ-CD2 3.67Å; F352-W401 AromaticContact CZ-CE3 3.65Å; F352-W401 HydrophobicContact CZ-CE3 3.65Å; F352-W401 HydrophobicContact CZ-CG 4.02Å; F352-W401 HydrophobicContact CZ-CZ3 4.19Å; F352-M504 HydrophobicContact CE2-CB 3.77Å; F352-M504 HydrophobicContact CE2-CE 3.72Å; F352-M504 HydrophobicContact CE2-CG 4.22Å; F352-M504 HydrophobicContact CZ-CB 4.33Å; F352-M504 HydrophobicContact CZ-CE 3.97Å; F352-R507 HydrophobicContact CD2-CB 4.14Å; F352-A508 HydrophobicContact CB-CB 4.49Å; F352-A508 HydrophobicContact CD1-CB 3.66Å; F352-A508 HydrophobicContact CD2-CB 4.36Å; F352-A508 HydrophobicContact CE1-CB 3.89Å; F352-A508 HydrophobicContact CG-CB 3.92Å; F352-A508 HydrophobicContact CZ-CB 4.37Å; F352-G511 WeakPolarHBondContact O-CA 3.39Å
353	Y	91.8	Very high	91.6	Very high	53 Å²	53	12.4 Å²	12.4	21%	0.208	6%	0.059	C	C	.	.	I	π-helix	trans	-106.5	-52.6	-171.5	-169.3	-96.1	0	0	0	113.2	E349 R510 R514	E349-Y353 HydrophobicContact CG-CD1 4.4Å; E349-Y353 CarbonylContact O-C 3.53Å; E349-Y353 WeakPolarHBondContact O-CA 3.47Å; E349-Y353 VanDerWaalsContact O-CB 3.23Å; E349-Y353 WeakPolarHBondContact O-CB 3.44Å; E349-Y353 PolarHBondContact O-N 3.27Å; E349-Y353 WeakPolarHBondContact OE1-CD1 3.31Å; E349-Y353 WeakPolarHBondContact OE1-CE1 3.39Å; E349-Y353 VanDerWaalsContact OE1-CG 3.23Å; Y353-R510 HydrophobicContact CD2-CG 4.25Å; Y353-R510 HydrophobicContact CE2-CG 4.21Å; Y353-R514 HydrophobicContact CE2-CB 4.11Å; Y353-R514 VanDerWaalsContact CE2-CD 3.47Å; Y353-R514 HydrophobicContact CE2-CG 4.39Å; Y353-R514 VanDerWaalsContact CZ-CD 3.49Å; Y353-R514 VanDerWaalsContact CZ-NH1 3.33Å
354	T	93	Very high	91	Very high	22 Å²	22	13.7 Å²	13.7	14%	0.135	7%	0.072	C	C	.	.	I	π-helix	trans	-88.9	-34.4	-178.2	79.6	0	0	0	0	112.3	E291 E349 F356 R394	E291-T354 HydrophobicContact CB-CG2 4.2Å; E291-T354 WeakPolarHBondContact OE2-CB 3.45Å; E291-T354 PolarHBondContact OE2-OG1 2.94Å; E349-T354 HydrophobicContact CG-CG2 4.36Å; E349-T354 PolarHBondContact O-N 3.44Å; T354-F356 PolarHBondContact O-N 3.47Å; T354-F356 PolarHBondContact OG1-N 3.48Å; T354-F356 VanDerWaalsContact OG1-N 3.16Å; T354-R394 PolarHBondContact O-NH1 3.15Å
355	G	93.4	Very high	90.7	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.079	C	C	.	.			trans	72.2	6.7	-172.4	0	0	0	0	0	114.3	Q350 F388 L389	Q350-G355 CarbonylContact O-C 3.53Å; Q350-G355 WeakPolarHBondContact O-CA 3.43Å; Q350-G355 PolarHBondContact O-N 2.91Å; G355-F388 WeakPolarHBondContact O-CA 3.18Å; G355-L389 PolarHBondContact O-N 3.43Å
356	F	95.4	Very high	90.7	Very high	1 Å²	1	12.4 Å²	12.4	0%	0.004	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	92.5	172.4	-173.9	-134.5	0	0	0	108.9	N284 R287 C288 E291 Q350 T354 Y386 F388	N284-F356 HydrophobicContact CB-CZ 4.05Å; R287-F356 HydrophobicContact CB-CE1 3.84Å; R287-F356 HydrophobicContact CB-CZ 4.29Å; R287-F356 HydrophobicContact CG-CD1 3.91Å; R287-F356 HydrophobicContact CG-CE1 3.67Å; R287-F356 HydrophobicContact CG-CZ 4.24Å; C288-F356 HydrophobicContact CB-CE1 4.37Å; E291-F356 WeakPolarHBondContact OE2-CB 3.28Å; Q350-F356 VanDerWaalsContact CB-O 3.3Å; Q350-F356 WeakPolarHBondContact CB-O 3.43Å; Q350-F356 WeakPolarHBondContact CG-O 3.47Å; Q350-F356 PolarHBondContact O-N 3.36Å; T354-F356 PolarHBondContact O-N 3.47Å; T354-F356 PolarHBondContact OG1-N 3.48Å; T354-F356 VanDerWaalsContact OG1-N 3.16Å; F356-Y386 AromaticContact CD1-CD1 3.57Å; F356-Y386 HydrophobicContact CD1-CD1 3.57Å; F356-Y386 AromaticContact CD1-CE1 3.7Å; F356-Y386 HydrophobicContact CD1-CE1 3.7Å; F356-Y386 AromaticContact CD2-CD1 3.64Å; F356-Y386 HydrophobicContact CD2-CD1 3.64Å; F356-Y386 HydrophobicContact CD2-CG 4.31Å; F356-Y386 AromaticContact CE1-CD1 3.25Å; F356-Y386 HydrophobicContact CE1-CD1 3.25Å; F356-Y386 AromaticContact CE1-CE1 3.43Å; F356-Y386 HydrophobicContact CE1-CE1 3.43Å; F356-Y386 VanDerWaalsContact CE1-CE1 3.43Å; F356-Y386 HydrophobicContact CE1-CG 4.05Å; F356-Y386 VanDerWaalsContact CE2-CB 3.42Å; F356-Y386 AromaticContact CE2-CD1 3.4Å; F356-Y386 HydrophobicContact CE2-CD1 3.4Å; F356-Y386 HydrophobicContact CE2-CE1 4.4Å; F356-Y386 AromaticContact CE2-CG 3.71Å; F356-Y386 HydrophobicContact CE2-CG 3.71Å; F356-Y386 AromaticContact CG-CD1 3.77Å; F356-Y386 HydrophobicContact CG-CD1 3.77Å; F356-Y386 HydrophobicContact CG-CE1 4.28Å; F356-Y386 AromaticContact CZ-CD1 3.18Å; F356-Y386 HydrophobicContact CZ-CD1 3.18Å; F356-Y386 HydrophobicContact CZ-CD2 4.46Å; F356-Y386 AromaticContact CZ-CE1 3.84Å; F356-Y386 HydrophobicContact CZ-CE1 3.84Å; F356-Y386 AromaticContact CZ-CG 3.54Å; F356-Y386 HydrophobicContact CZ-CG 3.54Å; F356-F388 HydrophobicContact CB-CD1 4.37Å; F356-F388 HydrophobicContact CB-CE1 3.61Å; F356-F388 HydrophobicContact CB-CZ 4.01Å; F356-F388 HydrophobicContact CD2-CD1 4.25Å; F356-F388 HydrophobicContact CD2-CD2 4.26Å; F356-F388 AromaticContact CD2-CE1 3.45Å; F356-F388 HydrophobicContact CD2-CE1 3.45Å; F356-F388 VanDerWaalsContact CD2-CE1 3.45Å; F356-F388 AromaticContact CD2-CE2 3.48Å; F356-F388 HydrophobicContact CD2-CE2 3.48Å; F356-F388 VanDerWaalsContact CD2-CE2 3.48Å; F356-F388 AromaticContact CD2-CZ 2.96Å; F356-F388 HydrophobicContact CD2-CZ 2.96Å; F356-F388 HydrophobicContact CE2-CE1 4.37Å; F356-F388 AromaticContact CE2-CE2 3.64Å; F356-F388 HydrophobicContact CE2-CE2 3.64Å; F356-F388 AromaticContact CE2-CZ 3.45Å; F356-F388 HydrophobicContact CE2-CZ 3.45Å; F356-F388 VanDerWaalsContact CE2-CZ 3.45Å; F356-F388 AromaticContact CG-CE1 3.82Å; F356-F388 HydrophobicContact CG-CE1 3.82Å; F356-F388 AromaticContact CG-CZ 3.66Å; F356-F388 HydrophobicContact CG-CZ 3.66Å; F356-F388 HydrophobicContact CZ-CZ 4.5Å
357	I	92.3	Very high	90.6	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.005	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.3	-164.9	-63.4	144.7	0	0	0	109.7	I351 S359 Y386 Q387 L389 V480 N483	I351-I357 HydrophobicContact CG1-CG1 4.22Å; I351-I357 HydrophobicContact CG1-CG2 4.36Å; I357-S359 PolarHBondContact O-N 3.46Å; I357-S359 PolarHBondContact O-OG 3.19Å; I357-Y386 VanDerWaalsContact O-CA 3.3Å; I357-Y386 WeakPolarHBondContact O-CA 3.22Å; I357-Q387 PolarHBondContact N-O 2.92Å; I357-Q387 PolarHBondContact O-N 3.15Å; I357-L389 HydrophobicContact CD1-CB 3.56Å; I357-L389 HydrophobicContact CD1-CD2 4.33Å; I357-V480 HydrophobicContact CD1-CG2 3.53Å; I357-V480 HydrophobicContact CG1-CG2 4.43Å; I357-N483 HydrophobicContact CG2-CB 4.36Å
358	H	92.6	Very high	90.7	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.009	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	114.4	163.4	-173.7	-2.7	0	0	0	108.7	F347 D360 D382 L385 Y386 N483	F347-H358 HydrophobicContact CD1-CB 4.47Å; F347-H358 HydrophobicContact CE1-CB 4.02Å; F347-H358 AromaticContact CE1-CD2 3.91Å; H358-D360 VanDerWaalsContact CE1-C 3.48Å; H358-D360 PolarHBondContact CE1-O 3.18Å; H358-D360 VanDerWaalsContact CE1-O 3.24Å; H358-D360 PolarHBondContact ND1-N 2.96Å; H358-D382 PolarHBondContact CE1-O 2.96Å; H358-D382 VanDerWaalsContact CE1-O 3.24Å; H358-D382 PolarHBondContact NE2-O 3.36Å; H358-L385 PolarHBondContact ND1-O 3.36Å; H358-Y386 HydrophobicContact CB-CD1 4.34Å; H358-Y386 HydrophobicContact CB-CE1 3.73Å; H358-Y386 HydrophobicContact CB-CE2 3.9Å; H358-Y386 VanDerWaalsContact CB-CZ 3.46Å; H358-Y386 AromaticContact CG-CE2 3.73Å; H358-Y386 AromaticContact CG-CZ 3.7Å; H358-Y386 AromaticContact ND1-CE2 3.83Å; H358-N483 PolarHBondContact O-ND2 3.05Å
359	S	82.8	Confident	90.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.	S	Bend	trans	-90	-3.7	-167.9	-59.9	0	0	0	0	114.1	I357 L385 L479 R482	I357-S359 PolarHBondContact O-N 3.46Å; I357-S359 PolarHBondContact O-OG 3.19Å; S359-L385 PolarHBondContact N-O 2.91Å; S359-L479 WeakPolarHBondContact OG-CB 3.44Å; S359-R482 WeakPolarHBondContact O-CD 3.36Å; S359-R482 WeakPolarHBondContact O-CG 3.38Å; S359-R482 PolarHBondContact O-NE 3.09Å
360	D	79.6	Confident	90.7	Very high	24 Å²	24	22.3 Å²	22.3	13%	0.128	11%	0.11	C	C	.	.			trans	-144.8	64.5	-177.5	-166.2	31.2	0	0	0	113.3	H358 H362 N365 R482	H358-D360 VanDerWaalsContact CE1-C 3.48Å; H358-D360 PolarHBondContact CE1-O 3.18Å; H358-D360 VanDerWaalsContact CE1-O 3.24Å; H358-D360 PolarHBondContact ND1-N 2.96Å; D360-H362 PolarHBondContact O-N 2.97Å; D360-N365 PolarHBondContact O-ND2 3.04Å; D360-R482 IonicContact OD1-CZ 2.9Å; D360-R482 IonicContact OD1-NE 3.81Å; D360-R482 PolarHBondContact OD1-NE 3.25Å; D360-R482 IonicContact OD1-NH2 3.65Å; D360-R482 PolarHBondContact OD1-NH2 3.3Å; D360-R482 IonicContact OD2-CZ 3.5Å; D360-R482 IonicContact OD2-NH2 2.69Å; D360-R482 PolarHBondContact OD2-NH2 3.27Å
361	P	82	Confident	90.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.113	C	C	.	.			trans	-79.2	47.1	-179.6	37.3	-39.3	0	0	0	112.1	F347 T486 V487 I490	F347-P361 HydrophobicContact CD1-CB 4.14Å; F347-P361 HydrophobicContact CD1-CG 4.41Å; F347-P361 HydrophobicContact CD2-CB 4.44Å; F347-P361 HydrophobicContact CE1-CB 3.41Å; F347-P361 VanDerWaalsContact CE1-CB 3.41Å; F347-P361 HydrophobicContact CE1-CG 4.14Å; F347-P361 HydrophobicContact CE2-CB 3.73Å; F347-P361 HydrophobicContact CE2-CG 4.48Å; F347-P361 HydrophobicContact CZ-CB 3.17Å; F347-P361 HydrophobicContact CZ-CG 4.18Å; P361-T486 VanDerWaalsContact C-CG2 3.45Å; P361-T486 HydrophobicContact CG-CG2 3.91Å; P361-T486 WeakPolarHBondContact O-CG2 3.39Å; P361-V487 HydrophobicContact CG-CG2 4.28Å; P361-I490 VanDerWaalsContact O-CD1 3.28Å; P361-I490 WeakPolarHBondContact O-CD1 3.33Å
362	H	81.3	Confident	90.4	Very high	83 Å²	83	28.7 Å²	28.7	38%	0.384	15%	0.152	S	C	.	.			trans	-54.6	148	-177.6	-178.4	-94.1	0	0	0	110.7	D360 G364 N365	D360-H362 PolarHBondContact O-N 2.97Å; H362-G364 PolarHBondContact ND1-N 3.42Å; H362-G364 VanDerWaalsContact ND1-N 3.18Å; H362-G364 PolarHBondContact O-N 3.34Å; H362-N365 WeakPolarHBondContact O-CB 3.29Å; H362-N365 PolarHBondContact O-N 3.09Å
363	P	82.3	Confident	90.2	Very high	17 Å²	17	33.3 Å²	33.3	11%	0.11	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-50.9	-26.6	-179.6	-25.8	25.2	0	0	0	116	V323 N324 N365 I490	V323-P363 HydrophobicContact CG1-CB 4Å; N324-P363 HydrophobicContact CB-CB 4.03Å; P363-N365 VanDerWaalsContact C-N 3.3Å; P363-I490 HydrophobicContact CB-CG1 4.43Å; P363-I490 HydrophobicContact CG-CD1 4.35Å; P363-I490 HydrophobicContact CG-CG1 3.78Å
364	G	83.2	Confident	90.2	Very high	27 Å²	27	32.4 Å²	32.4	28%	0.278	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-69.5	-22.5	174.3	0	0	0	0	0	114.8	H362	H362-G364 PolarHBondContact ND1-N 3.42Å; H362-G364 VanDerWaalsContact ND1-N 3.18Å; H362-G364 PolarHBondContact O-N 3.34Å
365	N	90	Very high	90.3	Very high	25 Å²	25	37.1 Å²	37.1	13%	0.134	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-96.7	4.2	-176.4	-65.8	-9.7	0	0	0	112.6	D360 H362 P363 L381 D382	D360-N365 PolarHBondContact O-ND2 3.04Å; H362-N365 WeakPolarHBondContact O-CB 3.29Å; H362-N365 PolarHBondContact O-N 3.09Å; P363-N365 VanDerWaalsContact C-N 3.3Å; N365-L381 PolarHBondContact O-N 3.28Å; N365-D382 HydrophobicContact CB-CB 4.12Å; N365-D382 WeakPolarHBondContact ND2-CB 3.37Å; N365-D382 PolarHBondContact ND2-OD2 3.42Å; N365-D382 VanDerWaalsContact ND2-OD2 3.12Å; N365-D382 WeakPolarHBondContact OD1-CB 3.38Å
366	V	94.3	Very high	90.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	112.5	177.1	-174.7	0	0	0	0	109.2	V323 L343 F347 L378 V379 L380	V323-V366 HydrophobicContact CB-CB 4.02Å; V323-V366 HydrophobicContact CB-CG1 3.95Å; V323-V366 HydrophobicContact CG1-CB 3.95Å; V323-V366 HydrophobicContact CG1-CG1 4.37Å; V323-V366 HydrophobicContact CG2-CG1 4.16Å; V323-V366 PolarHBondContact N-O 3.06Å; L343-V366 HydrophobicContact CD1-CG1 3.84Å; L343-V366 HydrophobicContact CD1-CG2 4.28Å; F347-V366 HydrophobicContact CZ-CG2 4.49Å; V366-L378 HydrophobicContact CG1-CB 4.45Å; V366-V379 WeakPolarHBondContact CA-O 3.49Å; V366-L380 HydrophobicContact CG1-CD2 4.27Å; V366-L380 HydrophobicContact CG2-CD2 4.12Å
367	L	95.7	Very high	90.6	Very high	23 Å²	23	38.2 Å²	38.2	12%	0.12	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	150.1	171.5	-52.6	178.9	0	0	0	110.9	C318 C321 L378 V379 L381	C318-L367 WeakPolarHBondContact O-CD1 3.35Å; C321-L367 CarbonylContact O-C 3.58Å; C321-L367 VanDerWaalsContact O-CA 3.26Å; C321-L367 WeakPolarHBondContact O-CA 3.47Å; L367-L378 CarbonylContact O-C 3.21Å; L367-L378 WeakPolarHBondContact O-CA 3.47Å; L367-V379 HydrophobicContact CB-CB 4.1Å; L367-V379 HydrophobicContact CB-CG2 4.45Å; L367-V379 PolarHBondContact N-O 3.2Å; L367-V379 PolarHBondContact O-N 3.48Å; L367-L381 HydrophobicContact CD1-CD1 3.73Å; L367-L381 HydrophobicContact CD2-CD1 4.43Å; L367-L381 HydrophobicContact CG-CD1 3.73Å; L367-L381 HydrophobicContact CG-CG 4.46Å
368	V	97.4	Very high	90.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131.7	173.9	179.4	0	0	0	0	108.5	G320 C321 V323 I329 L334 I339 A376 Q377 L378	G320-V368 CarbonylContact C-O 3.47Å; G320-V368 WeakPolarHBondContact CA-O 3.38Å; C321-V368 PolarHBondContact N-O 3.2Å; C321-V368 PolarHBondContact O-N 3.4Å; V323-V368 HydrophobicContact CB-CG2 4.1Å; V323-V368 HydrophobicContact CG2-CG2 4.01Å; I329-V368 HydrophobicContact CG1-CG1 4.41Å; L334-V368 HydrophobicContact CD1-CG1 3.67Å; I339-V368 HydrophobicContact CD1-CG1 3.67Å; I339-V368 HydrophobicContact CD1-CG2 4.31Å; I339-V368 HydrophobicContact CG1-CG1 4.02Å; I339-V368 HydrophobicContact CG1-CG2 4.46Å; I339-V368 HydrophobicContact CG2-CG2 3.99Å; V368-A376 HydrophobicContact CG1-CB 4.28Å; V368-Q377 WeakPolarHBondContact CA-O 3.3Å; V368-L378 HydrophobicContact CG2-CD2 3.99Å
369	R	95.8	Very high	91.1	Very high	74 Å²	74	38.1 Å²	38.1	28%	0.279	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.1	171	72.6	-178.5	-171.3	-167.4	1.5	111	G371 Q377 V379	R369-G371 PolarHBondContact O-N 3.5Å; R369-Q377 HydrophobicContact CG-CB 3.99Å; R369-Q377 PolarHBondContact N-O 2.84Å; R369-Q377 VanDerWaalsContact NH2-OE1 3.16Å; R369-Q377 PolarHBondContact O-N 3.46Å; R369-V379 HydrophobicContact CG-CG2 4.42Å
370	K	95.6	Very high	91.7	Very high	117 Å²	117	38.2 Å²	38.2	51%	0.509	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121.8	172.2	-164.5	167	-171.8	168.2	0	110.4	L334	L334-K370 HydrophobicContact CD2-CB 4.45Å; L334-K370 HydrophobicContact CD2-CG 4.2Å
371	G	93.4	Very high	92.4	Very high	7 Å²	7	39.4 Å²	39.4	7%	0.072	21%	0.214	C	C	.	.			trans	-76	170.5	174.5	0	0	0	0	0	112.8	R369 D373 G374 K375	R369-G371 PolarHBondContact O-N 3.5Å; G371-D373 PolarHBondContact O-N 3.41Å; G371-G374 PolarHBondContact O-N 2.99Å; G371-K375 PolarHBondContact N-O 3.28Å
372	P	91	Very high	92.8	Very high	127 Å²	127	41.4 Å²	41.4	83%	0.825	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23.9	177.7	27.5	-34.6	0	0	0	112.8	G374	P372-G374 PolarHBondContact O-N 3.09Å
373	D	91.8	Very high	93.3	Very high	97 Å²	97	37.8 Å²	37.8	52%	0.519	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	4.1	174.2	68.7	-17.4	0	0	0	113.2	G371 K375	G371-D373 PolarHBondContact O-N 3.41Å; D373-K375 PolarHBondContact O-N 3.17Å; D373-K375 WeakPolarHBondContact OD1-CB 3.31Å; D373-K375 PolarHBondContact OD1-N 3.21Å
374	G	91.9	Very high	93.6	Very high	34 Å²	34	37 Å²	37	35%	0.351	20%	0.203	S	C	.	.	S	Bend	trans	74.9	0.2	-176.4	0	0	0	0	0	114.6	G371 P372	G371-G374 PolarHBondContact O-N 2.99Å; P372-G374 PolarHBondContact O-N 3.09Å
375	K	95	Very high	93.8	Very high	121 Å²	121	36 Å²	36	53%	0.526	19%	0.191	S	C	.	.	S	Bend	trans	-98.4	175.6	179.5	-58.8	-176.8	-179.7	174	0	111.2	G371 D373 Q377	G371-K375 PolarHBondContact N-O 3.28Å; D373-K375 PolarHBondContact O-N 3.17Å; D373-K375 WeakPolarHBondContact OD1-CB 3.31Å; D373-K375 PolarHBondContact OD1-N 3.21Å; K375-Q377 PolarHBondContact O-N 3.19Å
376	A	96.4	Very high	93.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	132.4	-179.4	0	0	0	0	0	111.7	L334 D338 I339 K342 V368	L334-A376 HydrophobicContact CD1-CB 4.27Å; L334-A376 HydrophobicContact CD2-CB 4.31Å; D338-A376 WeakPolarHBondContact OD2-CB 3.38Å; D338-A376 PolarHBondContact OD2-N 2.86Å; I339-A376 HydrophobicContact CD1-CB 4.25Å; I339-A376 HydrophobicContact CG1-CB 3.44Å; I339-A376 VanDerWaalsContact CG1-CB 3.44Å; K342-A376 PolarHBondContact NZ-O 2.92Å; V368-A376 HydrophobicContact CG1-CB 4.28Å
377	Q	97.4	Very high	93.6	Very high	24 Å²	24	37.8 Å²	37.8	11%	0.112	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	139.5	159.5	-76.8	-173.1	-24.1	0	0	109.1	Y297 V299 V368 R369 K375	Y297-Q377 CarbonylContact O-C 3.47Å; Y297-Q377 WeakPolarHBondContact O-CA 3.17Å; V299-Q377 HydrophobicContact CG2-CB 4.36Å; V368-Q377 WeakPolarHBondContact CA-O 3.3Å; R369-Q377 HydrophobicContact CG-CB 3.99Å; R369-Q377 PolarHBondContact N-O 2.84Å; R369-Q377 VanDerWaalsContact NH2-OE1 3.16Å; R369-Q377 PolarHBondContact O-N 3.46Å; K375-Q377 PolarHBondContact O-N 3.19Å
378	L	97.8	Very high	93.4	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121.3	173.5	-49.3	-179.4	0	0	0	108.1	Y297 I298 V299 I339 K342 L343 V366 L367 V368	Y297-L378 PolarHBondContact O-N 2.91Å; I298-L378 WeakPolarHBondContact CA-O 3.46Å; I298-L378 HydrophobicContact CD1-CB 3.91Å; I298-L378 HydrophobicContact CD1-CD1 4.01Å; I298-L378 HydrophobicContact CD1-CG 4.34Å; V299-L378 PolarHBondContact N-O 3.29Å; I339-L378 HydrophobicContact CG2-CD2 3.94Å; K342-L378 HydrophobicContact CB-CD1 3.71Å; K342-L378 HydrophobicContact CB-CG 4.32Å; L343-L378 HydrophobicContact CB-CD1 3.94Å; L343-L378 HydrophobicContact CD1-CD1 4.13Å; V366-L378 HydrophobicContact CG1-CB 4.45Å; L367-L378 CarbonylContact O-C 3.21Å; L367-L378 WeakPolarHBondContact O-CA 3.47Å; V368-L378 HydrophobicContact CG2-CD2 3.99Å
379	V	97.6	Very high	93.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.3	171.4	-170.1	0	0	0	0	107.6	V299 P301 C318 V366 L367 R369 L381	V299-V379 HydrophobicContact CB-CG2 4.2Å; V299-V379 HydrophobicContact CG1-CG1 4.43Å; V299-V379 HydrophobicContact CG1-CG2 4.49Å; V299-V379 CarbonylContact O-C 3.59Å; V299-V379 VanDerWaalsContact O-CA 3.27Å; V299-V379 WeakPolarHBondContact O-CA 3.1Å; P301-V379 HydrophobicContact CG-CG1 4.12Å; C318-V379 HydrophobicContact CB-CB 4.49Å; C318-V379 HydrophobicContact CB-CG1 3.69Å; C318-V379 HydrophobicContact CB-CG2 4.23Å; V366-V379 WeakPolarHBondContact CA-O 3.49Å; L367-V379 HydrophobicContact CB-CB 4.1Å; L367-V379 HydrophobicContact CB-CG2 4.45Å; L367-V379 PolarHBondContact N-O 3.2Å; L367-V379 PolarHBondContact O-N 3.48Å; R369-V379 HydrophobicContact CG-CG2 4.42Å; V379-L381 HydrophobicContact CG1-CD2 3.82Å; V379-L381 HydrophobicContact CG1-CG 4.46Å
380	L	97	Very high	93	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.5	174.5	-53.2	-177.2	0	0	0	108.3	L292 I298 V299 V300 P301 F347 V366 H383	L292-L380 HydrophobicContact CD1-CD1 3.86Å; I298-L380 HydrophobicContact CG2-CD1 3.83Å; I298-L380 HydrophobicContact CG2-CG 4.12Å; V299-L380 PolarHBondContact O-N 3.17Å; V300-L380 HydrophobicContact CG2-CB 4.41Å; P301-L380 VanDerWaalsContact CD-O 3.24Å; P301-L380 WeakPolarHBondContact CD-O 3.13Å; F347-L380 HydrophobicContact CZ-CD2 4.15Å; V366-L380 HydrophobicContact CG1-CD2 4.27Å; V366-L380 HydrophobicContact CG2-CD2 4.12Å; L380-H383 PolarHBondContact O-NE2 3.5Å
381	L	93.2	Very high	92.9	Very high	49 Å²	49	42.9 Å²	42.9	26%	0.257	23%	0.225	S	C	.	.			trans	-118	171.1	178	-55.5	-179.1	0	0	0	109.3	P301 N365 L367 V379	P301-L381 HydrophobicContact CG-CD2 3.66Å; N365-L381 PolarHBondContact O-N 3.28Å; L367-L381 HydrophobicContact CD1-CD1 3.73Å; L367-L381 HydrophobicContact CD2-CD1 4.43Å; L367-L381 HydrophobicContact CG-CD1 3.73Å; L367-L381 HydrophobicContact CG-CG 4.46Å; V379-L381 HydrophobicContact CG1-CD2 3.82Å; V379-L381 HydrophobicContact CG1-CG 4.46Å
382	D	89.8	Confident	92.8	Very high	42 Å²	42	49 Å²	49	23%	0.225	25%	0.25	C	C	.	.			trans	52.9	86.6	174.9	-168.6	0.9	0	0	0	113.5	K228 H358 N365 G384	K228-D382 IonicContact NZ-OD1 3.98Å; H358-D382 PolarHBondContact CE1-O 2.96Å; H358-D382 VanDerWaalsContact CE1-O 3.24Å; H358-D382 PolarHBondContact NE2-O 3.36Å; N365-D382 HydrophobicContact CB-CB 4.12Å; N365-D382 WeakPolarHBondContact ND2-CB 3.37Å; N365-D382 PolarHBondContact ND2-OD2 3.42Å; N365-D382 VanDerWaalsContact ND2-OD2 3.12Å; N365-D382 WeakPolarHBondContact OD1-CB 3.38Å; D382-G384 VanDerWaalsContact C-N 3.31Å; D382-G384 PolarHBondContact OD1-N 3.16Å
383	H	93.5	Very high	93	Very high	7 Å²	7	43.5 Å²	43.5	3%	0.032	21%	0.213	C	C	.	.			trans	-97.9	22.3	-178.1	-65	-99.8	0	0	0	112.8	E281 N284 A285 L380 L385 Y386	E281-H383 HydrophobicContact CG-CB 4.04Å; E281-H383 WeakPolarHBondContact O-CB 3.4Å; E281-H383 PolarHBondContact OE1-N 3.28Å; N284-H383 HydrophobicContact CB-CB 3.93Å; N284-H383 VanDerWaalsContact CB-O 3.32Å; N284-H383 WeakPolarHBondContact CB-O 3.37Å; N284-H383 PolarHBondContact ND2-O 2.9Å; A285-H383 HydrophobicContact CB-CB 3.99Å; L380-H383 PolarHBondContact O-NE2 3.5Å; H383-L385 VanDerWaalsContact C-N 3.33Å; H383-L385 PolarHBondContact O-N 2.77Å; H383-Y386 HydrophobicContact CB-CD2 4.4Å; H383-Y386 HydrophobicContact CB-CE2 3.82Å; H383-Y386 PolarHBondContact CE1-OH 3.2Å; H383-Y386 AromaticContact ND1-CE2 3.53Å; H383-Y386 AromaticContact ND1-CZ 3.51Å; H383-Y386 PolarHBondContact ND1-OH 3.02Å; H383-Y386 WeakPolarHBondContact O-CD2 3.5Å
384	G	88	Confident	93.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	-66.6	-31.3	-173	0	0	0	0	0	113.8	D382	D382-G384 VanDerWaalsContact C-N 3.31Å; D382-G384 PolarHBondContact OD1-N 3.16Å
385	L	86.9	Confident	93.2	Very high	5 Å²	5	39 Å²	39	3%	0.026	18%	0.184	C	C	.	.			trans	-122.3	101.1	-175.3	-165.7	63.8	0	0	0	113.3	T271 H358 S359 H383 L479	T271-L385 HydrophobicContact CG2-CD1 3.33Å; T271-L385 HydrophobicContact CG2-CD2 3.7Å; T271-L385 HydrophobicContact CG2-CG 4.11Å; H358-L385 PolarHBondContact ND1-O 3.36Å; S359-L385 PolarHBondContact N-O 2.91Å; H383-L385 VanDerWaalsContact C-N 3.33Å; H383-L385 PolarHBondContact O-N 2.77Å; L385-L479 HydrophobicContact CD2-CD2 4.28Å
386	Y	91.2	Very high	93.2	Very high	8 Å²	8	33.7 Å²	33.7	3%	0.031	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	148.3	174.2	-84.2	-107.3	0	0	0	111.3	N284 C288 F356 I357 H358 H383	N284-Y386 HydrophobicContact CB-CD2 3.96Å; N284-Y386 HydrophobicContact CB-CE2 4.4Å; N284-Y386 HydrophobicContact CB-CG 4.3Å; C288-Y386 HydrophobicContact CB-CE1 4.29Å; C288-Y386 PolarHBondContact SG-OH 3.46Å; F356-Y386 AromaticContact CD1-CD1 3.57Å; F356-Y386 HydrophobicContact CD1-CD1 3.57Å; F356-Y386 AromaticContact CD1-CE1 3.7Å; F356-Y386 HydrophobicContact CD1-CE1 3.7Å; F356-Y386 AromaticContact CD2-CD1 3.64Å; F356-Y386 HydrophobicContact CD2-CD1 3.64Å; F356-Y386 HydrophobicContact CD2-CG 4.31Å; F356-Y386 AromaticContact CE1-CD1 3.25Å; F356-Y386 HydrophobicContact CE1-CD1 3.25Å; F356-Y386 AromaticContact CE1-CE1 3.43Å; F356-Y386 HydrophobicContact CE1-CE1 3.43Å; F356-Y386 VanDerWaalsContact CE1-CE1 3.43Å; F356-Y386 HydrophobicContact CE1-CG 4.05Å; F356-Y386 VanDerWaalsContact CE2-CB 3.42Å; F356-Y386 AromaticContact CE2-CD1 3.4Å; F356-Y386 HydrophobicContact CE2-CD1 3.4Å; F356-Y386 HydrophobicContact CE2-CE1 4.4Å; F356-Y386 AromaticContact CE2-CG 3.71Å; F356-Y386 HydrophobicContact CE2-CG 3.71Å; F356-Y386 AromaticContact CG-CD1 3.77Å; F356-Y386 HydrophobicContact CG-CD1 3.77Å; F356-Y386 HydrophobicContact CG-CE1 4.28Å; F356-Y386 AromaticContact CZ-CD1 3.18Å; F356-Y386 HydrophobicContact CZ-CD1 3.18Å; F356-Y386 HydrophobicContact CZ-CD2 4.46Å; F356-Y386 AromaticContact CZ-CE1 3.84Å; F356-Y386 HydrophobicContact CZ-CE1 3.84Å; F356-Y386 AromaticContact CZ-CG 3.54Å; F356-Y386 HydrophobicContact CZ-CG 3.54Å; I357-Y386 VanDerWaalsContact O-CA 3.3Å; I357-Y386 WeakPolarHBondContact O-CA 3.22Å; H358-Y386 HydrophobicContact CB-CD1 4.34Å; H358-Y386 HydrophobicContact CB-CE1 3.73Å; H358-Y386 HydrophobicContact CB-CE2 3.9Å; H358-Y386 VanDerWaalsContact CB-CZ 3.46Å; H358-Y386 AromaticContact CG-CE2 3.73Å; H358-Y386 AromaticContact CG-CZ 3.7Å; H358-Y386 AromaticContact ND1-CE2 3.83Å; H383-Y386 HydrophobicContact CB-CD2 4.4Å; H383-Y386 HydrophobicContact CB-CE2 3.82Å; H383-Y386 PolarHBondContact CE1-OH 3.2Å; H383-Y386 AromaticContact ND1-CE2 3.53Å; H383-Y386 AromaticContact ND1-CZ 3.51Å; H383-Y386 PolarHBondContact ND1-OH 3.02Å; H383-Y386 WeakPolarHBondContact O-CD2 3.5Å
387	Q	89	Confident	93.2	Very high	56 Å²	56	33.7 Å²	33.7	26%	0.262	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	155.9	173.5	-73.8	-69.7	8.3	0	0	112	I357 P476 L479	I357-Q387 PolarHBondContact N-O 2.92Å; I357-Q387 PolarHBondContact O-N 3.15Å; Q387-P476 HydrophobicContact CB-CB 4.46Å; Q387-L479 HydrophobicContact CB-CD1 4.46Å; Q387-L479 HydrophobicContact CG-CD1 3.36Å
388	F	92.1	Very high	93.1	Very high	91 Å²	91	32.5 Å²	32.5	40%	0.399	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.1	169.6	-77	-75.8	0	0	0	111.4	R287 G355 F356 P476	R287-F388 VanDerWaalsContact NH2-CZ 3.34Å; G355-F388 WeakPolarHBondContact O-CA 3.18Å; F356-F388 HydrophobicContact CB-CD1 4.37Å; F356-F388 HydrophobicContact CB-CE1 3.61Å; F356-F388 HydrophobicContact CB-CZ 4.01Å; F356-F388 HydrophobicContact CD2-CD1 4.25Å; F356-F388 HydrophobicContact CD2-CD2 4.26Å; F356-F388 AromaticContact CD2-CE1 3.45Å; F356-F388 HydrophobicContact CD2-CE1 3.45Å; F356-F388 VanDerWaalsContact CD2-CE1 3.45Å; F356-F388 AromaticContact CD2-CE2 3.48Å; F356-F388 HydrophobicContact CD2-CE2 3.48Å; F356-F388 VanDerWaalsContact CD2-CE2 3.48Å; F356-F388 AromaticContact CD2-CZ 2.96Å; F356-F388 HydrophobicContact CD2-CZ 2.96Å; F356-F388 HydrophobicContact CE2-CE1 4.37Å; F356-F388 AromaticContact CE2-CE2 3.64Å; F356-F388 HydrophobicContact CE2-CE2 3.64Å; F356-F388 AromaticContact CE2-CZ 3.45Å; F356-F388 HydrophobicContact CE2-CZ 3.45Å; F356-F388 VanDerWaalsContact CE2-CZ 3.45Å; F356-F388 AromaticContact CG-CE1 3.82Å; F356-F388 HydrophobicContact CG-CE1 3.82Å; F356-F388 AromaticContact CG-CZ 3.66Å; F356-F388 HydrophobicContact CG-CZ 3.66Å; F356-F388 HydrophobicContact CZ-CZ 4.5Å; F388-P476 WeakPolarHBondContact O-CG 3.49Å
389	L	92.7	Very high	92.9	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.016	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-92.3	119.8	164.6	-171.4	65.6	0	0	0	109.1	G355 I357 D393 R394 L397 P476 M477	G355-L389 PolarHBondContact O-N 3.43Å; I357-L389 HydrophobicContact CD1-CB 3.56Å; I357-L389 HydrophobicContact CD1-CD2 4.33Å; L389-D393 HydrophobicContact CD1-CB 3.63Å; L389-D393 HydrophobicContact CG-CB 4.1Å; L389-R394 HydrophobicContact CD2-CB 3.8Å; L389-R394 HydrophobicContact CD2-CG 4.2Å; L389-R394 HydrophobicContact CG-CB 3.99Å; L389-R394 PolarHBondContact O-NH1 3.35Å; L389-L397 HydrophobicContact CD2-CD2 3.86Å; L389-P476 HydrophobicContact CD1-CB 4.16Å; L389-M477 HydrophobicContact CD1-CG 4.23Å; L389-M477 HydrophobicContact CD1-SD 3.85Å; L389-M477 HydrophobicContact CD2-SD 4.16Å
390	E	92.4	Very high	92.8	Very high	107 Å²	107	33.2 Å²	33.2	50%	0.5	16%	0.16	S	C	.	.	P	Polyproline II helix	trans	-55.4	148.7	177.7	-67	-171.7	176.6	0	0	111.2	K392 D393 R394	E390-K392 HydrophobicContact CB-CG 4.36Å; E390-K392 PolarHBondContact O-N 3.42Å; E390-K392 VanDerWaalsContact O-N 3.16Å; E390-K392 WeakPolarHBondContact OE2-CE 3.42Å; E390-K392 IonicContact OE2-NZ 2.9Å; E390-K392 PolarHBondContact OE2-NZ 3Å; E390-D393 PolarHBondContact O-N 3.45Å; E390-D393 VanDerWaalsContact O-N 3.14Å; E390-R394 WeakPolarHBondContact O-CB 3.3Å; E390-R394 PolarHBondContact O-N 2.85Å
391	E	92.1	Very high	92.6	Very high	120 Å²	120	33.1 Å²	33.1	56%	0.561	16%	0.16	S	C	*	.	H	α-helix	trans	-59.1	-33.5	-176.1	-58.5	-156.3	140.1	0	0	112.9	R394 A395 L515	E391-R394 IonicContact OE1-NH2 2.71Å; E391-R394 PolarHBondContact OE1-NH2 3.49Å; E391-A395 VanDerWaalsContact O-CB 3.24Å; E391-A395 WeakPolarHBondContact O-CB 3.33Å; E391-A395 PolarHBondContact O-N 2.87Å; E391-L515 HydrophobicContact CB-CD2 4.02Å; E391-L515 HydrophobicContact CG-CD2 4.14Å
392	K	92.4	Very high	92.4	Very high	136 Å²	136	34 Å²	34	59%	0.591	16%	0.159	S	C	*	.	H	α-helix	trans	-63.7	-48.7	177.6	82.4	-171.3	-169.6	-144.2	0	111.3	E390 A395 A396	E390-K392 HydrophobicContact CB-CG 4.36Å; E390-K392 PolarHBondContact O-N 3.42Å; E390-K392 VanDerWaalsContact O-N 3.16Å; E390-K392 WeakPolarHBondContact OE2-CE 3.42Å; E390-K392 IonicContact OE2-NZ 2.9Å; E390-K392 PolarHBondContact OE2-NZ 3Å; K392-A395 PolarHBondContact O-N 2.86Å; K392-A396 PolarHBondContact O-N 2.75Å
393	D	94.6	Very high	92.5	Very high	10 Å²	10	32 Å²	32	5%	0.053	15%	0.149	C	C	.	.	H	α-helix	trans	-72.9	-38.6	-176.9	-62.3	-25.8	0	0	0	109.3	L389 E390 A395 A396 L397 L419	L389-D393 HydrophobicContact CD1-CB 3.63Å; L389-D393 HydrophobicContact CG-CB 4.1Å; E390-D393 PolarHBondContact O-N 3.45Å; E390-D393 VanDerWaalsContact O-N 3.14Å; D393-A395 PolarHBondContact O-N 2.98Å; D393-A396 PolarHBondContact O-N 2.47Å; D393-L397 VanDerWaalsContact O-CB 3.31Å; D393-L397 WeakPolarHBondContact O-CB 3.44Å; D393-L397 PolarHBondContact O-N 3.48Å; D393-L419 HydrophobicContact CB-CD2 3.83Å
394	R	94.9	Very high	92.3	Very high	13 Å²	13	31.7 Å²	31.7	5%	0.049	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-42	173.8	-170.4	170.6	67.9	-139.5	8.1	112.1	I351 T354 L389 E390 E391 L397 C398 L515	I351-R394 WeakPolarHBondContact O-CD 3.4Å; T354-R394 PolarHBondContact O-NH1 3.15Å; L389-R394 HydrophobicContact CD2-CB 3.8Å; L389-R394 HydrophobicContact CD2-CG 4.2Å; L389-R394 HydrophobicContact CG-CB 3.99Å; L389-R394 PolarHBondContact O-NH1 3.35Å; E390-R394 WeakPolarHBondContact O-CB 3.3Å; E390-R394 PolarHBondContact O-N 2.85Å; E391-R394 IonicContact OE1-NH2 2.71Å; E391-R394 PolarHBondContact OE1-NH2 3.49Å; R394-L397 PolarHBondContact O-N 3.45Å; R394-C398 WeakPolarHBondContact O-CB 3.28Å; R394-C398 PolarHBondContact O-N 2.85Å; R394-C398 PolarHBondContact O-SG 2.92Å; R394-L515 HydrophobicContact CB-CD1 4.42Å; R394-L515 HydrophobicContact CG-CD1 4.3Å; R394-L515 VanDerWaalsContact NH2-CD2 3.26Å
395	A	93.6	Very high	92.1	Very high	25 Å²	25	32 Å²	32	21%	0.207	15%	0.149	C	C	.	.	H	α-helix	trans	-63.7	-44.3	175.8	0	0	0	0	0	111.6	E391 K392 D393 C398 Q399 L515	E391-A395 VanDerWaalsContact O-CB 3.24Å; E391-A395 WeakPolarHBondContact O-CB 3.33Å; E391-A395 PolarHBondContact O-N 2.87Å; K392-A395 PolarHBondContact O-N 2.86Å; D393-A395 PolarHBondContact O-N 2.98Å; A395-C398 PolarHBondContact O-N 3.31Å; A395-Q399 PolarHBondContact O-N 3.4Å; A395-Q399 VanDerWaalsContact O-N 3.09Å; A395-L515 HydrophobicContact CB-CD1 3.86Å
396	A	95.4	Very high	91.9	Very high	8 Å²	8	32.7 Å²	32.7	7%	0.066	15%	0.153	C	C	.	.	H	α-helix	trans	-61.5	-45.4	175.5	0	0	0	0	0	111.4	K392 D393 C398 Q399 L400 A418 L419	K392-A396 PolarHBondContact O-N 2.75Å; D393-A396 PolarHBondContact O-N 2.47Å; A396-C398 PolarHBondContact O-N 3.46Å; A396-Q399 PolarHBondContact O-N 3.35Å; A396-L400 WeakPolarHBondContact O-CB 3.19Å; A396-L400 PolarHBondContact O-N 2.93Å; A396-A418 HydrophobicContact CB-CB 3.84Å; A396-L419 HydrophobicContact CB-CD1 4.39Å; A396-L419 HydrophobicContact CB-CD2 4.13Å; A396-L419 HydrophobicContact CB-CG 3.87Å
397	L	96.1	Very high	91.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.3	-43.6	176.5	178.8	60.4	0	0	0	112.3	I351 F352 L389 D393 R394 Q399 L400 W401 L419 L431 M477 V480	I351-L397 HydrophobicContact CG2-CD2 3.68Å; F352-L397 HydrophobicContact CD1-CG 4.41Å; F352-L397 HydrophobicContact CE1-CD2 4.24Å; F352-L397 HydrophobicContact CE1-CG 3.96Å; L389-L397 HydrophobicContact CD2-CD2 3.86Å; D393-L397 VanDerWaalsContact O-CB 3.31Å; D393-L397 WeakPolarHBondContact O-CB 3.44Å; D393-L397 PolarHBondContact O-N 3.48Å; R394-L397 PolarHBondContact O-N 3.45Å; L397-Q399 VanDerWaalsContact C-N 3.32Å; L397-Q399 PolarHBondContact O-N 3.33Å; L397-L400 PolarHBondContact O-N 3.48Å; L397-W401 WeakPolarHBondContact O-CB 3.18Å; L397-W401 PolarHBondContact O-N 3.24Å; L397-L419 HydrophobicContact CB-CD1 4.37Å; L397-L431 HydrophobicContact CD1-CD1 4.21Å; L397-L431 HydrophobicContact CD1-CD2 3.83Å; L397-M477 HydrophobicContact CD1-CE 3.85Å; L397-M477 HydrophobicContact CD2-CE 4.04Å; L397-M477 HydrophobicContact CD2-SD 3.99Å; L397-M477 HydrophobicContact CG-CE 4.45Å; L397-V480 HydrophobicContact CD2-CG1 4.06Å
398	C	94.8	Very high	91.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-43.8	177.3	-70.7	0	0	0	0	111.8	F352 R394 A395 A396 R402 A508 W512	F352-C398 PolarHBondContact O-SG 2.71Å; R394-C398 WeakPolarHBondContact O-CB 3.28Å; R394-C398 PolarHBondContact O-N 2.85Å; R394-C398 PolarHBondContact O-SG 2.92Å; A395-C398 PolarHBondContact O-N 3.31Å; A396-C398 PolarHBondContact O-N 3.46Å; C398-R402 PolarHBondContact O-N 3.33Å; C398-R402 VanDerWaalsContact O-N 3.12Å; C398-A508 HydrophobicContact CB-CB 4.23Å; C398-A508 WeakPolarHBondContact CB-O 3.42Å; C398-A508 PolarHBondContact SG-O 3.11Å; C398-W512 HydrophobicContact CB-CB 3.76Å
399	Q	93.3	Very high	91.3	Very high	16 Å²	16	37.3 Å²	37.3	8%	0.075	18%	0.176	C	C	.	.	H	α-helix	trans	-72	-38.6	178.8	-77.1	-62.8	-38.5	0	0	112.8	A395 A396 L397 R402 A403 H415 W512	A395-Q399 PolarHBondContact O-N 3.4Å; A395-Q399 VanDerWaalsContact O-N 3.09Å; A396-Q399 PolarHBondContact O-N 3.35Å; L397-Q399 VanDerWaalsContact C-N 3.32Å; L397-Q399 PolarHBondContact O-N 3.33Å; Q399-R402 PolarHBondContact O-N 3.44Å; Q399-A403 VanDerWaalsContact O-CB 3.31Å; Q399-A403 WeakPolarHBondContact O-CB 3.13Å; Q399-A403 PolarHBondContact O-N 3.27Å; Q399-H415 HydrophobicContact CB-CB 4.4Å; Q399-H415 WeakPolarHBondContact CB-CD2 3.48Å; Q399-H415 WeakPolarHBondContact CB-NE2 3.36Å; Q399-W512 HydrophobicContact CG-CD2 4.49Å; Q399-W512 HydrophobicContact CG-CG 4.11Å; Q399-W512 VanDerWaalsContact NE2-CD1 3.33Å
400	L	95.2	Very high	91.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59	-47.9	173.4	177.3	62	0	0	0	110.6	A396 L397 R402 A403 I404 M412 H415 A416 L419 F427 L431	A396-L400 WeakPolarHBondContact O-CB 3.19Å; A396-L400 PolarHBondContact O-N 2.93Å; L397-L400 PolarHBondContact O-N 3.48Å; L400-R402 VanDerWaalsContact C-N 3.32Å; L400-R402 PolarHBondContact O-N 2.83Å; L400-A403 PolarHBondContact O-N 3.1Å; L400-A403 VanDerWaalsContact O-N 3.11Å; L400-I404 HydrophobicContact CD1-CD1 4.16Å; L400-I404 HydrophobicContact CD1-CG1 4.23Å; L400-I404 HydrophobicContact CG-CD1 3.95Å; L400-I404 HydrophobicContact CG-CG1 4.47Å; L400-I404 VanDerWaalsContact O-CG1 3.27Å; L400-I404 WeakPolarHBondContact O-CG1 3.27Å; L400-I404 PolarHBondContact O-N 3.27Å; L400-M412 HydrophobicContact CD1-CB 4.2Å; L400-M412 HydrophobicContact CD1-CG 4.41Å; L400-H415 HydrophobicContact CB-CB 3.85Å; L400-A416 HydrophobicContact CD1-CB 4.42Å; L400-L419 HydrophobicContact CD2-CD1 4.12Å; L400-F427 HydrophobicContact CD2-CD1 3.78Å; L400-F427 HydrophobicContact CD2-CE1 3.31Å; L400-F427 HydrophobicContact CD2-CZ 4.06Å; L400-L431 HydrophobicContact CD2-CD2 3.96Å; L400-L431 HydrophobicContact CG-CD2 4.41Å
401	W	93.4	Very high	91.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-43.5	177.9	-159.8	-75	0	0	0	111.9	F352 L397 I405 L431 M432 I484 Y501 M504 A505 A508	F352-W401 HydrophobicContact CE1-CB 4.12Å; F352-W401 HydrophobicContact CE1-CD2 4.21Å; F352-W401 HydrophobicContact CE1-CE3 4.13Å; F352-W401 HydrophobicContact CE1-CG 4.22Å; F352-W401 HydrophobicContact CZ-CB 4.41Å; F352-W401 AromaticContact CZ-CD2 3.67Å; F352-W401 HydrophobicContact CZ-CD2 3.67Å; F352-W401 AromaticContact CZ-CE3 3.65Å; F352-W401 HydrophobicContact CZ-CE3 3.65Å; F352-W401 HydrophobicContact CZ-CG 4.02Å; F352-W401 HydrophobicContact CZ-CZ3 4.19Å; L397-W401 WeakPolarHBondContact O-CB 3.18Å; L397-W401 PolarHBondContact O-N 3.24Å; W401-I405 WeakPolarHBondContact O-CG1 3.48Å; W401-I405 PolarHBondContact O-N 3.32Å; W401-L431 HydrophobicContact CE3-CD1 4.38Å; W401-L431 HydrophobicContact CE3-CD2 3.84Å; W401-L431 HydrophobicContact CE3-CG 3.97Å; W401-L431 HydrophobicContact CZ3-CD1 3.89Å; W401-L431 HydrophobicContact CZ3-CD2 4.06Å; W401-L431 HydrophobicContact CZ3-CG 3.64Å; W401-M432 HydrophobicContact CD2-SD 4.43Å; W401-M432 HydrophobicContact CH2-SD 4.01Å; W401-M432 HydrophobicContact CZ2-SD 3.9Å; W401-M432 HydrophobicContact CZ3-SD 4.32Å; W401-I484 HydrophobicContact CH2-CD1 4.2Å; W401-I484 HydrophobicContact CH2-CG2 4.46Å; W401-I484 HydrophobicContact CZ3-CD1 3.76Å; W401-Y501 HydrophobicContact CZ2-CD1 4.32Å; W401-Y501 PolarHBondContact NE1-O 3.22Å; W401-Y501 VanDerWaalsContact NE1-O 3.09Å; W401-M504 HydrophobicContact CH2-CB 4.46Å; W401-M504 HydrophobicContact CH2-CE 3.43Å; W401-M504 VanDerWaalsContact CH2-CE 3.43Å; W401-M504 HydrophobicContact CH2-SD 3.76Å; W401-M504 HydrophobicContact CZ2-CB 3.57Å; W401-M504 HydrophobicContact CZ2-CE 3.74Å; W401-M504 HydrophobicContact CZ2-CG 4.19Å; W401-M504 HydrophobicContact CZ2-SD 3.62Å; W401-M504 HydrophobicContact CZ3-CE 3.97Å; W401-A505 VanDerWaalsContact CD1-CA 3.45Å; W401-A508 HydrophobicContact CB-CB 4.08Å; W401-A508 HydrophobicContact CG-CB 4.39Å
402	R	89.9	Confident	91.4	Very high	67 Å²	67	30.6 Å²	30.6	25%	0.253	16%	0.16	S	C	.	.	H	α-helix	trans	-60.2	-46	173.9	176.5	-175.1	167.3	-83.4	-9.3	111.4	C398 Q399 L400 I405 L406 V509 F541	C398-R402 PolarHBondContact O-N 3.33Å; C398-R402 VanDerWaalsContact O-N 3.12Å; Q399-R402 PolarHBondContact O-N 3.44Å; L400-R402 VanDerWaalsContact C-N 3.32Å; L400-R402 PolarHBondContact O-N 2.83Å; R402-I405 PolarHBondContact O-N 3.06Å; R402-L406 HydrophobicContact CG-CD1 3.86Å; R402-L406 HydrophobicContact CG-CG 4.45Å; R402-L406 WeakPolarHBondContact O-CG 3.48Å; R402-L406 PolarHBondContact O-N 3.32Å; R402-V509 HydrophobicContact CB-CG2 4.39Å; R402-V509 HydrophobicContact CG-CG2 4.23Å; R402-F541 HydrophobicContact CG-CD2 3.99Å; R402-F541 HydrophobicContact CG-CE2 4Å
403	A	90.6	Very high	91.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-40.3	-177.7	0	0	0	0	0	112.1	Q399 L400 I405 L406 R407 D408 A411 M412	Q399-A403 VanDerWaalsContact O-CB 3.31Å; Q399-A403 WeakPolarHBondContact O-CB 3.13Å; Q399-A403 PolarHBondContact O-N 3.27Å; L400-A403 PolarHBondContact O-N 3.1Å; L400-A403 VanDerWaalsContact O-N 3.11Å; A403-I405 VanDerWaalsContact C-N 3.33Å; A403-I405 PolarHBondContact O-N 3.09Å; A403-L406 CarbonylContact O-C 3.34Å; A403-L406 PolarHBondContact O-N 2.99Å; A403-R407 WeakPolarHBondContact O-CA 3.45Å; A403-R407 PolarHBondContact O-N 2.83Å; A403-D408 HydrophobicContact CB-CB 4.37Å; A403-D408 PolarHBondContact O-N 3.4Å; A403-A411 HydrophobicContact CB-CB 3.64Å; A403-M412 HydrophobicContact CB-CB 4.45Å; A403-M412 HydrophobicContact CB-CG 3.68Å
404	I	89	Confident	91.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.5	-47.1	174.3	-67.9	165.5	0	0	0	110.6	L400 L406 R407 M412 L431 M432 V436	L400-I404 HydrophobicContact CD1-CD1 4.16Å; L400-I404 HydrophobicContact CD1-CG1 4.23Å; L400-I404 HydrophobicContact CG-CD1 3.95Å; L400-I404 HydrophobicContact CG-CG1 4.47Å; L400-I404 VanDerWaalsContact O-CG1 3.27Å; L400-I404 WeakPolarHBondContact O-CG1 3.27Å; L400-I404 PolarHBondContact O-N 3.27Å; I404-L406 VanDerWaalsContact C-N 3.34Å; I404-L406 PolarHBondContact O-N 2.97Å; I404-R407 PolarHBondContact O-N 3.39Å; I404-M412 HydrophobicContact CG1-CE 4.19Å; I404-M412 HydrophobicContact CG1-CG 4.11Å; I404-M412 HydrophobicContact CG1-SD 4.34Å; I404-L431 HydrophobicContact CD1-CD2 4.14Å; I404-M432 HydrophobicContact CD1-CG 4.11Å; I404-M432 HydrophobicContact CD1-SD 4.39Å; I404-M432 HydrophobicContact CG2-CE 3.77Å; I404-M432 HydrophobicContact CG2-CG 3.76Å; I404-M432 HydrophobicContact CG2-SD 3.94Å; I404-V436 HydrophobicContact CG2-CG1 4.13Å; I404-V436 HydrophobicContact CG2-CG2 4.24Å
405	I	84.6	Confident	91.7	Very high	6 Å²	6	35.1 Å²	35.1	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-68.5	-35.8	-177.2	-64.3	-70.9	0	0	0	111.9	W401 R402 A403 R407 M432 W442 A505 F541 L545	W401-I405 WeakPolarHBondContact O-CG1 3.48Å; W401-I405 PolarHBondContact O-N 3.32Å; R402-I405 PolarHBondContact O-N 3.06Å; A403-I405 VanDerWaalsContact C-N 3.33Å; A403-I405 PolarHBondContact O-N 3.09Å; I405-R407 VanDerWaalsContact C-N 3.31Å; I405-M432 HydrophobicContact CD1-CE 3.95Å; I405-W442 HydrophobicContact CG2-CH2 4.22Å; I405-W442 HydrophobicContact CG2-CZ2 3.94Å; I405-A505 HydrophobicContact CG1-CB 3.87Å; I405-F541 HydrophobicContact CG2-CE2 4.32Å; I405-F541 HydrophobicContact CG2-CZ 4.03Å; I405-L545 HydrophobicContact CG2-CD1 3.45Å; I405-L545 VanDerWaalsContact CG2-CD1 3.45Å
406	L	83.1	Confident	91.9	Very high	21 Å²	21	34 Å²	34	11%	0.11	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	0.8	176	-63.6	179.2	0	0	0	113.4	R402 A403 I404 D408 F541 A544 L545	R402-L406 HydrophobicContact CG-CD1 3.86Å; R402-L406 HydrophobicContact CG-CG 4.45Å; R402-L406 WeakPolarHBondContact O-CG 3.48Å; R402-L406 PolarHBondContact O-N 3.32Å; A403-L406 CarbonylContact O-C 3.34Å; A403-L406 PolarHBondContact O-N 2.99Å; I404-L406 VanDerWaalsContact C-N 3.34Å; I404-L406 PolarHBondContact O-N 2.97Å; L406-D408 PolarHBondContact O-N 2.98Å; L406-F541 HydrophobicContact CD1-CD2 4.21Å; L406-F541 HydrophobicContact CD1-CE2 4.39Å; L406-F541 HydrophobicContact CD2-CD2 4.34Å; L406-F541 HydrophobicContact CD2-CE2 4.16Å; L406-F541 HydrophobicContact CG-CD2 4.39Å; L406-F541 HydrophobicContact CG-CE2 4.13Å; L406-A544 HydrophobicContact CD2-CB 4.08Å; L406-L545 HydrophobicContact CD2-CD1 4.01Å
407	R	82.8	Confident	91.9	Very high	100 Å²	100	36.4 Å²	36.4	38%	0.377	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	39.8	-177.7	-52.8	-179.5	71.7	-167.6	6.2	113.4	A403 I404 I405 D409 M552	A403-R407 WeakPolarHBondContact O-CA 3.45Å; A403-R407 PolarHBondContact O-N 2.83Å; I404-R407 PolarHBondContact O-N 3.39Å; I405-R407 VanDerWaalsContact C-N 3.31Å; R407-D409 PolarHBondContact O-N 3.42Å; R407-M552 VanDerWaalsContact CD-CE 3.47Å
408	D	87.1	Confident	91.9	Very high	66 Å²	66	39.2 Å²	39.2	35%	0.353	22%	0.22	S	C	.	.			trans	-92.2	88.3	177.8	-176.1	-18.5	0	0	0	109.9	A403 L406 A410 A411 M412	A403-D408 HydrophobicContact CB-CB 4.37Å; A403-D408 PolarHBondContact O-N 3.4Å; L406-D408 PolarHBondContact O-N 2.98Å; D408-A410 PolarHBondContact O-N 3.12Å; D408-A410 PolarHBondContact OD1-N 2.81Å; D408-A411 HydrophobicContact CB-CB 4Å; D408-A411 PolarHBondContact O-N 3.22Å; D408-A411 WeakPolarHBondContact OD1-CB 3.48Å; D408-A411 PolarHBondContact OD1-N 3.31Å; D408-A411 WeakPolarHBondContact OD2-CB 3.12Å; D408-M412 WeakPolarHBondContact O-CB 3.47Å; D408-M412 VanDerWaalsContact O-CG 3.22Å; D408-M412 WeakPolarHBondContact O-CG 3.45Å; D408-M412 PolarHBondContact O-N 2.87Å
409	D	88.9	Confident	91.9	Very high	85 Å²	85	39.3 Å²	39.3	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-57.3	-34.9	-177.8	-75.6	-71.9	0	0	0	113.2	R407 R413 Y424	R407-D409 PolarHBondContact O-N 3.42Å; D409-R413 WeakPolarHBondContact O-CB 3.22Å; D409-R413 PolarHBondContact O-N 3.34Å; D409-Y424 HydrophobicContact CB-CE2 4.46Å
410	A	93.3	Very high	92	Very high	74 Å²	74	40.7 Å²	40.7	61%	0.612	24%	0.239	S	C	*	.	H	α-helix	trans	-68.1	-46.6	179.5	0	0	0	0	0	110.7	D408 R413 A414	D408-A410 PolarHBondContact O-N 3.12Å; D408-A410 PolarHBondContact OD1-N 2.81Å; A410-R413 PolarHBondContact O-N 2.87Å; A410-A414 PolarHBondContact O-N 2.94Å
411	A	92.8	Very high	92	Very high	14 Å²	14	40.8 Å²	40.8	12%	0.116	24%	0.24	C	C	.	.	H	α-helix	trans	-67.4	-38.8	175.2	0	0	0	0	0	112	A403 D408 R413 A414 H415	A403-A411 HydrophobicContact CB-CB 3.64Å; D408-A411 HydrophobicContact CB-CB 4Å; D408-A411 PolarHBondContact O-N 3.22Å; D408-A411 WeakPolarHBondContact OD1-CB 3.48Å; D408-A411 PolarHBondContact OD1-N 3.31Å; D408-A411 WeakPolarHBondContact OD2-CB 3.12Å; A411-R413 VanDerWaalsContact C-N 3.33Å; A411-R413 PolarHBondContact O-N 2.99Å; A411-A414 PolarHBondContact O-N 2.91Å; A411-H415 WeakPolarHBondContact O-CB 3.25Å; A411-H415 PolarHBondContact O-CD2 3.13Å; A411-H415 PolarHBondContact O-N 3.15Å
412	M	94.1	Very high	91.9	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-57.2	-48.1	174.9	-71.5	167.3	58.8	0	0	110.6	L400 A403 I404 D408 H415 A416 Y424 L425 S428 V436	L400-M412 HydrophobicContact CD1-CB 4.2Å; L400-M412 HydrophobicContact CD1-CG 4.41Å; A403-M412 HydrophobicContact CB-CB 4.45Å; A403-M412 HydrophobicContact CB-CG 3.68Å; I404-M412 HydrophobicContact CG1-CE 4.19Å; I404-M412 HydrophobicContact CG1-CG 4.11Å; I404-M412 HydrophobicContact CG1-SD 4.34Å; D408-M412 WeakPolarHBondContact O-CB 3.47Å; D408-M412 VanDerWaalsContact O-CG 3.22Å; D408-M412 WeakPolarHBondContact O-CG 3.45Å; D408-M412 PolarHBondContact O-N 2.87Å; M412-H415 PolarHBondContact O-N 3.15Å; M412-A416 WeakPolarHBondContact O-CB 3.24Å; M412-A416 PolarHBondContact O-N 3.24Å; M412-Y424 HydrophobicContact CB-CD2 3.67Å; M412-Y424 HydrophobicContact CB-CE2 4.17Å; M412-Y424 HydrophobicContact CE-CD2 4.04Å; M412-Y424 HydrophobicContact CE-CE2 4.21Å; M412-L425 HydrophobicContact CE-CD2 4.25Å; M412-S428 WeakPolarHBondContact CE-OG 3.34Å; M412-V436 HydrophobicContact CE-CG1 3.95Å
413	R	95.7	Very high	92	Very high	149 Å²	149	50.6 Å²	50.6	56%	0.562	29%	0.287	S	S	*	.	H	α-helix	trans	-60.3	-47	176.6	-173.5	-177	-60.8	-139.8	1.6	112.3	D409 A410 A411 H415 A417 Y424	D409-R413 WeakPolarHBondContact O-CB 3.22Å; D409-R413 PolarHBondContact O-N 3.34Å; A410-R413 PolarHBondContact O-N 2.87Å; A411-R413 VanDerWaalsContact C-N 3.33Å; A411-R413 PolarHBondContact O-N 2.99Å; R413-H415 PolarHBondContact O-N 3.13Å; R413-A417 VanDerWaalsContact O-CB 3.31Å; R413-A417 WeakPolarHBondContact O-CB 3.43Å; R413-A417 PolarHBondContact O-N 2.78Å; R413-Y424 HydrophobicContact CB-CD1 3.97Å; R413-Y424 HydrophobicContact CB-CD2 4.39Å; R413-Y424 HydrophobicContact CB-CE1 4.3Å; R413-Y424 HydrophobicContact CB-CG 4.04Å; R413-Y424 HydrophobicContact CG-CD1 4.03Å; R413-Y424 HydrophobicContact CG-CE1 4.42Å; R413-Y424 HydrophobicContact CG-CG 4.5Å
414	A	96.6	Very high	92.1	Very high	56 Å²	56	51.8 Å²	51.8	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-61.9	-44	-178.6	0	0	0	0	0	112.2	A410 A411 A418	A410-A414 PolarHBondContact O-N 2.94Å; A411-A414 PolarHBondContact O-N 2.91Å; A414-A418 PolarHBondContact O-N 3.4Å; A414-A418 VanDerWaalsContact O-N 3.09Å
415	H	96.3	Very high	92.2	Very high	49 Å²	49	52.7 Å²	52.7	23%	0.227	30%	0.297	C	S	.	.	H	α-helix	trans	-83	-28.1	-175.5	-62.9	-52.8	0	0	0	113.6	Q399 L400 A411 M412 R413 A418 L419	Q399-H415 HydrophobicContact CB-CB 4.4Å; Q399-H415 WeakPolarHBondContact CB-CD2 3.48Å; Q399-H415 WeakPolarHBondContact CB-NE2 3.36Å; L400-H415 HydrophobicContact CB-CB 3.85Å; A411-H415 WeakPolarHBondContact O-CB 3.25Å; A411-H415 PolarHBondContact O-CD2 3.13Å; A411-H415 PolarHBondContact O-N 3.15Å; M412-H415 PolarHBondContact O-N 3.15Å; R413-H415 PolarHBondContact O-N 3.13Å; H415-A418 PolarHBondContact O-N 3.45Å; H415-L419 PolarHBondContact O-N 2.87Å
416	A	96.4	Very high	92.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-43.3	166.1	0	0	0	0	0	111.3	L400 M412 A418 L419 G420 V421 Y424 F427	L400-A416 HydrophobicContact CD1-CB 4.42Å; M412-A416 WeakPolarHBondContact O-CB 3.24Å; M412-A416 PolarHBondContact O-N 3.24Å; A416-A418 VanDerWaalsContact C-N 3.3Å; A416-A418 PolarHBondContact O-N 3.16Å; A416-L419 CarbonylContact O-C 3.54Å; A416-L419 WeakPolarHBondContact O-CA 3.48Å; A416-L419 WeakPolarHBondContact O-CB 3.24Å; A416-L419 PolarHBondContact O-N 3.2Å; A416-G420 PolarHBondContact O-N 3.42Å; A416-V421 CarbonylContact C-O 3.5Å; A416-V421 PolarHBondContact O-N 2.75Å; A416-Y424 VanDerWaalsContact CB-CB 3.42Å; A416-F427 HydrophobicContact CB-CD1 3.98Å
417	A	96.1	Very high	92.8	Very high	59 Å²	59	51.8 Å²	51.8	49%	0.488	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-35.4	176.9	0	0	0	0	0	112.4	R413 L419 G420 V421	R413-A417 VanDerWaalsContact O-CB 3.31Å; R413-A417 WeakPolarHBondContact O-CB 3.43Å; R413-A417 PolarHBondContact O-N 2.78Å; A417-L419 PolarHBondContact O-N 3.28Å; A417-G420 WeakPolarHBondContact O-CA 3.41Å; A417-G420 PolarHBondContact O-N 3.46Å; A417-V421 WeakPolarHBondContact CA-O 3.47Å; A417-V421 PolarHBondContact N-O 2.87Å
418	A	95.4	Very high	93.2	Very high	60 Å²	60	47 Å²	47	50%	0.496	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-24.2	172.9	0	0	0	0	0	113.1	A396 A414 H415 A416 G420	A396-A418 HydrophobicContact CB-CB 3.84Å; A414-A418 PolarHBondContact O-N 3.4Å; A414-A418 VanDerWaalsContact O-N 3.09Å; H415-A418 PolarHBondContact O-N 3.45Å; A416-A418 VanDerWaalsContact C-N 3.3Å; A416-A418 PolarHBondContact O-N 3.16Å; A418-G420 VanDerWaalsContact C-N 3.31Å
419	L	95.5	Very high	93.2	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	13.6	171	-68.9	168	0	0	0	112.6	D393 A396 L397 L400 H415 A416 A417 V421 F427 L473 P474 M477	D393-L419 HydrophobicContact CB-CD2 3.83Å; A396-L419 HydrophobicContact CB-CD1 4.39Å; A396-L419 HydrophobicContact CB-CD2 4.13Å; A396-L419 HydrophobicContact CB-CG 3.87Å; L397-L419 HydrophobicContact CB-CD1 4.37Å; L400-L419 HydrophobicContact CD2-CD1 4.12Å; H415-L419 PolarHBondContact O-N 2.87Å; A416-L419 CarbonylContact O-C 3.54Å; A416-L419 WeakPolarHBondContact O-CA 3.48Å; A416-L419 WeakPolarHBondContact O-CB 3.24Å; A416-L419 PolarHBondContact O-N 3.2Å; A417-L419 PolarHBondContact O-N 3.28Å; L419-V421 VanDerWaalsContact C-N 3.31Å; L419-V421 PolarHBondContact O-N 3.35Å; L419-F427 HydrophobicContact CB-CE1 4.33Å; L419-F427 HydrophobicContact CD1-CE1 3.76Å; L419-F427 HydrophobicContact CD1-CZ 4.02Å; L419-L473 HydrophobicContact CB-CD2 4.33Å; L419-P474 HydrophobicContact CD2-CG 4.29Å; L419-P474 WeakPolarHBondContact O-CD 3.49Å; L419-M477 HydrophobicContact CD2-CG 4.41Å; L419-M477 HydrophobicContact CD2-SD 4.48Å
420	G	94.5	Very high	93.1	Very high	44 Å²	44	41.3 Å²	41.3	45%	0.454	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-1.2	178	0	0	0	0	0	115.1	A416 A417 A418 A472	A416-G420 PolarHBondContact O-N 3.42Å; A417-G420 WeakPolarHBondContact O-CA 3.41Å; A417-G420 PolarHBondContact O-N 3.46Å; A418-G420 VanDerWaalsContact C-N 3.31Å; G420-A472 WeakPolarHBondContact O-CB 3.24Å
421	V	94.8	Very high	93	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.018	21%	0.214	C	C	.	.			trans	-101	125.4	-171.5	-174.3	0	0	0	0	112.1	A416 A417 L419 F427 V469 A472 L473	A416-V421 CarbonylContact C-O 3.5Å; A416-V421 PolarHBondContact O-N 2.75Å; A417-V421 WeakPolarHBondContact CA-O 3.47Å; A417-V421 PolarHBondContact N-O 2.87Å; L419-V421 VanDerWaalsContact C-N 3.31Å; L419-V421 PolarHBondContact O-N 3.35Å; V421-F427 HydrophobicContact CB-CB 4.48Å; V421-F427 HydrophobicContact CB-CD1 4.06Å; V421-F427 HydrophobicContact CB-CG 4.35Å; V421-F427 HydrophobicContact CG1-CB 3.79Å; V421-F427 HydrophobicContact CG1-CD1 4.28Å; V421-F427 HydrophobicContact CG1-CG 4.15Å; V421-F427 HydrophobicContact CG2-CD1 4.11Å; V421-F427 HydrophobicContact CG2-CE1 4.38Å; V421-F427 HydrophobicContact CG2-CG 4.29Å; V421-V469 HydrophobicContact CG1-CB 4.28Å; V421-V469 HydrophobicContact CG1-CG1 3.95Å; V421-V469 HydrophobicContact CG1-CG2 3.83Å; V421-V469 HydrophobicContact CG2-CG1 4.17Å; V421-A472 HydrophobicContact CG2-CB 4.42Å; V421-L473 HydrophobicContact CG2-CD2 3.49Å; V421-L473 VanDerWaalsContact CG2-CD2 3.49Å; V421-L473 HydrophobicContact CG2-CG 3.82Å
422	K	91.6	Very high	92.7	Very high	201 Å²	201	37.1 Å²	37.1	87%	0.874	21%	0.208	S	C	*	.	S	Bend	trans	-81.9	-43.2	177.6	-65.3	-177.3	-178.4	178.5	0	112.9	Y424	K422-Y424 VanDerWaalsContact C-N 3.29Å; K422-Y424 PolarHBondContact O-N 3.24Å
423	D	92.6	Very high	92.2	Very high	71 Å²	71	38.4 Å²	38.4	38%	0.38	21%	0.214	S	C	.	.			trans	-80.6	80.4	177.4	-164.9	-21.9	0	0	0	110.2	L425 L426 F427 V469	D423-L425 PolarHBondContact O-N 3.49Å; D423-L425 PolarHBondContact OD1-N 3.45Å; D423-L426 HydrophobicContact CB-CB 4.19Å; D423-L426 VanDerWaalsContact CG-CB 3.42Å; D423-L426 WeakPolarHBondContact OD1-CB 3.29Å; D423-L426 PolarHBondContact OD1-N 3.23Å; D423-F427 VanDerWaalsContact O-CB 3.29Å; D423-F427 WeakPolarHBondContact O-CB 3.2Å; D423-F427 PolarHBondContact O-N 3.18Å; D423-V469 HydrophobicContact CB-CG2 4.39Å
424	Y	93	Very high	91.6	Very high	25 Å²	25	31.5 Å²	31.5	10%	0.098	19%	0.188	C	C	.	.	H	α-helix	trans	-65.4	-26.5	-176.7	72.2	-82	0	0	0	113	D409 M412 R413 A416 K422 S428	D409-Y424 HydrophobicContact CB-CE2 4.46Å; M412-Y424 HydrophobicContact CB-CD2 3.67Å; M412-Y424 HydrophobicContact CB-CE2 4.17Å; M412-Y424 HydrophobicContact CE-CD2 4.04Å; M412-Y424 HydrophobicContact CE-CE2 4.21Å; R413-Y424 HydrophobicContact CB-CD1 3.97Å; R413-Y424 HydrophobicContact CB-CD2 4.39Å; R413-Y424 HydrophobicContact CB-CE1 4.3Å; R413-Y424 HydrophobicContact CB-CG 4.04Å; R413-Y424 HydrophobicContact CG-CD1 4.03Å; R413-Y424 HydrophobicContact CG-CE1 4.42Å; R413-Y424 HydrophobicContact CG-CG 4.5Å; A416-Y424 VanDerWaalsContact CB-CB 3.42Å; K422-Y424 VanDerWaalsContact C-N 3.29Å; K422-Y424 PolarHBondContact O-N 3.24Å; Y424-S428 VanDerWaalsContact O-CB 3.24Å; Y424-S428 WeakPolarHBondContact O-CB 3.47Å; Y424-S428 PolarHBondContact O-N 2.91Å; Y424-S428 PolarHBondContact O-OG 2.87Å
425	L	90.2	Very high	90.9	Very high	19 Å²	19	29 Å²	29	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-76.6	-53.5	-178.9	-77.9	159.1	0	0	0	110.5	M412 D423 F427 S428 E429 R437	M412-L425 HydrophobicContact CE-CD2 4.25Å; D423-L425 PolarHBondContact O-N 3.49Å; D423-L425 PolarHBondContact OD1-N 3.45Å; L425-F427 PolarHBondContact O-N 3.33Å; L425-S428 WeakPolarHBondContact O-CB 3.36Å; L425-S428 PolarHBondContact O-N 3.33Å; L425-E429 WeakPolarHBondContact O-CG 3.27Å; L425-E429 PolarHBondContact O-N 2.99Å; L425-R437 HydrophobicContact CD2-CG 4.25Å
426	L	89.1	Confident	89.9	Confident	9 Å²	9	27 Å²	27	5%	0.047	16%	0.159	C	C	.	.	H	α-helix	trans	-56.5	-43.4	175.9	-179.3	59.6	0	0	0	110.4	D423 S428 E429 M430 M458 A465 I466 V469	D423-L426 HydrophobicContact CB-CB 4.19Å; D423-L426 VanDerWaalsContact CG-CB 3.42Å; D423-L426 WeakPolarHBondContact OD1-CB 3.29Å; D423-L426 PolarHBondContact OD1-N 3.23Å; L426-S428 PolarHBondContact O-N 3.38Å; L426-E429 PolarHBondContact O-N 3.17Å; L426-M430 HydrophobicContact CD1-CG 4.45Å; L426-M430 HydrophobicContact CD1-SD 4.42Å; L426-M430 HydrophobicContact CG-SD 4Å; L426-M430 WeakPolarHBondContact O-CB 3.38Å; L426-M430 WeakPolarHBondContact O-CG 3.44Å; L426-M430 PolarHBondContact O-N 2.94Å; L426-M458 HydrophobicContact CD1-CE 4.37Å; L426-M458 HydrophobicContact CD1-CG 4.2Å; L426-M458 HydrophobicContact CD1-SD 3.46Å; L426-M458 WeakPolarHBondContact CD1-SD 3.46Å; L426-A465 HydrophobicContact CD2-CB 3.53Å; L426-I466 HydrophobicContact CD1-CG1 4.06Å; L426-I466 HydrophobicContact CD2-CG1 4.12Å; L426-I466 HydrophobicContact CG-CG1 4.43Å; L426-V469 HydrophobicContact CD2-CG2 4Å; L426-V469 HydrophobicContact CG-CG2 4.3Å
427	F	92.1	Very high	88.4	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-41.2	176.5	-179.9	-141.8	0	0	0	113.1	L400 A416 L419 V421 D423 L425 E429 M430 L431 V469 L473 M477	L400-F427 HydrophobicContact CD2-CD1 3.78Å; L400-F427 HydrophobicContact CD2-CE1 3.31Å; L400-F427 HydrophobicContact CD2-CZ 4.06Å; A416-F427 HydrophobicContact CB-CD1 3.98Å; L419-F427 HydrophobicContact CB-CE1 4.33Å; L419-F427 HydrophobicContact CD1-CE1 3.76Å; L419-F427 HydrophobicContact CD1-CZ 4.02Å; V421-F427 HydrophobicContact CB-CB 4.48Å; V421-F427 HydrophobicContact CB-CD1 4.06Å; V421-F427 HydrophobicContact CB-CG 4.35Å; V421-F427 HydrophobicContact CG1-CB 3.79Å; V421-F427 HydrophobicContact CG1-CD1 4.28Å; V421-F427 HydrophobicContact CG1-CG 4.15Å; V421-F427 HydrophobicContact CG2-CD1 4.11Å; V421-F427 HydrophobicContact CG2-CE1 4.38Å; V421-F427 HydrophobicContact CG2-CG 4.29Å; D423-F427 VanDerWaalsContact O-CB 3.29Å; D423-F427 WeakPolarHBondContact O-CB 3.2Å; D423-F427 PolarHBondContact O-N 3.18Å; L425-F427 PolarHBondContact O-N 3.33Å; F427-E429 VanDerWaalsContact C-N 3.33Å; F427-E429 PolarHBondContact O-N 3Å; F427-M430 PolarHBondContact O-N 2.82Å; F427-L431 HydrophobicContact CE2-CB 4.48Å; F427-L431 VanDerWaalsContact O-CB 3.24Å; F427-L431 WeakPolarHBondContact O-CB 3.47Å; F427-L431 PolarHBondContact O-N 3.25Å; F427-V469 HydrophobicContact CB-CG1 4Å; F427-V469 HydrophobicContact CD2-CG1 3.86Å; F427-V469 HydrophobicContact CG-CG1 4.16Å; F427-L473 HydrophobicContact CD2-CD1 4.36Å; F427-L473 HydrophobicContact CD2-CD2 4.39Å; F427-L473 HydrophobicContact CE1-CD2 4.08Å; F427-L473 HydrophobicContact CE2-CD1 3.86Å; F427-L473 HydrophobicContact CE2-CD2 3.69Å; F427-L473 HydrophobicContact CE2-CG 4.36Å; F427-L473 HydrophobicContact CZ-CD2 3.51Å; F427-M477 HydrophobicContact CZ-CE 4.27Å
428	S	91.2	Very high	86.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-39.4	176.6	-61.9	0	0	0	0	111.4	M412 Y424 L425 L426 L431 M432	M412-S428 WeakPolarHBondContact CE-OG 3.34Å; Y424-S428 VanDerWaalsContact O-CB 3.24Å; Y424-S428 WeakPolarHBondContact O-CB 3.47Å; Y424-S428 PolarHBondContact O-N 2.91Å; Y424-S428 PolarHBondContact O-OG 2.87Å; L425-S428 WeakPolarHBondContact O-CB 3.36Å; L425-S428 PolarHBondContact O-N 3.33Å; L426-S428 PolarHBondContact O-N 3.38Å; S428-L431 PolarHBondContact O-N 3.22Å; S428-M432 VanDerWaalsContact O-CB 3.24Å; S428-M432 WeakPolarHBondContact O-CB 3.43Å; S428-M432 WeakPolarHBondContact O-CG 3.26Å; S428-M432 PolarHBondContact O-N 2.93Å
429	E	87.8	Confident	84.6	Confident	9 Å²	9	33.8 Å²	33.8	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-68.1	-38.1	176.6	-69.9	-179.8	160.3	0	0	112.4	L425 L426 F427 Q433 R434 V436 Y454	L425-E429 WeakPolarHBondContact O-CG 3.27Å; L425-E429 PolarHBondContact O-N 2.99Å; L426-E429 PolarHBondContact O-N 3.17Å; F427-E429 VanDerWaalsContact C-N 3.33Å; F427-E429 PolarHBondContact O-N 3Å; E429-Q433 VanDerWaalsContact O-CA 3.22Å; E429-Q433 WeakPolarHBondContact O-CA 3.27Å; E429-Q433 PolarHBondContact O-N 2.67Å; E429-R434 WeakPolarHBondContact CA-O 3.46Å; E429-R434 PolarHBondContact O-N 3.4Å; E429-V436 HydrophobicContact CG-CB 4.1Å; E429-V436 HydrophobicContact CG-CG2 3.83Å; E429-V436 PolarHBondContact OE1-N 2.85Å; E429-Y454 PolarHBondContact OE2-OH 3.3Å
430	M	86.6	Confident	82.7	Confident	22 Å²	22	35.2 Å²	35.2	11%	0.108	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-44.3	172	-70	167.9	62.2	0	0	112	L426 F427 Q433 I466 V469 L470	L426-M430 HydrophobicContact CD1-CG 4.45Å; L426-M430 HydrophobicContact CD1-SD 4.42Å; L426-M430 HydrophobicContact CG-SD 4Å; L426-M430 WeakPolarHBondContact O-CB 3.38Å; L426-M430 WeakPolarHBondContact O-CG 3.44Å; L426-M430 PolarHBondContact O-N 2.94Å; F427-M430 PolarHBondContact O-N 2.82Å; M430-Q433 VanDerWaalsContact O-CG 3.27Å; M430-Q433 WeakPolarHBondContact O-CG 3.38Å; M430-Q433 PolarHBondContact O-N 3.27Å; M430-I466 HydrophobicContact CE-CG2 3.94Å; M430-I466 HydrophobicContact SD-CB 4.49Å; M430-I466 HydrophobicContact SD-CG1 4.27Å; M430-I466 HydrophobicContact SD-CG2 4.22Å; M430-V469 HydrophobicContact CE-CB 4.38Å; M430-V469 HydrophobicContact CE-CG1 3.93Å; M430-V469 HydrophobicContact SD-CB 4.07Å; M430-V469 HydrophobicContact SD-CG1 3.8Å; M430-V469 HydrophobicContact SD-CG2 4.41Å; M430-L470 HydrophobicContact CE-CD1 4.04Å; M430-L470 HydrophobicContact CE-CD2 3.56Å; M430-L470 HydrophobicContact CE-CG 3.68Å
431	L	89.8	Confident	80.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-42	179.9	-177.4	64.1	0	0	0	111.4	L397 L400 W401 I404 F427 S428 L481 I484	L397-L431 HydrophobicContact CD1-CD1 4.21Å; L397-L431 HydrophobicContact CD1-CD2 3.83Å; L400-L431 HydrophobicContact CD2-CD2 3.96Å; L400-L431 HydrophobicContact CG-CD2 4.41Å; W401-L431 HydrophobicContact CE3-CD1 4.38Å; W401-L431 HydrophobicContact CE3-CD2 3.84Å; W401-L431 HydrophobicContact CE3-CG 3.97Å; W401-L431 HydrophobicContact CZ3-CD1 3.89Å; W401-L431 HydrophobicContact CZ3-CD2 4.06Å; W401-L431 HydrophobicContact CZ3-CG 3.64Å; I404-L431 HydrophobicContact CD1-CD2 4.14Å; F427-L431 HydrophobicContact CE2-CB 4.48Å; F427-L431 VanDerWaalsContact O-CB 3.24Å; F427-L431 WeakPolarHBondContact O-CB 3.47Å; F427-L431 PolarHBondContact O-N 3.25Å; S428-L431 PolarHBondContact O-N 3.22Å; L431-L481 HydrophobicContact CB-CD2 4.43Å; L431-L481 HydrophobicContact CD1-CD2 3.86Å; L431-I484 HydrophobicContact CD1-CD1 3.63Å
432	M	87	Confident	79	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-81.4	-17.8	178.1	-62	-64.4	-81.3	0	0	112.4	W401 I404 I405 S428 R434 V436 L441 R500 Y501	W401-M432 HydrophobicContact CD2-SD 4.43Å; W401-M432 HydrophobicContact CH2-SD 4.01Å; W401-M432 HydrophobicContact CZ2-SD 3.9Å; W401-M432 HydrophobicContact CZ3-SD 4.32Å; I404-M432 HydrophobicContact CD1-CG 4.11Å; I404-M432 HydrophobicContact CD1-SD 4.39Å; I404-M432 HydrophobicContact CG2-CE 3.77Å; I404-M432 HydrophobicContact CG2-CG 3.76Å; I404-M432 HydrophobicContact CG2-SD 3.94Å; I405-M432 HydrophobicContact CD1-CE 3.95Å; S428-M432 VanDerWaalsContact O-CB 3.24Å; S428-M432 WeakPolarHBondContact O-CB 3.43Å; S428-M432 WeakPolarHBondContact O-CG 3.26Å; S428-M432 PolarHBondContact O-N 2.93Å; M432-R434 HydrophobicContact CB-CG 3.85Å; M432-R434 PolarHBondContact O-N 3.18Å; M432-V436 HydrophobicContact CB-CG2 4.39Å; M432-V436 HydrophobicContact CG-CG2 4.18Å; M432-L441 HydrophobicContact CE-CD2 3.41Å; M432-L441 VanDerWaalsContact CE-CD2 3.41Å; M432-R500 PolarHBondContact O-NH2 3.44Å; M432-Y501 HydrophobicContact CB-CE1 4.24Å; M432-Y501 HydrophobicContact CE-CD1 3.15Å; M432-Y501 HydrophobicContact CE-CE1 3.74Å; M432-Y501 HydrophobicContact CE-CG 3.75Å; M432-Y501 VanDerWaalsContact O-CE1 3.25Å; M432-Y501 WeakPolarHBondContact O-CE1 3.24Å; M432-Y501 PolarHBondContact O-OH 3.13Å; M432-Y501 HydrophobicContact SD-CD1 3.82Å; M432-Y501 HydrophobicContact SD-CE1 4.2Å
433	Q	84.5	Confident	77.1	Confident	28 Å²	28	30.1 Å²	30.1	13%	0.131	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	36.8	-175	-58.2	168.9	-1.4	0	0	112.1	E429 M430 N485	E429-Q433 VanDerWaalsContact O-CA 3.22Å; E429-Q433 WeakPolarHBondContact O-CA 3.27Å; E429-Q433 PolarHBondContact O-N 2.67Å; M430-Q433 VanDerWaalsContact O-CG 3.27Å; M430-Q433 WeakPolarHBondContact O-CG 3.38Å; M430-Q433 PolarHBondContact O-N 3.27Å; Q433-N485 PolarHBondContact OE1-OD1 3.26Å
434	R	82.9	Confident	75.3	Confident	4 Å²	4	28.9 Å²	28.9	2%	0.015	15%	0.153	C	C	.	.	S	Bend	trans	-162.5	160.3	177.3	69	175	-60.2	163.3	15.5	109.9	E429 M432 Q440 L441 L447 E451 Y501	E429-R434 WeakPolarHBondContact CA-O 3.46Å; E429-R434 PolarHBondContact O-N 3.4Å; M432-R434 HydrophobicContact CB-CG 3.85Å; M432-R434 PolarHBondContact O-N 3.18Å; R434-Q440 PolarHBondContact NH1-O 2.98Å; R434-Q440 PolarHBondContact NH2-O 3.03Å; R434-L441 PolarHBondContact NH1-O 2.85Å; R434-L447 HydrophobicContact CB-CD2 3.67Å; R434-E451 IonicContact CZ-OE1 3.42Å; R434-E451 IonicContact NE-OE1 3.33Å; R434-E451 IonicContact NH2-OE1 3.25Å; R434-E451 PolarHBondContact NH2-OE1 3.41Å; R434-E451 IonicContact NH2-OE2 2.73Å; R434-Y501 VanDerWaalsContact CD-CZ 3.4Å; R434-Y501 WeakPolarHBondContact CD-OH 3.34Å; R434-Y501 HydrophobicContact CG-CE1 4.43Å
435	P	80.5	Confident	74.1	Confident	4 Å²	4	32 Å²	32	3%	0.026	17%	0.168	C	C	.	.			trans	-62.4	138.1	172.7	-17.4	30.8	0	0	0	111.7	L438 E451 Y454 M455	P435-L438 HydrophobicContact CB-CB 4.35Å; P435-L438 HydrophobicContact CB-CD1 3.54Å; P435-L438 HydrophobicContact CB-CG 4.48Å; P435-L438 HydrophobicContact CG-CD1 3.83Å; P435-E451 HydrophobicContact CG-CB 4.17Å; P435-E451 HydrophobicContact CG-CG 4.15Å; P435-Y454 HydrophobicContact CB-CD1 4.18Å; P435-Y454 HydrophobicContact CB-CE1 4.1Å; P435-Y454 HydrophobicContact CG-CD1 3.57Å; P435-Y454 HydrophobicContact CG-CE1 3.97Å; P435-Y454 HydrophobicContact CG-CG 4.36Å; P435-M455 HydrophobicContact CG-CG 4.49Å; P435-M455 HydrophobicContact CG-SD 4.33Å
436	V	76.6	Confident	72.9	Confident	8 Å²	8	35.4 Å²	35.4	5%	0.048	19%	0.186	C	C	.	.	S	Bend	trans	-96.3	-27.2	-179.5	174.3	0	0	0	0	111.4	I404 M412 E429 M432	I404-V436 HydrophobicContact CG2-CG1 4.13Å; I404-V436 HydrophobicContact CG2-CG2 4.24Å; M412-V436 HydrophobicContact CE-CG1 3.95Å; E429-V436 HydrophobicContact CG-CB 4.1Å; E429-V436 HydrophobicContact CG-CG2 3.83Å; E429-V436 PolarHBondContact OE1-N 2.85Å; M432-V436 HydrophobicContact CB-CG2 4.39Å; M432-V436 HydrophobicContact CG-CG2 4.18Å
437	R	65.1	Low	71.8	Confident	168 Å²	168	37.9 Å²	37.9	63%	0.634	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-26.2	-175.3	-72.9	177.4	167.1	-173.6	-7.7	114.7	L425 G439	L425-R437 HydrophobicContact CD2-CG 4.25Å; R437-G439 PolarHBondContact O-N 2.98Å
438	L	56.5	Low	70.9	Confident	73 Å²	73	39.7 Å²	39.7	38%	0.382	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	6.2	-170	-92.1	143.3	0	0	0	115.9	P435 Q440	P435-L438 HydrophobicContact CB-CB 4.35Å; P435-L438 HydrophobicContact CB-CD1 3.54Å; P435-L438 HydrophobicContact CB-CG 4.48Å; P435-L438 HydrophobicContact CG-CD1 3.83Å; L438-Q440 WeakPolarHBondContact O-CG 3.46Å; L438-Q440 PolarHBondContact O-N 2.62Å
439	G	54.7	Low	69.9	Low	19 Å²	19	50.9 Å²	50.9	20%	0.196	25%	0.254	C	S	.	.	S	Bend	trans	67.2	-3.4	178.6	0	0	0	0	0	115.1	R437 L441	R437-G439 PolarHBondContact O-N 2.98Å; G439-L441 PolarHBondContact O-N 3.45Å
440	Q	55.7	Low	69.1	Low	32 Å²	32	55.7 Å²	55.7	15%	0.15	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-89.4	6.9	-170.7	-74.4	169.2	6.7	0	0	114.8	R434 L438 W442 G443 E451	R434-Q440 PolarHBondContact NH1-O 2.98Å; R434-Q440 PolarHBondContact NH2-O 3.03Å; L438-Q440 WeakPolarHBondContact O-CG 3.46Å; L438-Q440 PolarHBondContact O-N 2.62Å; Q440-W442 PolarHBondContact O-N 3.39Å; Q440-G443 PolarHBondContact O-N 2.86Å; Q440-E451 VanDerWaalsContact OE1-CG 3.26Å; Q440-E451 PolarHBondContact OE1-OE1 3.1Å; Q440-E451 VanDerWaalsContact OE1-OE1 3.11Å
441	L	56.1	Low	68.5	Low	8 Å²	8	54.7 Å²	54.7	4%	0.042	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-49.8	-23.2	178.5	-86.6	160.3	0	0	0	113.6	M432 R434 G439	M432-L441 HydrophobicContact CE-CD2 3.41Å; M432-L441 VanDerWaalsContact CE-CD2 3.41Å; R434-L441 PolarHBondContact NH1-O 2.85Å; G439-L441 PolarHBondContact O-N 3.45Å
442	W	55.2	Low	67.8	Low	76 Å²	76	56.6 Å²	56.6	29%	0.288	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-111.1	-12	-167.3	-58.7	83.5	0	0	0	115.3	I405 Q440 L545 T549 M552	I405-W442 HydrophobicContact CG2-CH2 4.22Å; I405-W442 HydrophobicContact CG2-CZ2 3.94Å; Q440-W442 PolarHBondContact O-N 3.39Å; W442-L545 HydrophobicContact CH2-CD1 3.13Å; W442-L545 HydrophobicContact CH2-CD2 3.64Å; W442-L545 HydrophobicContact CH2-CG 3.26Å; W442-L545 HydrophobicContact CZ2-CD1 3.52Å; W442-L545 HydrophobicContact CZ2-CG 4.09Å; W442-L545 HydrophobicContact CZ3-CD1 4.24Å; W442-L545 HydrophobicContact CZ3-CD2 4.08Å; W442-L545 HydrophobicContact CZ3-CG 3.92Å; W442-T549 HydrophobicContact CE3-CG2 4.47Å; W442-T549 WeakPolarHBondContact CZ3-OG1 3.46Å; W442-M552 HydrophobicContact CG-SD 4.28Å
443	G	52	Low	67.1	Low	58 Å²	58	58.9 Å²	58.9	60%	0.598	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-36.8	-165.9	0	0	0	0	0	115.3	Q440	Q440-G443 PolarHBondContact O-N 2.86Å
444	S	55.1	Low	66.9	Low	45 Å²	45	61.9 Å²	61.9	32%	0.315	32%	0.317	S	S	.	.			trans	-142.7	139	-175.8	58.9	0	0	0	0	111.9	L446	S444-L446 VanDerWaalsContact CB-O 3.25Å; S444-L446 WeakPolarHBondContact CB-O 3.42Å; S444-L446 PolarHBondContact O-N 2.88Å; S444-L446 PolarHBondContact OG-O 3.38Å
445	H	66.5	Low	66.7	Low	89 Å²	89	63.2 Å²	63.2	41%	0.412	32%	0.324	S	S	.	.	S	Bend	trans	-77.4	-12.2	173	-56.6	171.6	0	0	0	112.4	A496 V498	H445-A496 HydrophobicContact CB-CB 3.68Å; H445-A496 VanDerWaalsContact CB-O 3.27Å; H445-A496 WeakPolarHBondContact CB-O 3.31Å; H445-A496 PolarHBondContact ND1-O 3.12Å; H445-V498 PolarHBondContact ND1-N 2.92Å
446	L	66.5	Low	66.2	Low	91 Å²	91	67.5 Å²	67.5	48%	0.476	35%	0.35	S	S	.	.	S	Bend	trans	-111.9	149	175.1	-67.7	171.4	0	0	0	109.6	S444 V492 A496	S444-L446 VanDerWaalsContact CB-O 3.25Å; S444-L446 WeakPolarHBondContact CB-O 3.42Å; S444-L446 PolarHBondContact O-N 2.88Å; S444-L446 PolarHBondContact OG-O 3.38Å; L446-V492 HydrophobicContact CD2-CG1 4.11Å; L446-V492 HydrophobicContact CD2-CG2 4.1Å; L446-A496 HydrophobicContact CD2-CB 3.61Å; L446-A496 HydrophobicContact CG-CB 3.78Å
447	L	66.5	Low	66	Low	61 Å²	61	69.9 Å²	69.9	32%	0.319	36%	0.362	S	S	.	.			trans	-65.2	135.8	171	-72.4	160.5	0	0	0	109.5	R434 E451 A452	R434-L447 HydrophobicContact CB-CD2 3.67Å; L447-E451 WeakPolarHBondContact CA-OE2 3.47Å; L447-E451 HydrophobicContact CB-CB 4.35Å; L447-E451 HydrophobicContact CD2-CB 3.71Å; L447-A452 HydrophobicContact CB-CB 4.43Å
448	S	71.3	Confident	66.6	Low	38 Å²	38	62.3 Å²	62.3	27%	0.266	33%	0.334	S	S	.	.			trans	-64.7	163	165.5	87	0	0	0	0	110.2	E450 E451 A452	S448-E450 PolarHBondContact O-N 3.39Å; S448-E450 PolarHBondContact OG-N 2.85Å; S448-E451 PolarHBondContact N-OE2 2.92Å; S448-E451 PolarHBondContact O-N 2.73Å; S448-E451 WeakPolarHBondContact OG-CG 3.25Å; S448-E451 PolarHBondContact OG-N 3.48Å; S448-A452 WeakPolarHBondContact O-CB 3.22Å; S448-A452 PolarHBondContact O-N 3.06Å
449	R	70.4	Confident	67.1	Low	235 Å²	235	61.1 Å²	61.1	89%	0.887	33%	0.334	S	S	*	.	H	α-helix	trans	-59.8	-35.4	176.7	-173.3	177.8	179.2	-179.1	-0.7	111.7	A453	R449-A453 WeakPolarHBondContact O-CB 3.24Å; R449-A453 PolarHBondContact O-N 3.21Å
450	E	71.4	Confident	67.7	Low	110 Å²	110	66.4 Å²	66.4	51%	0.514	35%	0.349	S	S	.	.	H	α-helix	trans	-72.9	-44.7	178.7	-62.2	166.4	162.7	0	0	111.3	S448 A452 A453 Y454 Q576	S448-E450 PolarHBondContact O-N 3.39Å; S448-E450 PolarHBondContact OG-N 2.85Å; E450-A452 VanDerWaalsContact C-N 3.27Å; E450-A452 PolarHBondContact O-N 2.94Å; E450-A453 PolarHBondContact O-N 2.99Å; E450-Y454 WeakPolarHBondContact O-CB 3.45Å; E450-Y454 PolarHBondContact O-N 3.06Å; E450-Q576 PolarHBondContact OE1-NE2 3.48Å; E450-Q576 PolarHBondContact OE2-NE2 3.34Å
451	E	74.4	Confident	68.4	Low	2 Å²	2	70.7 Å²	70.7	1%	0.009	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-40.4	174.8	-69.6	179.4	119.8	0	0	110.7	R434 P435 Q440 L447 S448 Y454 M455	R434-E451 IonicContact CZ-OE1 3.42Å; R434-E451 IonicContact NE-OE1 3.33Å; R434-E451 IonicContact NH2-OE1 3.25Å; R434-E451 PolarHBondContact NH2-OE1 3.41Å; R434-E451 IonicContact NH2-OE2 2.73Å; P435-E451 HydrophobicContact CG-CB 4.17Å; P435-E451 HydrophobicContact CG-CG 4.15Å; Q440-E451 VanDerWaalsContact OE1-CG 3.26Å; Q440-E451 PolarHBondContact OE1-OE1 3.1Å; Q440-E451 VanDerWaalsContact OE1-OE1 3.11Å; L447-E451 WeakPolarHBondContact CA-OE2 3.47Å; L447-E451 HydrophobicContact CB-CB 4.35Å; L447-E451 HydrophobicContact CD2-CB 3.71Å; S448-E451 PolarHBondContact N-OE2 2.92Å; S448-E451 PolarHBondContact O-N 2.73Å; S448-E451 WeakPolarHBondContact OG-CG 3.25Å; S448-E451 PolarHBondContact OG-N 3.48Å; E451-Y454 PolarHBondContact O-N 3.29Å; E451-M455 WeakPolarHBondContact O-CB 3.32Å; E451-M455 WeakPolarHBondContact O-CG 3.34Å; E451-M455 PolarHBondContact O-N 2.86Å
452	A	74.1	Confident	69.3	Low	40 Å²	40	74.9 Å²	74.9	33%	0.331	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-43.3	176.1	0	0	0	0	0	112	L447 S448 E450 M455 V456	L447-A452 HydrophobicContact CB-CB 4.43Å; S448-A452 WeakPolarHBondContact O-CB 3.22Å; S448-A452 PolarHBondContact O-N 3.06Å; E450-A452 VanDerWaalsContact C-N 3.27Å; E450-A452 PolarHBondContact O-N 2.94Å; A452-M455 PolarHBondContact O-N 2.89Å; A452-V456 WeakPolarHBondContact O-CG2 3.47Å; A452-V456 PolarHBondContact O-N 2.97Å; A452-V456 VanDerWaalsContact O-N 3.09Å
453	A	72.9	Confident	70	Confident	47 Å²	47	74.4 Å²	74.4	39%	0.388	39%	0.388	S	S	.	.	H	α-helix	trans	-61.4	-48.3	175.5	0	0	0	0	0	111.3	R449 E450 M455 V456 D457	R449-A453 WeakPolarHBondContact O-CB 3.24Å; R449-A453 PolarHBondContact O-N 3.21Å; E450-A453 PolarHBondContact O-N 2.99Å; A453-M455 VanDerWaalsContact C-N 3.32Å; A453-M455 PolarHBondContact O-N 3.44Å; A453-V456 WeakPolarHBondContact O-CB 3.23Å; A453-V456 PolarHBondContact O-N 3.24Å; A453-D457 PolarHBondContact O-N 3.19Å
454	Y	79.6	Confident	70.9	Confident	91 Å²	91	78 Å²	78	36%	0.357	39%	0.389	S	S	.	.	H	α-helix	trans	-55.1	-45.9	174.9	171.8	-89.7	0	0	0	112.2	E429 P435 E450 E451 V456 D457 M458	E429-Y454 PolarHBondContact OE2-OH 3.3Å; P435-Y454 HydrophobicContact CB-CD1 4.18Å; P435-Y454 HydrophobicContact CB-CE1 4.1Å; P435-Y454 HydrophobicContact CG-CD1 3.57Å; P435-Y454 HydrophobicContact CG-CE1 3.97Å; P435-Y454 HydrophobicContact CG-CG 4.36Å; E450-Y454 WeakPolarHBondContact O-CB 3.45Å; E450-Y454 PolarHBondContact O-N 3.06Å; E451-Y454 PolarHBondContact O-N 3.29Å; Y454-V456 VanDerWaalsContact C-N 3.27Å; Y454-V456 PolarHBondContact O-N 3.42Å; Y454-D457 PolarHBondContact O-N 2.92Å; Y454-M458 HydrophobicContact CE1-CB 4.3Å; Y454-M458 WeakPolarHBondContact O-CB 3.3Å; Y454-M458 PolarHBondContact O-N 3.39Å
455	M	78.8	Confident	72	Confident	33 Å²	33	77.4 Å²	77.4	16%	0.163	39%	0.387	C	S	.	.	H	α-helix	trans	-65	-33.2	-180	-70.8	-63.9	-60.4	0	0	112.1	P435 E451 A452 A453 M458 A459	P435-M455 HydrophobicContact CG-CG 4.49Å; P435-M455 HydrophobicContact CG-SD 4.33Å; E451-M455 WeakPolarHBondContact O-CB 3.32Å; E451-M455 WeakPolarHBondContact O-CG 3.34Å; E451-M455 PolarHBondContact O-N 2.86Å; A452-M455 PolarHBondContact O-N 2.89Å; A453-M455 VanDerWaalsContact C-N 3.32Å; A453-M455 PolarHBondContact O-N 3.44Å; M455-M458 HydrophobicContact CE-CE 3.54Å; M455-M458 HydrophobicContact SD-CE 4Å; M455-A459 WeakPolarHBondContact O-CB 3.3Å; M455-A459 PolarHBondContact O-N 3.11Å; M455-A459 VanDerWaalsContact O-N 3.08Å
456	V	71.1	Confident	72.6	Confident	94 Å²	94	73.7 Å²	73.7	57%	0.57	37%	0.37	S	S	*	.	H	α-helix	trans	-70.4	-45.7	174.5	170.8	0	0	0	0	110.8	A452 A453 Y454 A459 R460	A452-V456 WeakPolarHBondContact O-CG2 3.47Å; A452-V456 PolarHBondContact O-N 2.97Å; A452-V456 VanDerWaalsContact O-N 3.09Å; A453-V456 WeakPolarHBondContact O-CB 3.23Å; A453-V456 PolarHBondContact O-N 3.24Å; Y454-V456 VanDerWaalsContact C-N 3.27Å; Y454-V456 PolarHBondContact O-N 3.42Å; V456-A459 PolarHBondContact O-N 2.9Å; V456-R460 PolarHBondContact O-N 2.9Å
457	D	72.8	Confident	73	Confident	57 Å²	57	70 Å²	70	31%	0.305	35%	0.351	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.8	-68	-32.7	0	0	0	110.8	A453 Y454 A459 R460 E461	A453-D457 PolarHBondContact O-N 3.19Å; Y454-D457 PolarHBondContact O-N 2.92Å; D457-A459 VanDerWaalsContact C-N 3.32Å; D457-A459 PolarHBondContact O-N 3.25Å; D457-R460 PolarHBondContact O-N 3.09Å; D457-R460 VanDerWaalsContact O-N 3.09Å; D457-R460 IonicContact OD1-CZ 2.78Å; D457-R460 IonicContact OD1-NH1 2.77Å; D457-R460 IonicContact OD1-NH2 3.48Å; D457-R460 PolarHBondContact OD1-NH2 3.42Å; D457-E461 WeakPolarHBondContact O-CB 3.24Å; D457-E461 WeakPolarHBondContact O-CG 3.14Å; D457-E461 PolarHBondContact O-N 3.44Å
458	M	76.8	Confident	73.8	Confident	10 Å²	10	69.5 Å²	69.5	5%	0.049	36%	0.355	C	S	.	.	H	α-helix	trans	-57.6	-44	173.8	-179.1	-80	-74.1	0	0	111.4	L426 Y454 M455 R460 H462 I466	L426-M458 HydrophobicContact CD1-CE 4.37Å; L426-M458 HydrophobicContact CD1-CG 4.2Å; L426-M458 HydrophobicContact CD1-SD 3.46Å; L426-M458 WeakPolarHBondContact CD1-SD 3.46Å; Y454-M458 HydrophobicContact CE1-CB 4.3Å; Y454-M458 WeakPolarHBondContact O-CB 3.3Å; Y454-M458 PolarHBondContact O-N 3.39Å; M455-M458 HydrophobicContact CE-CE 3.54Å; M455-M458 HydrophobicContact SD-CE 4Å; M458-R460 VanDerWaalsContact C-N 3.32Å; M458-R460 PolarHBondContact O-N 3.46Å; M458-H462 WeakPolarHBondContact O-CA 3.47Å; M458-H462 VanDerWaalsContact O-CB 3.29Å; M458-H462 WeakPolarHBondContact O-CB 3.42Å; M458-H462 PolarHBondContact O-N 2.9Å; M458-I466 HydrophobicContact SD-CD1 3.71Å; M458-I466 HydrophobicContact SD-CG1 4.21Å
459	A	68.3	Low	74.6	Confident	47 Å²	47	67.9 Å²	67.9	39%	0.388	34%	0.344	S	S	.	.	H	α-helix	trans	-64.5	-35.4	176.7	0	0	0	0	0	113	M455 V456 D457	M455-A459 WeakPolarHBondContact O-CB 3.3Å; M455-A459 PolarHBondContact O-N 3.11Å; M455-A459 VanDerWaalsContact O-N 3.08Å; V456-A459 PolarHBondContact O-N 2.9Å; D457-A459 VanDerWaalsContact C-N 3.32Å; D457-A459 PolarHBondContact O-N 3.25Å
460	R	66.1	Low	75.2	Confident	131 Å²	131	56.8 Å²	56.8	49%	0.494	30%	0.302	S	S	.	.	H	α-helix	trans	-76.5	-44.5	179.4	-174.6	-178.8	64.2	-143	-11.7	112.3	V456 D457 M458	V456-R460 PolarHBondContact O-N 2.9Å; D457-R460 PolarHBondContact O-N 3.09Å; D457-R460 VanDerWaalsContact O-N 3.09Å; D457-R460 IonicContact OD1-CZ 2.78Å; D457-R460 IonicContact OD1-NH1 2.77Å; D457-R460 IonicContact OD1-NH2 3.48Å; D457-R460 PolarHBondContact OD1-NH2 3.42Å; M458-R460 VanDerWaalsContact C-N 3.32Å; M458-R460 PolarHBondContact O-N 3.46Å
461	E	71.7	Confident	75.8	Confident	122 Å²	122	58 Å²	58	57%	0.57	30%	0.302	S	S	*	.	H	α-helix	trans	-90	-22.5	-169.5	-67.7	168.7	-160	0	0	112.9	D457	D457-E461 WeakPolarHBondContact O-CB 3.24Å; D457-E461 WeakPolarHBondContact O-CG 3.14Å; D457-E461 PolarHBondContact O-N 3.44Å
462	H	73.9	Confident	76.4	Confident	95 Å²	95	60.1 Å²	60.1	44%	0.44	32%	0.319	S	S	.	.	S	Bend	trans	-114.9	25.2	-179.1	-59.4	-64	0	0	0	113.7	M458 E464 A465 I466	M458-H462 WeakPolarHBondContact O-CA 3.47Å; M458-H462 VanDerWaalsContact O-CB 3.29Å; M458-H462 WeakPolarHBondContact O-CB 3.42Å; M458-H462 PolarHBondContact O-N 2.9Å; H462-E464 VanDerWaalsContact C-N 3.34Å; H462-E464 PolarHBondContact O-N 3.26Å; H462-A465 HydrophobicContact CB-CB 4.34Å; H462-A465 PolarHBondContact O-N 2.85Å; H462-I466 WeakPolarHBondContact O-CG1 3.33Å; H462-I466 PolarHBondContact O-N 3.31Å
463	F	70.3	Confident	77.1	Confident	67 Å²	67	58.7 Å²	58.7	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-51	-48	-179.1	-176.8	-98.3	0	0	0	113.1	L158 A465 I466 M467	L158-F463 WeakPolarHBondContact O-CE2 3.38Å; L158-F463 WeakPolarHBondContact O-CZ 3.49Å; F463-A465 VanDerWaalsContact C-N 3.33Å; F463-A465 PolarHBondContact O-N 3.38Å; F463-I466 WeakPolarHBondContact O-CB 3.37Å; F463-I466 PolarHBondContact O-N 2.97Å; F463-M467 HydrophobicContact CD1-CG 4.08Å; F463-M467 HydrophobicContact CE1-CG 3.68Å; F463-M467 HydrophobicContact CE1-SD 4.44Å; F463-M467 HydrophobicContact CE2-CG 4.28Å; F463-M467 HydrophobicContact CE2-SD 4.38Å; F463-M467 HydrophobicContact CZ-CG 3.79Å; F463-M467 HydrophobicContact CZ-SD 3.98Å; F463-M467 VanDerWaalsContact O-CG 3.29Å; F463-M467 WeakPolarHBondContact O-CG 3.45Å; F463-M467 PolarHBondContact O-N 3.48Å
464	E	70.4	Confident	77.9	Confident	132 Å²	132	57.8 Å²	57.8	62%	0.617	30%	0.296	S	S	*	.	H	α-helix	trans	-61.5	-38.6	178.5	-76.5	-60.3	144.9	0	0	113.2	H462 M467 A468	H462-E464 VanDerWaalsContact C-N 3.34Å; H462-E464 PolarHBondContact O-N 3.26Å; E464-M467 PolarHBondContact O-N 3.36Å; E464-A468 WeakPolarHBondContact O-CB 3.33Å; E464-A468 PolarHBondContact O-N 2.85Å
465	A	78.6	Confident	78	Confident	34 Å²	34	59.1 Å²	59.1	28%	0.281	30%	0.301	S	S	.	.	H	α-helix	trans	-69.8	-40.7	177.6	0	0	0	0	0	111.3	L426 H462 F463 M467 A468 V469	L426-A465 HydrophobicContact CD2-CB 3.53Å; H462-A465 HydrophobicContact CB-CB 4.34Å; H462-A465 PolarHBondContact O-N 2.85Å; F463-A465 VanDerWaalsContact C-N 3.33Å; F463-A465 PolarHBondContact O-N 3.38Å; A465-M467 VanDerWaalsContact C-N 3.33Å; A465-M467 PolarHBondContact O-N 2.91Å; A465-A468 WeakPolarHBondContact O-CB 3.3Å; A465-A468 PolarHBondContact O-N 2.78Å; A465-A468 VanDerWaalsContact O-N 3.16Å; A465-V469 WeakPolarHBondContact O-CG2 3.41Å; A465-V469 PolarHBondContact O-N 3.37Å
466	I	79.8	Confident	78.4	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.051	30%	0.301	C	S	.	.	H	α-helix	trans	-59	-47	173.2	-68.7	167.7	0	0	0	109.9	L426 M430 M458 H462 F463 A468 V469 L470	L426-I466 HydrophobicContact CD1-CG1 4.06Å; L426-I466 HydrophobicContact CD2-CG1 4.12Å; L426-I466 HydrophobicContact CG-CG1 4.43Å; M430-I466 HydrophobicContact CE-CG2 3.94Å; M430-I466 HydrophobicContact SD-CB 4.49Å; M430-I466 HydrophobicContact SD-CG1 4.27Å; M430-I466 HydrophobicContact SD-CG2 4.22Å; M458-I466 HydrophobicContact SD-CD1 3.71Å; M458-I466 HydrophobicContact SD-CG1 4.21Å; H462-I466 WeakPolarHBondContact O-CG1 3.33Å; H462-I466 PolarHBondContact O-N 3.31Å; F463-I466 WeakPolarHBondContact O-CB 3.37Å; F463-I466 PolarHBondContact O-N 2.97Å; I466-A468 VanDerWaalsContact C-N 3.3Å; I466-A468 PolarHBondContact O-N 3.11Å; I466-V469 WeakPolarHBondContact O-CB 3.44Å; I466-V469 PolarHBondContact O-N 3.04Å; I466-L470 HydrophobicContact CG2-CD1 3.58Å; I466-L470 HydrophobicContact CG2-CG 4.45Å; I466-L470 WeakPolarHBondContact O-CD1 3.33Å; I466-L470 VanDerWaalsContact O-CG 3.26Å; I466-L470 WeakPolarHBondContact O-CG 3.48Å; I466-L470 PolarHBondContact O-N 3.32Å
467	M	75.2	Confident	79.3	Confident	15 Å²	15	54.3 Å²	54.3	7%	0.074	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-34.8	176.4	-68.8	-59.4	-70.8	0	0	112.3	L158 F261 F463 E464 A465 R471	L158-M467 HydrophobicContact CB-SD 4.19Å; L158-M467 HydrophobicContact CD2-CE 3.78Å; L158-M467 HydrophobicContact CD2-SD 3.3Å; L158-M467 WeakPolarHBondContact CD2-SD 3.47Å; L158-M467 HydrophobicContact CG-SD 4.37Å; F261-M467 HydrophobicContact CZ-CE 4.49Å; F463-M467 HydrophobicContact CD1-CG 4.08Å; F463-M467 HydrophobicContact CE1-CG 3.68Å; F463-M467 HydrophobicContact CE1-SD 4.44Å; F463-M467 HydrophobicContact CE2-CG 4.28Å; F463-M467 HydrophobicContact CE2-SD 4.38Å; F463-M467 HydrophobicContact CZ-CG 3.79Å; F463-M467 HydrophobicContact CZ-SD 3.98Å; F463-M467 VanDerWaalsContact O-CG 3.29Å; F463-M467 WeakPolarHBondContact O-CG 3.45Å; F463-M467 PolarHBondContact O-N 3.48Å; E464-M467 PolarHBondContact O-N 3.36Å; A465-M467 VanDerWaalsContact C-N 3.33Å; A465-M467 PolarHBondContact O-N 2.91Å; M467-R471 WeakPolarHBondContact O-CB 3.45Å; M467-R471 VanDerWaalsContact O-CG 3.23Å; M467-R471 WeakPolarHBondContact O-CG 3.46Å; M467-R471 PolarHBondContact O-N 3.25Å; M467-R471 PolarHBondContact O-NE 3.31Å; M467-R471 VanDerWaalsContact O-NE 3.11Å
468	A	82.4	Confident	79.8	Confident	49 Å²	49	51.9 Å²	51.9	41%	0.405	26%	0.261	S	S	.	.	H	α-helix	trans	-65.9	-42.3	173.4	0	0	0	0	0	112.1	E464 A465 I466 A472	E464-A468 WeakPolarHBondContact O-CB 3.33Å; E464-A468 PolarHBondContact O-N 2.85Å; A465-A468 WeakPolarHBondContact O-CB 3.3Å; A465-A468 PolarHBondContact O-N 2.78Å; A465-A468 VanDerWaalsContact O-N 3.16Å; I466-A468 VanDerWaalsContact C-N 3.3Å; I466-A468 PolarHBondContact O-N 3.11Å; A468-A472 WeakPolarHBondContact O-CB 3.36Å; A468-A472 PolarHBondContact O-N 3.4Å; A468-A472 VanDerWaalsContact O-N 3.16Å
469	V	87.4	Confident	80.1	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-50.3	173.8	169.4	0	0	0	0	110.5	V421 D423 L426 F427 M430 A465 I466 R471 A472 L473	V421-V469 HydrophobicContact CG1-CB 4.28Å; V421-V469 HydrophobicContact CG1-CG1 3.95Å; V421-V469 HydrophobicContact CG1-CG2 3.83Å; V421-V469 HydrophobicContact CG2-CG1 4.17Å; D423-V469 HydrophobicContact CB-CG2 4.39Å; L426-V469 HydrophobicContact CD2-CG2 4Å; L426-V469 HydrophobicContact CG-CG2 4.3Å; F427-V469 HydrophobicContact CB-CG1 4Å; F427-V469 HydrophobicContact CD2-CG1 3.86Å; F427-V469 HydrophobicContact CG-CG1 4.16Å; M430-V469 HydrophobicContact CE-CB 4.38Å; M430-V469 HydrophobicContact CE-CG1 3.93Å; M430-V469 HydrophobicContact SD-CB 4.07Å; M430-V469 HydrophobicContact SD-CG1 3.8Å; M430-V469 HydrophobicContact SD-CG2 4.41Å; A465-V469 WeakPolarHBondContact O-CG2 3.41Å; A465-V469 PolarHBondContact O-N 3.37Å; I466-V469 WeakPolarHBondContact O-CB 3.44Å; I466-V469 PolarHBondContact O-N 3.04Å; V469-R471 VanDerWaalsContact C-N 3.34Å; V469-R471 PolarHBondContact O-N 3.47Å; V469-A472 PolarHBondContact O-N 3.18Å; V469-A472 VanDerWaalsContact O-N 3.09Å; V469-L473 HydrophobicContact CG1-CD1 4.3Å; V469-L473 WeakPolarHBondContact O-CG 3.38Å; V469-L473 PolarHBondContact O-N 2.74Å
470	L	84.3	Confident	81.1	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-35.9	-175.7	-64.8	160.9	0	0	0	112.7	H157 L158 M430 I466 A472 L473 L478 L481	H157-L470 WeakPolarHBondContact CD2-CD1 3.22Å; L158-L470 HydrophobicContact CD2-CB 3.98Å; L158-L470 HydrophobicContact CD2-CD1 3.2Å; L158-L470 HydrophobicContact CD2-CG 4.14Å; L158-L470 HydrophobicContact CG-CD1 4.15Å; M430-L470 HydrophobicContact CE-CD1 4.04Å; M430-L470 HydrophobicContact CE-CD2 3.56Å; M430-L470 HydrophobicContact CE-CG 3.68Å; I466-L470 HydrophobicContact CG2-CD1 3.58Å; I466-L470 HydrophobicContact CG2-CG 4.45Å; I466-L470 WeakPolarHBondContact O-CD1 3.33Å; I466-L470 VanDerWaalsContact O-CG 3.26Å; I466-L470 WeakPolarHBondContact O-CG 3.48Å; I466-L470 PolarHBondContact O-N 3.32Å; L470-A472 VanDerWaalsContact C-N 3.3Å; L470-A472 PolarHBondContact O-N 3.06Å; L470-L473 HydrophobicContact CD2-CD1 4.31Å; L470-L478 HydrophobicContact CB-CD2 4.19Å; L470-L478 HydrophobicContact CD2-CD2 3.68Å; L470-L481 HydrophobicContact CD2-CD1 3.7Å
471	R	82.6	Confident	82.1	Confident	136 Å²	136	44.1 Å²	44.1	51%	0.513	22%	0.223	S	C	.	.	H	α-helix	trans	-67.1	-30.1	173.6	-77.1	-178.5	-71.2	-166.9	-3.5	113	M467 V469	M467-R471 WeakPolarHBondContact O-CB 3.45Å; M467-R471 VanDerWaalsContact O-CG 3.23Å; M467-R471 WeakPolarHBondContact O-CG 3.46Å; M467-R471 PolarHBondContact O-N 3.25Å; M467-R471 PolarHBondContact O-NE 3.31Å; M467-R471 VanDerWaalsContact O-NE 3.11Å; V469-R471 VanDerWaalsContact C-N 3.34Å; V469-R471 PolarHBondContact O-N 3.47Å
472	A	88.5	Confident	82.7	Confident	45 Å²	45	39.8 Å²	39.8	37%	0.372	20%	0.201	S	C	.	.	H	α-helix	trans	-82.9	-22.1	-177.5	0	0	0	0	0	113.5	G420 V421 A468 V469 L470	G420-A472 WeakPolarHBondContact O-CB 3.24Å; V421-A472 HydrophobicContact CG2-CB 4.42Å; A468-A472 WeakPolarHBondContact O-CB 3.36Å; A468-A472 PolarHBondContact O-N 3.4Å; A468-A472 VanDerWaalsContact O-N 3.16Å; V469-A472 PolarHBondContact O-N 3.18Å; V469-A472 VanDerWaalsContact O-N 3.09Å; L470-A472 VanDerWaalsContact C-N 3.3Å; L470-A472 PolarHBondContact O-N 3.06Å
473	L	88.9	Confident	83.5	Confident	11 Å²	11	35.3 Å²	35.3	6%	0.058	18%	0.18	C	C	.	.	S	Bend	trans	-69.1	149.2	-177.1	-77.4	171.5	0	0	0	113.1	L419 V421 F427 V469 L470 R475 M477 L481	L419-L473 HydrophobicContact CB-CD2 4.33Å; V421-L473 HydrophobicContact CG2-CD2 3.49Å; V421-L473 VanDerWaalsContact CG2-CD2 3.49Å; V421-L473 HydrophobicContact CG2-CG 3.82Å; F427-L473 HydrophobicContact CD2-CD1 4.36Å; F427-L473 HydrophobicContact CD2-CD2 4.39Å; F427-L473 HydrophobicContact CE1-CD2 4.08Å; F427-L473 HydrophobicContact CE2-CD1 3.86Å; F427-L473 HydrophobicContact CE2-CD2 3.69Å; F427-L473 HydrophobicContact CE2-CG 4.36Å; F427-L473 HydrophobicContact CZ-CD2 3.51Å; V469-L473 HydrophobicContact CG1-CD1 4.3Å; V469-L473 WeakPolarHBondContact O-CG 3.38Å; V469-L473 PolarHBondContact O-N 2.74Å; L470-L473 HydrophobicContact CD2-CD1 4.31Å; L473-R475 PolarHBondContact O-N 3.04Å; L473-M477 HydrophobicContact CB-CB 4.15Å; L473-M477 HydrophobicContact CD1-CB 4.39Å; L473-M477 HydrophobicContact CD2-CB 4.21Å; L473-M477 HydrophobicContact CD2-CG 4.39Å; L473-M477 HydrophobicContact CG-CB 4.49Å; L473-L481 HydrophobicContact CD1-CD1 4.02Å
474	P	88.9	Confident	84.4	Confident	28 Å²	28	32.1 Å²	32.1	18%	0.182	17%	0.167	C	C	.	.			trans	-54.8	138.1	164.4	-23	31.8	0	0	0	110.6	L419 P476 M477	L419-P474 HydrophobicContact CD2-CG 4.29Å; L419-P474 WeakPolarHBondContact O-CD 3.49Å; P474-P476 VanDerWaalsContact C-CD 3.44Å; P474-P476 VanDerWaalsContact C-N 3.33Å; P474-P476 VanDerWaalsContact O-N 3.16Å; P474-M477 HydrophobicContact CB-CG 4.19Å; P474-M477 HydrophobicContact CG-CG 4.2Å; P474-M477 VanDerWaalsContact O-CB 3.23Å; P474-M477 WeakPolarHBondContact O-CB 3.42Å; P474-M477 PolarHBondContact O-N 3.46Å
475	R	81.9	Confident	85.2	Confident	119 Å²	119	27.4 Å²	27.4	45%	0.449	15%	0.146	S	C	.	.	H	α-helix	trans	-49.3	-44.5	-177.4	-64	-73.7	175.6	-167.9	-7.1	114	W263 D267 L473 M477 L478	W263-R475 VanDerWaalsContact CZ3-NH1 3.31Å; D267-R475 WeakPolarHBondContact OD2-CD 3.48Å; D267-R475 IonicContact OD2-CZ 2.77Å; D267-R475 IonicContact OD2-NE 2.69Å; D267-R475 IonicContact OD2-NH1 2.7Å; D267-R475 PolarHBondContact OD2-NH1 2.88Å; L473-R475 PolarHBondContact O-N 3.04Å; R475-M477 PolarHBondContact O-N 2.89Å; R475-M477 VanDerWaalsContact O-N 3.16Å; R475-L478 PolarHBondContact O-N 2.86Å
476	P	87.1	Confident	85.5	Confident	26 Å²	26	26.5 Å²	26.5	17%	0.169	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-23.5	178.1	-23.8	35.9	0	0	0	114.2	Q387 F388 L389 P474 L478 L479 V480	Q387-P476 HydrophobicContact CB-CB 4.46Å; F388-P476 WeakPolarHBondContact O-CG 3.49Å; L389-P476 HydrophobicContact CD1-CB 4.16Å; P474-P476 VanDerWaalsContact C-CD 3.44Å; P474-P476 VanDerWaalsContact C-N 3.33Å; P474-P476 VanDerWaalsContact O-N 3.16Å; P476-L478 VanDerWaalsContact C-N 3.3Å; P476-L478 PolarHBondContact O-N 3.22Å; P476-L479 PolarHBondContact O-N 3.03Å; P476-V480 PolarHBondContact O-N 3.32Å; P476-V480 VanDerWaalsContact O-N 3.1Å
477	M	89.3	Confident	86.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-28.2	179.8	-74.1	-60.6	-54.3	0	0	113.2	L389 L397 L419 F427 L473 P474 R475 L479 V480 L481	L389-M477 HydrophobicContact CD1-CG 4.23Å; L389-M477 HydrophobicContact CD1-SD 3.85Å; L389-M477 HydrophobicContact CD2-SD 4.16Å; L397-M477 HydrophobicContact CD1-CE 3.85Å; L397-M477 HydrophobicContact CD2-CE 4.04Å; L397-M477 HydrophobicContact CD2-SD 3.99Å; L397-M477 HydrophobicContact CG-CE 4.45Å; L419-M477 HydrophobicContact CD2-CG 4.41Å; L419-M477 HydrophobicContact CD2-SD 4.48Å; F427-M477 HydrophobicContact CZ-CE 4.27Å; L473-M477 HydrophobicContact CB-CB 4.15Å; L473-M477 HydrophobicContact CD1-CB 4.39Å; L473-M477 HydrophobicContact CD2-CB 4.21Å; L473-M477 HydrophobicContact CD2-CG 4.39Å; L473-M477 HydrophobicContact CG-CB 4.49Å; P474-M477 HydrophobicContact CB-CG 4.19Å; P474-M477 HydrophobicContact CG-CG 4.2Å; P474-M477 VanDerWaalsContact O-CB 3.23Å; P474-M477 WeakPolarHBondContact O-CB 3.42Å; P474-M477 PolarHBondContact O-N 3.46Å; R475-M477 PolarHBondContact O-N 2.89Å; R475-M477 VanDerWaalsContact O-N 3.16Å; M477-L479 PolarHBondContact O-N 3.23Å; M477-V480 HydrophobicContact CE-CB 4.15Å; M477-V480 HydrophobicContact CE-CG1 4.06Å; M477-V480 WeakPolarHBondContact O-CB 3.22Å; M477-V480 PolarHBondContact O-N 3.46Å; M477-V480 HydrophobicContact SD-CB 4.26Å; M477-V480 HydrophobicContact SD-CG2 4.06Å; M477-L481 WeakPolarHBondContact O-CG 3.5Å; M477-L481 PolarHBondContact O-N 3.25Å
478	L	83.4	Confident	86.7	Confident	6 Å²	6	28.7 Å²	28.7	3%	0.031	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-37.5	173.9	-61.3	178.8	0	0	0	111	F155 W263 L470 R475 P476 L481 R482	F155-L478 HydrophobicContact CE1-CD1 4.36Å; W263-L478 HydrophobicContact CH2-CD1 4.05Å; W263-L478 HydrophobicContact CZ3-CD1 3.64Å; L470-L478 HydrophobicContact CB-CD2 4.19Å; L470-L478 HydrophobicContact CD2-CD2 3.68Å; R475-L478 PolarHBondContact O-N 2.86Å; P476-L478 VanDerWaalsContact C-N 3.3Å; P476-L478 PolarHBondContact O-N 3.22Å; L478-L481 PolarHBondContact O-N 3.49Å; L478-R482 PolarHBondContact O-N 3.37Å; L478-R482 VanDerWaalsContact O-N 3.09Å
479	L	82.4	Confident	86.9	Confident	15 Å²	15	28.5 Å²	28.5	8%	0.079	14%	0.142	C	C	.	.	H	α-helix	trans	-80.1	-26.4	178.3	-66.6	176	0	0	0	112.7	S359 L385 Q387 P476 M477 R482 N483	S359-L479 WeakPolarHBondContact OG-CB 3.44Å; L385-L479 HydrophobicContact CD2-CD2 4.28Å; Q387-L479 HydrophobicContact CB-CD1 4.46Å; Q387-L479 HydrophobicContact CG-CD1 3.36Å; P476-L479 PolarHBondContact O-N 3.03Å; M477-L479 PolarHBondContact O-N 3.23Å; L479-R482 PolarHBondContact O-N 2.83Å; L479-N483 PolarHBondContact O-N 3.49Å
480	V	89.6	Confident	87	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-48.1	164.8	174.2	0	0	0	0	110.5	I351 I357 L397 P476 M477 R482 N483 I484	I351-V480 HydrophobicContact CD1-CG1 4.44Å; I351-V480 HydrophobicContact CG2-CG1 4.09Å; I357-V480 HydrophobicContact CD1-CG2 3.53Å; I357-V480 HydrophobicContact CG1-CG2 4.43Å; L397-V480 HydrophobicContact CD2-CG1 4.06Å; P476-V480 PolarHBondContact O-N 3.32Å; P476-V480 VanDerWaalsContact O-N 3.1Å; M477-V480 HydrophobicContact CE-CB 4.15Å; M477-V480 HydrophobicContact CE-CG1 4.06Å; M477-V480 WeakPolarHBondContact O-CB 3.22Å; M477-V480 PolarHBondContact O-N 3.46Å; M477-V480 HydrophobicContact SD-CB 4.26Å; M477-V480 HydrophobicContact SD-CG2 4.06Å; V480-R482 VanDerWaalsContact C-N 3.28Å; V480-R482 PolarHBondContact O-N 2.75Å; V480-N483 PolarHBondContact O-N 3.33Å; V480-I484 HydrophobicContact CG1-CD1 3.68Å; V480-I484 HydrophobicContact CG1-CG1 4.28Å; V480-I484 VanDerWaalsContact O-CG1 3.25Å; V480-I484 WeakPolarHBondContact O-CG1 3.29Å; V480-I484 PolarHBondContact O-N 2.74Å
481	L	87.7	Confident	87.3	Confident	10 Å²	10	28.3 Å²	28.3	5%	0.052	14%	0.141	C	C	.	.	H	α-helix	trans	-58.8	-41.4	177.4	-69.1	174.7	0	0	0	111.5	L431 L470 L473 M477 L478 I484 N485	L431-L481 HydrophobicContact CB-CD2 4.43Å; L431-L481 HydrophobicContact CD1-CD2 3.86Å; L470-L481 HydrophobicContact CD2-CD1 3.7Å; L473-L481 HydrophobicContact CD1-CD1 4.02Å; M477-L481 WeakPolarHBondContact O-CG 3.5Å; M477-L481 PolarHBondContact O-N 3.25Å; L478-L481 PolarHBondContact O-N 3.49Å; L481-I484 PolarHBondContact O-N 3.37Å; L481-N485 WeakPolarHBondContact O-CB 3.38Å; L481-N485 PolarHBondContact O-N 3.25Å
482	R	83.9	Confident	87.5	Confident	30 Å²	30	24.6 Å²	24.6	11%	0.113	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-52.2	173	-176.6	179.8	174.8	170.4	2	111.8	S154 S359 D360 L478 L479 V480 I484 N485 T486	S154-R482 PolarHBondContact OG-NE 3.29Å; S154-R482 PolarHBondContact OG-NH1 2.88Å; S154-R482 PolarHBondContact OG-NH2 3.33Å; S359-R482 WeakPolarHBondContact O-CD 3.36Å; S359-R482 WeakPolarHBondContact O-CG 3.38Å; S359-R482 PolarHBondContact O-NE 3.09Å; D360-R482 IonicContact OD1-CZ 2.9Å; D360-R482 IonicContact OD1-NE 3.81Å; D360-R482 PolarHBondContact OD1-NE 3.25Å; D360-R482 IonicContact OD1-NH2 3.65Å; D360-R482 PolarHBondContact OD1-NH2 3.3Å; D360-R482 IonicContact OD2-CZ 3.5Å; D360-R482 IonicContact OD2-NH2 2.69Å; D360-R482 PolarHBondContact OD2-NH2 3.27Å; L478-R482 PolarHBondContact O-N 3.37Å; L478-R482 VanDerWaalsContact O-N 3.09Å; L479-R482 PolarHBondContact O-N 2.83Å; V480-R482 VanDerWaalsContact C-N 3.28Å; V480-R482 PolarHBondContact O-N 2.75Å; R482-I484 VanDerWaalsContact C-N 3.32Å; R482-I484 PolarHBondContact O-N 2.92Å; R482-N485 WeakPolarHBondContact O-CB 3.25Å; R482-N485 PolarHBondContact O-N 3.48Å; R482-T486 PolarHBondContact O-N 2.84Å; R482-T486 PolarHBondContact O-OG1 3.32Å; R482-T486 VanDerWaalsContact O-OG1 3.09Å
483	N	90.6	Very high	87.4	Confident	1 Å²	1	25 Å²	25	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-54.7	-49.4	178.1	178.1	-70.2	0	0	0	111.1	F347 I351 I357 H358 L479 V480 N485 T486 V487	F347-N483 WeakPolarHBondContact CD1-ND2 3.39Å; I351-N483 HydrophobicContact CD1-CB 4.49Å; I351-N483 WeakPolarHBondContact CD1-OD1 3.21Å; I357-N483 HydrophobicContact CG2-CB 4.36Å; H358-N483 PolarHBondContact O-ND2 3.05Å; L479-N483 PolarHBondContact O-N 3.49Å; V480-N483 PolarHBondContact O-N 3.33Å; N483-N485 VanDerWaalsContact C-N 3.31Å; N483-N485 PolarHBondContact O-N 3.16Å; N483-T486 PolarHBondContact O-N 3.33Å; N483-T486 VanDerWaalsContact O-N 3.15Å; N483-V487 WeakPolarHBondContact O-CG2 3.33Å; N483-V487 PolarHBondContact O-N 3Å
484	I	90.2	Very high	87.4	Confident	1 Å²	1	25 Å²	25	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-41.5	-179.2	-65.8	175.1	0	0	0	111.1	I351 W401 L431 V480 L481 R482 R488 M504	I351-I484 HydrophobicContact CD1-CD1 4.45Å; I351-I484 HydrophobicContact CD1-CG1 3.9Å; W401-I484 HydrophobicContact CH2-CD1 4.2Å; W401-I484 HydrophobicContact CH2-CG2 4.46Å; W401-I484 HydrophobicContact CZ3-CD1 3.76Å; L431-I484 HydrophobicContact CD1-CD1 3.63Å; V480-I484 HydrophobicContact CG1-CD1 3.68Å; V480-I484 HydrophobicContact CG1-CG1 4.28Å; V480-I484 VanDerWaalsContact O-CG1 3.25Å; V480-I484 WeakPolarHBondContact O-CG1 3.29Å; V480-I484 PolarHBondContact O-N 2.74Å; L481-I484 PolarHBondContact O-N 3.37Å; R482-I484 VanDerWaalsContact C-N 3.32Å; R482-I484 PolarHBondContact O-N 2.92Å; I484-R488 WeakPolarHBondContact O-CB 3.33Å; I484-R488 PolarHBondContact O-N 2.88Å; I484-M504 HydrophobicContact CD1-CE 4.05Å; I484-M504 HydrophobicContact CG1-CE 3.84Å
485	N	86	Confident	87.2	Confident	33 Å²	33	26.3 Å²	26.3	18%	0.176	16%	0.155	C	C	.	.	H	α-helix	trans	-61.6	-45.7	175.3	-174	47	0	0	0	112.1	N156 Q433 L481 R482 N483 R488 A489	N156-N485 PolarHBondContact ND2-ND2 3.04Å; Q433-N485 PolarHBondContact OE1-OD1 3.26Å; L481-N485 WeakPolarHBondContact O-CB 3.38Å; L481-N485 PolarHBondContact O-N 3.25Å; R482-N485 WeakPolarHBondContact O-CB 3.25Å; R482-N485 PolarHBondContact O-N 3.48Å; N483-N485 VanDerWaalsContact C-N 3.31Å; N483-N485 PolarHBondContact O-N 3.16Å; N485-R488 WeakPolarHBondContact O-CB 3.44Å; N485-R488 PolarHBondContact O-N 3.34Å; N485-R488 PolarHBondContact OD1-NH2 2.89Å; N485-A489 WeakPolarHBondContact O-CB 3.42Å; N485-A489 PolarHBondContact O-N 3.43Å
486	T	86.3	Confident	87.3	Confident	15 Å²	15	20.9 Å²	20.9	9%	0.092	14%	0.135	C	C	.	.	H	α-helix	trans	-67.1	-42.4	-179.3	-54.8	0	0	0	0	111.6	P361 R482 N483 R488 A489 I490	P361-T486 VanDerWaalsContact C-CG2 3.45Å; P361-T486 HydrophobicContact CG-CG2 3.91Å; P361-T486 WeakPolarHBondContact O-CG2 3.39Å; R482-T486 PolarHBondContact O-N 2.84Å; R482-T486 PolarHBondContact O-OG1 3.32Å; R482-T486 VanDerWaalsContact O-OG1 3.09Å; N483-T486 PolarHBondContact O-N 3.33Å; N483-T486 VanDerWaalsContact O-N 3.15Å; T486-R488 VanDerWaalsContact C-N 3.33Å; T486-R488 PolarHBondContact O-N 3.09Å; T486-A489 PolarHBondContact O-N 3.18Å; T486-I490 HydrophobicContact CG2-CD1 4.3Å; T486-I490 WeakPolarHBondContact O-CG1 3.49Å; T486-I490 PolarHBondContact O-N 3.08Å
487	V	90.9	Very high	87.1	Confident	4 Å²	4	21.3 Å²	21.3	2%	0.024	14%	0.138	C	C	.	.	H	α-helix	trans	-61.8	-41.6	173.9	172.6	0	0	0	0	110.9	I344 F347 P361 N483 N491	I344-V487 HydrophobicContact CG1-CG1 3.83Å; F347-V487 HydrophobicContact CB-CG2 3.87Å; F347-V487 HydrophobicContact CD2-CG2 3.64Å; F347-V487 HydrophobicContact CE2-CG2 4.44Å; F347-V487 HydrophobicContact CG-CG2 3.85Å; P361-V487 HydrophobicContact CG-CG2 4.28Å; N483-V487 WeakPolarHBondContact O-CG2 3.33Å; N483-V487 PolarHBondContact O-N 3Å; V487-N491 WeakPolarHBondContact O-CB 3.35Å; V487-N491 PolarHBondContact O-N 2.89Å
488	R	88.8	Confident	87	Confident	67 Å²	67	21.7 Å²	21.7	25%	0.253	14%	0.141	S	C	.	.	H	α-helix	trans	-60.3	-48.5	172.9	-179.1	-168	62.7	88.5	3	110.9	I484 N485 T486 I490 N491 V492	I484-R488 WeakPolarHBondContact O-CB 3.33Å; I484-R488 PolarHBondContact O-N 2.88Å; N485-R488 WeakPolarHBondContact O-CB 3.44Å; N485-R488 PolarHBondContact O-N 3.34Å; N485-R488 PolarHBondContact OD1-NH2 2.89Å; T486-R488 VanDerWaalsContact C-N 3.33Å; T486-R488 PolarHBondContact O-N 3.09Å; R488-I490 VanDerWaalsContact C-N 3.33Å; R488-I490 PolarHBondContact O-N 3.38Å; R488-N491 PolarHBondContact O-N 3.37Å; R488-V492 HydrophobicContact CG-CG2 4.28Å; R488-V492 WeakPolarHBondContact O-CG2 3.23Å; R488-V492 PolarHBondContact O-N 3.29Å
489	A	85.6	Confident	87	Confident	44 Å²	44	23.2 Å²	23.2	36%	0.364	15%	0.149	S	C	.	.	H	α-helix	trans	-59.5	-42.7	-178.6	0	0	0	0	0	111.9	N485 T486 V492 A493	N485-A489 WeakPolarHBondContact O-CB 3.42Å; N485-A489 PolarHBondContact O-N 3.43Å; T486-A489 PolarHBondContact O-N 3.18Å; A489-V492 PolarHBondContact O-N 2.96Å; A489-A493 WeakPolarHBondContact O-CB 3.39Å; A489-A493 PolarHBondContact O-N 3.47Å
490	I	89.3	Confident	87.4	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.3	-47.3	174.1	-65.8	162.5	0	0	0	110.8	V323 L343 P361 P363 T486 R488 V492 A493 L494	V323-I490 HydrophobicContact CB-CG2 4.45Å; V323-I490 HydrophobicContact CG1-CD1 4.06Å; V323-I490 HydrophobicContact CG1-CG1 4.15Å; V323-I490 HydrophobicContact CG1-CG2 3.82Å; V323-I490 HydrophobicContact CG2-CG2 3.79Å; L343-I490 HydrophobicContact CD2-CB 3.9Å; L343-I490 HydrophobicContact CD2-CD1 4.08Å; L343-I490 HydrophobicContact CD2-CG2 3.44Å; L343-I490 VanDerWaalsContact CD2-CG2 3.44Å; P361-I490 VanDerWaalsContact O-CD1 3.28Å; P361-I490 WeakPolarHBondContact O-CD1 3.33Å; P363-I490 HydrophobicContact CB-CG1 4.43Å; P363-I490 HydrophobicContact CG-CD1 4.35Å; P363-I490 HydrophobicContact CG-CG1 3.78Å; T486-I490 HydrophobicContact CG2-CD1 4.3Å; T486-I490 WeakPolarHBondContact O-CG1 3.49Å; T486-I490 PolarHBondContact O-N 3.08Å; R488-I490 VanDerWaalsContact C-N 3.33Å; R488-I490 PolarHBondContact O-N 3.38Å; I490-V492 VanDerWaalsContact C-N 3.27Å; I490-V492 PolarHBondContact O-N 2.94Å; I490-A493 PolarHBondContact O-N 3.41Å; I490-L494 HydrophobicContact CG2-CD1 4.15Å; I490-L494 HydrophobicContact CG2-CG 4.42Å; I490-L494 WeakPolarHBondContact O-CB 3.18Å; I490-L494 WeakPolarHBondContact O-CG 3.33Å; I490-L494 PolarHBondContact O-N 3.47Å
491	N	90.8	Very high	87.3	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-58.5	-41.1	178.1	-170.1	51.4	0	0	0	111.6	V487 R488 L494 G495 A496 V498	V487-N491 WeakPolarHBondContact O-CB 3.35Å; V487-N491 PolarHBondContact O-N 2.89Å; R488-N491 PolarHBondContact O-N 3.37Å; N491-L494 WeakPolarHBondContact O-CB 3.34Å; N491-L494 PolarHBondContact O-N 2.95Å; N491-G495 PolarHBondContact O-N 2.92Å; N491-A496 WeakPolarHBondContact O-CA 3.33Å; N491-A496 PolarHBondContact O-N 2.91Å; N491-V498 PolarHBondContact ND2-O 3.48Å; N491-V498 VanDerWaalsContact ND2-O 3.15Å
492	V	86.9	Confident	87	Confident	59 Å²	59	25.4 Å²	25.4	36%	0.358	16%	0.157	S	C	.	.	H	α-helix	trans	-65.5	-44.7	175.8	172	0	0	0	0	111.5	L446 R488 A489 I490 L494 G495	L446-V492 HydrophobicContact CD2-CG1 4.11Å; L446-V492 HydrophobicContact CD2-CG2 4.1Å; R488-V492 HydrophobicContact CG-CG2 4.28Å; R488-V492 WeakPolarHBondContact O-CG2 3.23Å; R488-V492 PolarHBondContact O-N 3.29Å; A489-V492 PolarHBondContact O-N 2.96Å; I490-V492 VanDerWaalsContact C-N 3.27Å; I490-V492 PolarHBondContact O-N 2.94Å; V492-L494 PolarHBondContact O-N 2.91Å; V492-G495 WeakPolarHBondContact O-CA 3.33Å; V492-G495 PolarHBondContact O-N 3.4Å
493	A	86.6	Confident	87.2	Confident	53 Å²	53	25 Å²	25	44%	0.438	16%	0.157	S	C	.	.	H	α-helix	trans	-59.8	-30.4	176.3	0	0	0	0	0	112.5	N324 A489 I490 G495	N324-A493 HydrophobicContact CB-CB 4.24Å; A489-A493 WeakPolarHBondContact O-CB 3.39Å; A489-A493 PolarHBondContact O-N 3.47Å; I490-A493 PolarHBondContact O-N 3.41Å; A493-G495 PolarHBondContact O-N 3.05Å
494	L	88.9	Confident	87.3	Confident	11 Å²	11	25.2 Å²	25.2	6%	0.058	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1.4	173.4	-71.7	-175.7	0	0	0	114	V323 V326 I329 V336 I339 A340 I490 N491 V492	V323-L494 WeakPolarHBondContact O-CD2 3.32Å; V326-L494 HydrophobicContact CG2-CD2 4.01Å; I329-L494 HydrophobicContact CD1-CD2 4.05Å; V336-L494 HydrophobicContact CG1-CB 3.47Å; V336-L494 VanDerWaalsContact CG1-CB 3.47Å; V336-L494 HydrophobicContact CG1-CD1 4.19Å; V336-L494 HydrophobicContact CG1-CD2 3.68Å; V336-L494 HydrophobicContact CG1-CG 3.95Å; V336-L494 WeakPolarHBondContact CG1-O 3.41Å; I339-L494 HydrophobicContact CG2-CD1 4Å; A340-L494 HydrophobicContact CB-CD1 3.99Å; I490-L494 HydrophobicContact CG2-CD1 4.15Å; I490-L494 HydrophobicContact CG2-CG 4.42Å; I490-L494 WeakPolarHBondContact O-CB 3.18Å; I490-L494 WeakPolarHBondContact O-CG 3.33Å; I490-L494 PolarHBondContact O-N 3.47Å; N491-L494 WeakPolarHBondContact O-CB 3.34Å; N491-L494 PolarHBondContact O-N 2.95Å; V492-L494 PolarHBondContact O-N 2.91Å
495	G	85.8	Confident	87.2	Confident	55 Å²	55	25.2 Å²	25.2	57%	0.567	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.6	20.7	-177.5	0	0	0	0	0	114.3	N491 V492 A493	N491-G495 PolarHBondContact O-N 2.92Å; V492-G495 WeakPolarHBondContact O-CA 3.33Å; V492-G495 PolarHBondContact O-N 3.4Å; A493-G495 PolarHBondContact O-N 3.05Å
496	A	83.2	Confident	87.3	Confident	5 Å²	5	26.6 Å²	26.6	4%	0.041	16%	0.162	C	C	.	.			trans	46.6	55	-178.2	0	0	0	0	0	113.9	H445 L446 N491 V498	H445-A496 HydrophobicContact CB-CB 3.68Å; H445-A496 VanDerWaalsContact CB-O 3.27Å; H445-A496 WeakPolarHBondContact CB-O 3.31Å; H445-A496 PolarHBondContact ND1-O 3.12Å; L446-A496 HydrophobicContact CD2-CB 3.61Å; L446-A496 HydrophobicContact CG-CB 3.78Å; N491-A496 WeakPolarHBondContact O-CA 3.33Å; N491-A496 PolarHBondContact O-N 2.91Å; A496-V498 PolarHBondContact O-N 3.37Å; A496-V498 VanDerWaalsContact O-N 3.13Å
497	P	83.8	Confident	87.5	Confident	35 Å²	35	27.5 Å²	27.5	23%	0.227	16%	0.164	C	C	.	.			trans	-71.5	-7.9	-174.5	32	-39.8	0	0	0	114.2	V336 K337 A340	V336-P497 HydrophobicContact CG1-CG 4.15Å; K337-P497 HydrophobicContact CB-CB 4.01Å; K337-P497 HydrophobicContact CG-CB 4.29Å; A340-P497 HydrophobicContact CB-CG 3.59Å
498	V	85.4	Confident	87.6	Confident	9 Å²	9	27.3 Å²	27.3	6%	0.055	16%	0.163	C	C	.	.	S	Bend	trans	-140.3	139.4	-167.8	179	0	0	0	0	111.2	K337 A340 E341 I344 H445 N491 A496 R500 L503	K337-V498 HydrophobicContact CG-CG2 3.82Å; A340-V498 HydrophobicContact CB-CB 4.38Å; A340-V498 HydrophobicContact CB-CG2 3.84Å; E341-V498 HydrophobicContact CB-CG2 4.45Å; E341-V498 HydrophobicContact CG-CB 4.41Å; E341-V498 HydrophobicContact CG-CG1 3.94Å; E341-V498 HydrophobicContact CG-CG2 3.47Å; E341-V498 VanDerWaalsContact CG-CG2 3.47Å; I344-V498 HydrophobicContact CD1-CB 4.23Å; I344-V498 HydrophobicContact CD1-CG1 4Å; H445-V498 PolarHBondContact ND1-N 2.92Å; N491-V498 PolarHBondContact ND2-O 3.48Å; N491-V498 VanDerWaalsContact ND2-O 3.15Å; A496-V498 PolarHBondContact O-N 3.37Å; A496-V498 VanDerWaalsContact O-N 3.13Å; V498-R500 PolarHBondContact O-N 2.95Å; V498-R500 VanDerWaalsContact O-N 3.13Å; V498-L503 HydrophobicContact CG1-CD1 3.27Å; V498-L503 HydrophobicContact CG1-CG 4.07Å
499	D	85.3	Confident	87.6	Confident	37 Å²	37	24.3 Å²	24.3	20%	0.198	15%	0.152	C	C	.	.			trans	-73.2	97.2	167.4	-177.7	-6.7	0	0	0	110.5	Y501 F502 L503	D499-Y501 VanDerWaalsContact C-N 3.3Å; D499-Y501 PolarHBondContact O-N 3.49Å; D499-Y501 WeakPolarHBondContact OD1-CB 3.27Å; D499-Y501 PolarHBondContact OD1-N 2.7Å; D499-F502 HydrophobicContact CB-CB 4.32Å; D499-F502 PolarHBondContact OD1-N 3.25Å; D499-F502 VanDerWaalsContact OD1-N 3.15Å; D499-F502 VanDerWaalsContact OD2-CB 3.31Å; D499-F502 WeakPolarHBondContact OD2-CB 3.33Å; D499-L503 PolarHBondContact O-N 2.85Å
500	R	89.1	Confident	87.6	Confident	8 Å²	8	26.3 Å²	26.3	3%	0.03	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-34.9	177.9	72	-179.4	-178.9	99.4	-7.1	112.5	I344 M432 V498 L503 M504	I344-R500 HydrophobicContact CD1-CB 3.76Å; I344-R500 HydrophobicContact CG1-CB 4.35Å; I344-R500 HydrophobicContact CG2-CB 4.37Å; M432-R500 PolarHBondContact O-NH2 3.44Å; V498-R500 PolarHBondContact O-N 2.95Å; V498-R500 VanDerWaalsContact O-N 3.13Å; R500-L503 PolarHBondContact O-N 3.35Å; R500-M504 VanDerWaalsContact O-CB 3.26Å; R500-M504 WeakPolarHBondContact O-CB 3.23Å; R500-M504 WeakPolarHBondContact O-CG 3.34Å; R500-M504 PolarHBondContact O-N 2.86Å
501	Y	87.5	Confident	87.5	Confident	15 Å²	15	26.3 Å²	26.3	6%	0.059	15%	0.15	C	C	.	.	H	α-helix	trans	-65.9	-46.5	-172.7	-57.8	-67.1	0	0	0	110.1	W401 M432 R434 D499 M504 A505	W401-Y501 HydrophobicContact CZ2-CD1 4.32Å; W401-Y501 PolarHBondContact NE1-O 3.22Å; W401-Y501 VanDerWaalsContact NE1-O 3.09Å; M432-Y501 HydrophobicContact CB-CE1 4.24Å; M432-Y501 HydrophobicContact CE-CD1 3.15Å; M432-Y501 HydrophobicContact CE-CE1 3.74Å; M432-Y501 HydrophobicContact CE-CG 3.75Å; M432-Y501 VanDerWaalsContact O-CE1 3.25Å; M432-Y501 WeakPolarHBondContact O-CE1 3.24Å; M432-Y501 PolarHBondContact O-OH 3.13Å; M432-Y501 HydrophobicContact SD-CD1 3.82Å; M432-Y501 HydrophobicContact SD-CE1 4.2Å; R434-Y501 VanDerWaalsContact CD-CZ 3.4Å; R434-Y501 WeakPolarHBondContact CD-OH 3.34Å; R434-Y501 HydrophobicContact CG-CE1 4.43Å; D499-Y501 VanDerWaalsContact C-N 3.3Å; D499-Y501 PolarHBondContact O-N 3.49Å; D499-Y501 WeakPolarHBondContact OD1-CB 3.27Å; D499-Y501 PolarHBondContact OD1-N 2.7Å; Y501-M504 PolarHBondContact O-N 2.82Å; Y501-A505 VanDerWaalsContact O-CB 3.29Å; Y501-A505 WeakPolarHBondContact O-CB 3.43Å; Y501-A505 PolarHBondContact O-N 3.28Å
502	F	82.7	Confident	87.3	Confident	48 Å²	48	29.1 Å²	29.1	21%	0.211	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-44.2	176.9	176.2	-119.9	0	0	0	112.9	D499 M504 A505 K506 L545	D499-F502 HydrophobicContact CB-CB 4.32Å; D499-F502 PolarHBondContact OD1-N 3.25Å; D499-F502 VanDerWaalsContact OD1-N 3.15Å; D499-F502 VanDerWaalsContact OD2-CB 3.31Å; D499-F502 WeakPolarHBondContact OD2-CB 3.33Å; F502-M504 VanDerWaalsContact C-N 3.32Å; F502-M504 PolarHBondContact O-N 2.95Å; F502-A505 PolarHBondContact O-N 2.9Å; F502-K506 HydrophobicContact CD1-CD 4.36Å; F502-K506 HydrophobicContact CD2-CG 4.46Å; F502-K506 HydrophobicContact CE1-CD 3.84Å; F502-K506 VanDerWaalsContact CE1-NZ 3.31Å; F502-K506 HydrophobicContact CE2-CD 4.02Å; F502-K506 HydrophobicContact CE2-CG 4.08Å; F502-K506 HydrophobicContact CZ-CD 3.7Å; F502-K506 HydrophobicContact CZ-CG 4.28Å; F502-K506 PolarHBondContact O-N 3.43Å; F502-L545 HydrophobicContact CD2-CD2 3.47Å; F502-L545 VanDerWaalsContact CD2-CD2 3.47Å; F502-L545 HydrophobicContact CE2-CD2 3.12Å; F502-L545 HydrophobicContact CZ-CD2 4.16Å
503	L	87.9	Confident	87.1	Confident	23 Å²	23	26.4 Å²	26.4	12%	0.12	14%	0.144	C	C	.	.	H	α-helix	trans	-61	-43.1	177	-77.7	-173.3	0	0	0	112	E341 I344 V498 D499 R500 K506 R507	E341-L503 HydrophobicContact CB-CD1 4.46Å; E341-L503 HydrophobicContact CG-CD1 4.29Å; I344-L503 HydrophobicContact CB-CD1 4.16Å; I344-L503 HydrophobicContact CD1-CD1 4.41Å; I344-L503 HydrophobicContact CG2-CB 3.76Å; I344-L503 HydrophobicContact CG2-CD1 3.99Å; V498-L503 HydrophobicContact CG1-CD1 3.27Å; V498-L503 HydrophobicContact CG1-CG 4.07Å; D499-L503 PolarHBondContact O-N 2.85Å; R500-L503 PolarHBondContact O-N 3.35Å; L503-K506 PolarHBondContact O-N 2.84Å; L503-R507 PolarHBondContact O-N 2.88Å
504	M	92.5	Very high	86.8	Confident	5 Å²	5	29 Å²	29	3%	0.025	14%	0.142	C	C	.	.	H	α-helix	trans	-65.4	-40.8	175.9	-72.7	178.4	77.3	0	0	111.2	I344 A348 I351 F352 W401 I484 R500 Y501 F502 K506 R507 A508	I344-M504 HydrophobicContact CG2-CG 3.95Å; A348-M504 HydrophobicContact CB-CG 3.97Å; I351-M504 HydrophobicContact CD1-CE 4.3Å; F352-M504 HydrophobicContact CE2-CB 3.77Å; F352-M504 HydrophobicContact CE2-CE 3.72Å; F352-M504 HydrophobicContact CE2-CG 4.22Å; F352-M504 HydrophobicContact CZ-CB 4.33Å; F352-M504 HydrophobicContact CZ-CE 3.97Å; W401-M504 HydrophobicContact CH2-CB 4.46Å; W401-M504 HydrophobicContact CH2-CE 3.43Å; W401-M504 VanDerWaalsContact CH2-CE 3.43Å; W401-M504 HydrophobicContact CH2-SD 3.76Å; W401-M504 HydrophobicContact CZ2-CB 3.57Å; W401-M504 HydrophobicContact CZ2-CE 3.74Å; W401-M504 HydrophobicContact CZ2-CG 4.19Å; W401-M504 HydrophobicContact CZ2-SD 3.62Å; W401-M504 HydrophobicContact CZ3-CE 3.97Å; I484-M504 HydrophobicContact CD1-CE 4.05Å; I484-M504 HydrophobicContact CG1-CE 3.84Å; R500-M504 VanDerWaalsContact O-CB 3.26Å; R500-M504 WeakPolarHBondContact O-CB 3.23Å; R500-M504 WeakPolarHBondContact O-CG 3.34Å; R500-M504 PolarHBondContact O-N 2.86Å; Y501-M504 PolarHBondContact O-N 2.82Å; F502-M504 VanDerWaalsContact C-N 3.32Å; F502-M504 PolarHBondContact O-N 2.95Å; M504-K506 PolarHBondContact O-N 3.45Å; M504-R507 CarbonylContact O-C 3.41Å; M504-R507 WeakPolarHBondContact O-CB 3.26Å; M504-R507 PolarHBondContact O-N 2.76Å; M504-R507 VanDerWaalsContact O-N 3.1Å; M504-A508 WeakPolarHBondContact O-CB 3.33Å; M504-A508 PolarHBondContact O-N 2.98Å
505	A	88.9	Confident	86.5	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-41.7	177.1	0	0	0	0	0	112.7	W401 I405 Y501 F502 R507 A508 V509 F541	W401-A505 VanDerWaalsContact CD1-CA 3.45Å; I405-A505 HydrophobicContact CG1-CB 3.87Å; Y501-A505 VanDerWaalsContact O-CB 3.29Å; Y501-A505 WeakPolarHBondContact O-CB 3.43Å; Y501-A505 PolarHBondContact O-N 3.28Å; F502-A505 PolarHBondContact O-N 2.9Å; A505-R507 VanDerWaalsContact C-N 3.25Å; A505-R507 PolarHBondContact O-N 3.48Å; A505-A508 WeakPolarHBondContact O-CB 3.19Å; A505-A508 PolarHBondContact O-N 3.28Å; A505-V509 WeakPolarHBondContact O-CG2 3.35Å; A505-V509 PolarHBondContact O-N 2.85Å; A505-F541 HydrophobicContact CB-CE1 4.23Å; A505-F541 HydrophobicContact CB-CZ 3.72Å
506	K	87	Confident	85.9	Confident	63 Å²	63	27.6 Å²	27.6	27%	0.274	12%	0.123	S	C	.	.	H	α-helix	trans	-57.8	-39.9	173.6	-80.1	-178.9	153.5	173.2	0	111.9	F502 L503 M504 R510 F541	F502-K506 HydrophobicContact CD1-CD 4.36Å; F502-K506 HydrophobicContact CD2-CG 4.46Å; F502-K506 HydrophobicContact CE1-CD 3.84Å; F502-K506 VanDerWaalsContact CE1-NZ 3.31Å; F502-K506 HydrophobicContact CE2-CD 4.02Å; F502-K506 HydrophobicContact CE2-CG 4.08Å; F502-K506 HydrophobicContact CZ-CD 3.7Å; F502-K506 HydrophobicContact CZ-CG 4.28Å; F502-K506 PolarHBondContact O-N 3.43Å; L503-K506 PolarHBondContact O-N 2.84Å; M504-K506 PolarHBondContact O-N 3.45Å; K506-R510 PolarHBondContact O-N 2.7Å; K506-F541 HydrophobicContact CG-CE1 4.44Å
507	R	91.5	Very high	84.8	Confident	33 Å²	33	27.9 Å²	27.9	13%	0.125	13%	0.126	C	C	.	.	H	α-helix	trans	-72.7	-38.8	176	-65.2	-67.2	178.8	173.4	-1.8	112.3	A348 E349 F352 L503 M504 A505 R510 G511	A348-R507 HydrophobicContact CB-CB 3.83Å; A348-R507 HydrophobicContact CB-CG 3.76Å; E349-R507 WeakPolarHBondContact OE2-CD 3.25Å; E349-R507 IonicContact OE2-CZ 3.21Å; E349-R507 IonicContact OE2-NE 2.87Å; E349-R507 IonicContact OE2-NH1 3.28Å; E349-R507 PolarHBondContact OE2-NH1 2.92Å; F352-R507 HydrophobicContact CD2-CB 4.14Å; L503-R507 PolarHBondContact O-N 2.88Å; M504-R507 CarbonylContact O-C 3.41Å; M504-R507 WeakPolarHBondContact O-CB 3.26Å; M504-R507 PolarHBondContact O-N 2.76Å; M504-R507 VanDerWaalsContact O-N 3.1Å; A505-R507 VanDerWaalsContact C-N 3.25Å; A505-R507 PolarHBondContact O-N 3.48Å; R507-R510 PolarHBondContact O-N 2.92Å; R507-G511 PolarHBondContact O-N 3.31Å
508	A	91.9	Very high	83.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-56.6	-49.1	173.2	0	0	0	0	0	112.2	F352 C398 W401 M504 A505 R510 G511 W512	F352-A508 HydrophobicContact CB-CB 4.49Å; F352-A508 HydrophobicContact CD1-CB 3.66Å; F352-A508 HydrophobicContact CD2-CB 4.36Å; F352-A508 HydrophobicContact CE1-CB 3.89Å; F352-A508 HydrophobicContact CG-CB 3.92Å; F352-A508 HydrophobicContact CZ-CB 4.37Å; C398-A508 HydrophobicContact CB-CB 4.23Å; C398-A508 WeakPolarHBondContact CB-O 3.42Å; C398-A508 PolarHBondContact SG-O 3.11Å; W401-A508 HydrophobicContact CB-CB 4.08Å; W401-A508 HydrophobicContact CG-CB 4.39Å; M504-A508 WeakPolarHBondContact O-CB 3.33Å; M504-A508 PolarHBondContact O-N 2.98Å; A505-A508 WeakPolarHBondContact O-CB 3.19Å; A505-A508 PolarHBondContact O-N 3.28Å; A508-R510 PolarHBondContact O-N 3.38Å; A508-G511 PolarHBondContact O-N 3.37Å; A508-W512 PolarHBondContact O-N 3.09Å
509	V	88.4	Confident	82.4	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.024	16%	0.159	C	C	.	.	H	α-helix	trans	-62.7	-42.6	178.3	173.7	0	0	0	0	111.5	R402 A505 S513 M538 F541	R402-V509 HydrophobicContact CB-CG2 4.39Å; R402-V509 HydrophobicContact CG-CG2 4.23Å; A505-V509 WeakPolarHBondContact O-CG2 3.35Å; A505-V509 PolarHBondContact O-N 2.85Å; V509-S513 WeakPolarHBondContact O-CB 3.21Å; V509-S513 PolarHBondContact O-N 3.36Å; V509-S513 PolarHBondContact O-OG 3.3Å; V509-M538 HydrophobicContact CG1-CG 4.27Å; V509-F541 HydrophobicContact CG1-CB 4.1Å; V509-F541 HydrophobicContact CG1-CG 4.47Å; V509-F541 HydrophobicContact CG2-CB 4.11Å; V509-F541 HydrophobicContact CG2-CD1 3.93Å; V509-F541 HydrophobicContact CG2-CD2 3.72Å; V509-F541 HydrophobicContact CG2-CE1 4.28Å; V509-F541 HydrophobicContact CG2-CE2 4.09Å; V509-F541 HydrophobicContact CG2-CG 3.63Å; V509-F541 HydrophobicContact CG2-CZ 4.35Å
510	R	87.2	Confident	80.8	Confident	86 Å²	86	39.4 Å²	39.4	33%	0.325	18%	0.183	S	C	.	.	H	α-helix	trans	-63.7	-44.3	175.7	-177.4	178.4	171.5	171.5	-2.3	111.9	Y353 K506 R507 A508 S513 R514 V534 M538	Y353-R510 HydrophobicContact CD2-CG 4.25Å; Y353-R510 HydrophobicContact CE2-CG 4.21Å; K506-R510 PolarHBondContact O-N 2.7Å; R507-R510 PolarHBondContact O-N 2.92Å; A508-R510 PolarHBondContact O-N 3.38Å; R510-S513 PolarHBondContact O-N 3.33Å; R510-R514 PolarHBondContact O-N 2.77Å; R510-V534 HydrophobicContact CG-CG1 4.27Å; R510-M538 HydrophobicContact CB-SD 4.44Å
511	G	86.1	Confident	78.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-51.4	177	0	0	0	0	0	112.4	F352 R507 A508 S513 R514 L515	F352-G511 WeakPolarHBondContact O-CA 3.39Å; R507-G511 PolarHBondContact O-N 3.31Å; A508-G511 PolarHBondContact O-N 3.37Å; G511-S513 PolarHBondContact O-N 2.96Å; G511-R514 WeakPolarHBondContact O-CB 3.49Å; G511-R514 PolarHBondContact O-N 3.5Å; G511-L515 WeakPolarHBondContact O-CG 3.18Å; G511-L515 PolarHBondContact O-N 3.08Å; G511-L515 VanDerWaalsContact O-N 3.14Å
512	W	87	Confident	76.9	Confident	62 Å²	62	52 Å²	52	24%	0.235	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-44.2	176.7	176.7	82.9	0	0	0	113	C398 Q399 A508 R514 L515 V516 E537	C398-W512 HydrophobicContact CB-CB 3.76Å; Q399-W512 HydrophobicContact CG-CD2 4.49Å; Q399-W512 HydrophobicContact CG-CG 4.11Å; Q399-W512 VanDerWaalsContact NE2-CD1 3.33Å; A508-W512 PolarHBondContact O-N 3.09Å; W512-R514 PolarHBondContact O-N 3.26Å; W512-L515 PolarHBondContact O-N 3.07Å; W512-V516 HydrophobicContact CD2-CG2 3.77Å; W512-V516 HydrophobicContact CE3-CG2 4.4Å; W512-V516 HydrophobicContact CG-CG2 4.28Å; W512-V516 HydrophobicContact CH2-CG2 4.21Å; W512-V516 HydrophobicContact CZ2-CG2 3.54Å; W512-V516 PolarHBondContact O-N 3.03Å; W512-E537 HydrophobicContact CZ3-CG 4.16Å
513	S	81.9	Confident	75.3	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.014	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-34.8	-179.2	-60.1	0	0	0	0	112	V509 R510 G511 G517 E537	V509-S513 WeakPolarHBondContact O-CB 3.21Å; V509-S513 PolarHBondContact O-N 3.36Å; V509-S513 PolarHBondContact O-OG 3.3Å; R510-S513 PolarHBondContact O-N 3.33Å; G511-S513 PolarHBondContact O-N 2.96Å; S513-G517 PolarHBondContact O-N 3.33Å; S513-E537 WeakPolarHBondContact OG-CB 3.48Å
514	R	81.7	Confident	73.4	Confident	107 Å²	107	64.3 Å²	64.3	40%	0.404	31%	0.307	S	S	.	.	H	α-helix	trans	-66.2	-47.9	171.7	173.7	-177.2	171.3	-178.7	1.1	112	Y353 R510 G511 W512 G517 A518	Y353-R514 HydrophobicContact CE2-CB 4.11Å; Y353-R514 VanDerWaalsContact CE2-CD 3.47Å; Y353-R514 HydrophobicContact CE2-CG 4.39Å; Y353-R514 VanDerWaalsContact CZ-CD 3.49Å; Y353-R514 VanDerWaalsContact CZ-NH1 3.33Å; R510-R514 PolarHBondContact O-N 2.77Å; G511-R514 WeakPolarHBondContact O-CB 3.49Å; G511-R514 PolarHBondContact O-N 3.5Å; W512-R514 PolarHBondContact O-N 3.26Å; R514-G517 CarbonylContact O-C 3.55Å; R514-G517 PolarHBondContact O-N 2.96Å; R514-A518 PolarHBondContact O-N 3.42Å
515	L	82.1	Confident	71.7	Confident	12 Å²	12	68 Å²	68	6%	0.063	35%	0.347	C	S	.	.	H	α-helix	trans	-60.8	-48.1	-178.1	-70.4	170.7	0	0	0	111.1	E391 R394 A395 G511 W512 G517 A518 T519	E391-L515 HydrophobicContact CB-CD2 4.02Å; E391-L515 HydrophobicContact CG-CD2 4.14Å; R394-L515 HydrophobicContact CB-CD1 4.42Å; R394-L515 HydrophobicContact CG-CD1 4.3Å; R394-L515 VanDerWaalsContact NH2-CD2 3.26Å; A395-L515 HydrophobicContact CB-CD1 3.86Å; G511-L515 WeakPolarHBondContact O-CG 3.18Å; G511-L515 PolarHBondContact O-N 3.08Å; G511-L515 VanDerWaalsContact O-N 3.14Å; W512-L515 PolarHBondContact O-N 3.07Å; L515-G517 VanDerWaalsContact C-N 3.33Å; L515-G517 PolarHBondContact O-N 3.44Å; L515-A518 WeakPolarHBondContact O-CB 3.35Å; L515-A518 PolarHBondContact O-N 2.64Å; L515-T519 PolarHBondContact O-N 3.18Å; L515-T519 PolarHBondContact O-OG1 3.38Å
516	V	72.2	Confident	70.3	Confident	26 Å²	26	71.6 Å²	71.6	16%	0.158	37%	0.369	C	S	.	.	H	α-helix	trans	-60.1	-44.1	173.8	176.7	0	0	0	0	110.8	W512 A518 T519 Y520	W512-V516 HydrophobicContact CD2-CG2 3.77Å; W512-V516 HydrophobicContact CE3-CG2 4.4Å; W512-V516 HydrophobicContact CG-CG2 4.28Å; W512-V516 HydrophobicContact CH2-CG2 4.21Å; W512-V516 HydrophobicContact CZ2-CG2 3.54Å; W512-V516 PolarHBondContact O-N 3.03Å; V516-A518 PolarHBondContact O-N 2.91Å; V516-A518 VanDerWaalsContact O-N 3.12Å; V516-T519 PolarHBondContact O-N 3.04Å; V516-T519 VanDerWaalsContact O-N 3.17Å; V516-Y520 HydrophobicContact CG1-CD2 3.98Å; V516-Y520 HydrophobicContact CG1-CE2 3.7Å; V516-Y520 VanDerWaalsContact O-CD2 3.28Å; V516-Y520 WeakPolarHBondContact O-CD2 3.39Å; V516-Y520 PolarHBondContact O-N 3.32Å
517	G	60.6	Low	69.2	Low	10 Å²	10	73.5 Å²	73.5	10%	0.103	39%	0.39	C	S	.	.	H	α-helix	trans	-61.8	-17.6	176.5	0	0	0	0	0	115	S513 R514 L515 R530	S513-G517 PolarHBondContact O-N 3.33Å; R514-G517 CarbonylContact O-C 3.55Å; R514-G517 PolarHBondContact O-N 2.96Å; L515-G517 VanDerWaalsContact C-N 3.33Å; L515-G517 PolarHBondContact O-N 3.44Å; G517-R530 PolarHBondContact O-NE 2.91Å; G517-R530 PolarHBondContact O-NH2 3.01Å
518	A	61.4	Low	68.2	Low	33 Å²	33	78.8 Å²	78.8	27%	0.273	42%	0.42	S	S	.	.	H	α-helix	trans	-88.3	-30.7	175.5	0	0	0	0	0	112.9	R514 L515 V516 R521	R514-A518 PolarHBondContact O-N 3.42Å; L515-A518 WeakPolarHBondContact O-CB 3.35Å; L515-A518 PolarHBondContact O-N 2.64Å; V516-A518 PolarHBondContact O-N 2.91Å; V516-A518 VanDerWaalsContact O-N 3.12Å; A518-R521 WeakPolarHBondContact O-CG 3.32Å
519	T	57.7	Low	67.3	Low	115 Å²	115	84 Å²	84	71%	0.706	45%	0.448	S	S	*	.	H	α-helix	trans	-70.8	-32.5	177.7	-40.1	0	0	0	0	112.4	L515 V516 R521	L515-T519 PolarHBondContact O-N 3.18Å; L515-T519 PolarHBondContact O-OG1 3.38Å; V516-T519 PolarHBondContact O-N 3.04Å; V516-T519 VanDerWaalsContact O-N 3.17Å; T519-R521 PolarHBondContact O-N 3.19Å
520	Y	52	Low	66.3	Low	176 Å²	176	89.6 Å²	89.6	69%	0.69	47%	0.468	S	S	*	.			trans	-80.7	48	175.7	-72.6	-101.4	0	0	0	112.4	V516 G522	V516-Y520 HydrophobicContact CG1-CD2 3.98Å; V516-Y520 HydrophobicContact CG1-CE2 3.7Å; V516-Y520 VanDerWaalsContact O-CD2 3.28Å; V516-Y520 WeakPolarHBondContact O-CD2 3.39Å; V516-Y520 PolarHBondContact O-N 3.32Å; Y520-G522 PolarHBondContact O-N 3.39Å
521	R	48.9	Very low	65.6	Low	224 Å²	224	91.5 Å²	91.5	85%	0.845	48%	0.48	S	S	*	.			trans	-66.3	2.9	173.1	-94.1	177.8	-169.3	-164.9	3.5	113.8	A518 T519 V523	A518-R521 WeakPolarHBondContact O-CG 3.32Å; T519-R521 PolarHBondContact O-N 3.19Å; R521-V523 PolarHBondContact O-N 2.93Å
522	G	45.7	Very low	65.2	Low	62 Å²	62	94.1 Å²	94.1	64%	0.639	50%	0.502	S	S	*	.	S	Bend	trans	-82.2	105	176.4	0	0	0	0	0	113.6	Y520 Y524	Y520-G522 PolarHBondContact O-N 3.39Å; G522-Y524 PolarHBondContact O-N 3.36Å
523	V	49.1	Very low	64.7	Low	122 Å²	122	94.7 Å²	94.7	74%	0.739	51%	0.506	S	S	*	.	S	Bend	trans	83.2	-22	148.8	-164.9	0	0	0	0	120.6	R521	R521-V523 PolarHBondContact O-N 2.93Å
524	Y	46.9	Very low	64.5	Low	208 Å²	208	95.6 Å²	95.6	82%	0.816	51%	0.512	S	S	*	.			trans	-137.3	86.1	172	-71.7	-78.8	0	0	0	113.5	G522 T526	G522-Y524 PolarHBondContact O-N 3.36Å; Y524-T526 PolarHBondContact O-N 2.88Å
525	G	57.6	Low	64.4	Low	82 Å²	82	94.1 Å²	94.1	85%	0.845	51%	0.514	S	S	*	.			trans	-82.1	104.9	172.3	0	0	0	0	0	112
526	T	58.9	Low	64.4	Low	76 Å²	76	100.3 Å²	100.3	47%	0.466	54%	0.537	S	S	.	.			trans	-132.8	133.3	151.5	60.3	0	0	0	0	109.2	Y524 L528 L529 R530	Y524-T526 PolarHBondContact O-N 2.88Å; T526-L528 PolarHBondContact O-N 3.01Å; T526-L528 VanDerWaalsContact O-N 3.15Å; T526-L529 PolarHBondContact O-N 2.77Å; T526-L529 WeakPolarHBondContact OG1-CD1 3.24Å; T526-L529 WeakPolarHBondContact OG1-CG 3.29Å; T526-R530 PolarHBondContact O-N 2.8Å
527	S	64.8	Low	64.8	Low	104 Å²	104	100.6 Å²	100.6	73%	0.727	54%	0.537	S	S	*	.	H	α-helix	trans	-53.5	-32.6	176.8	-173.5	0	0	0	0	112	R530 H531	S527-R530 PolarHBondContact O-N 3.2Å; S527-H531 WeakPolarHBondContact O-CB 3.49Å; S527-H531 PolarHBondContact O-N 3.42Å
528	L	71	Confident	65.7	Low	143 Å²	143	103.2 Å²	103.2	75%	0.749	55%	0.547	S	S	*	.	H	α-helix	trans	-64	-48.2	177.9	-80.1	155.8	0	0	0	113.6	T526 R530 H531 A532	T526-L528 PolarHBondContact O-N 3.01Å; T526-L528 VanDerWaalsContact O-N 3.15Å; L528-R530 VanDerWaalsContact C-N 3.28Å; L528-R530 PolarHBondContact O-N 3.06Å; L528-H531 PolarHBondContact O-N 3.39Å; L528-A532 WeakPolarHBondContact O-CB 3.34Å; L528-A532 PolarHBondContact O-N 3.13Å
529	L	72.6	Confident	66.8	Low	111 Å²	111	105.9 Å²	105.9	58%	0.581	56%	0.556	S	S	*	*	H	α-helix	trans	-64.2	-36.4	178.4	-74	172.3	0	0	0	111.7	T526 A532 K533	T526-L529 PolarHBondContact O-N 2.77Å; T526-L529 WeakPolarHBondContact OG1-CD1 3.24Å; T526-L529 WeakPolarHBondContact OG1-CG 3.29Å; L529-A532 PolarHBondContact O-N 3.1Å; L529-K533 WeakPolarHBondContact O-CB 3.47Å; L529-K533 PolarHBondContact O-N 3.35Å
530	R	67.6	Low	68	Low	120 Å²	120	104.4 Å²	104.4	45%	0.453	54%	0.54	S	S	.	.	H	α-helix	trans	-65.1	-45	174	-172.9	-178.3	-72.2	166.2	-2.7	111.1	G517 T526 S527 L528 K533 V534	G517-R530 PolarHBondContact O-NE 2.91Å; G517-R530 PolarHBondContact O-NH2 3.01Å; T526-R530 PolarHBondContact O-N 2.8Å; S527-R530 PolarHBondContact O-N 3.2Å; L528-R530 VanDerWaalsContact C-N 3.28Å; L528-R530 PolarHBondContact O-N 3.06Å; R530-K533 PolarHBondContact O-N 3.33Å; R530-V534 WeakPolarHBondContact O-CG2 3.4Å; R530-V534 PolarHBondContact O-N 3.36Å
531	H	71	Confident	69.4	Low	126 Å²	126	96.4 Å²	96.4	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-61.9	-46.1	176.4	-169.5	82.2	0	0	0	111.5	S527 L528 K533 V534 V535	S527-H531 WeakPolarHBondContact O-CB 3.49Å; S527-H531 PolarHBondContact O-N 3.42Å; L528-H531 PolarHBondContact O-N 3.39Å; H531-K533 VanDerWaalsContact C-N 3.32Å; H531-K533 PolarHBondContact O-N 3.12Å; H531-V534 PolarHBondContact O-N 3.48Å; H531-V535 WeakPolarHBondContact O-CG2 3.28Å; H531-V535 PolarHBondContact O-N 3.44Å
532	A	78.8	Confident	70.9	Confident	55 Å²	55	88.3 Å²	88.3	46%	0.455	48%	0.481	S	S	.	.	H	α-helix	trans	-59	-41.5	176	0	0	0	0	0	112.1	L528 L529 V535 W536	L528-A532 WeakPolarHBondContact O-CB 3.34Å; L528-A532 PolarHBondContact O-N 3.13Å; L529-A532 PolarHBondContact O-N 3.1Å; A532-V535 PolarHBondContact O-N 2.88Å; A532-W536 VanDerWaalsContact O-CB 3.27Å; A532-W536 WeakPolarHBondContact O-CB 3.44Å; A532-W536 PolarHBondContact O-N 2.89Å
533	K	77.4	Confident	72.8	Confident	74 Å²	74	88.8 Å²	88.8	32%	0.322	47%	0.471	S	S	.	.	H	α-helix	trans	-63.4	-44.3	174.7	-174.3	176.4	-179.5	176.4	0	112.2	L529 R530 H531 V535 W536 E537	L529-K533 WeakPolarHBondContact O-CB 3.47Å; L529-K533 PolarHBondContact O-N 3.35Å; R530-K533 PolarHBondContact O-N 3.33Å; H531-K533 VanDerWaalsContact C-N 3.32Å; H531-K533 PolarHBondContact O-N 3.12Å; K533-V535 VanDerWaalsContact C-N 3.34Å; K533-V535 PolarHBondContact O-N 2.89Å; K533-W536 PolarHBondContact O-N 3.29Å; K533-E537 HydrophobicContact CG-CG 4.5Å; K533-E537 WeakPolarHBondContact O-CG 3.47Å; K533-E537 PolarHBondContact O-N 2.92Å
534	V	76.1	Confident	74.4	Confident	22 Å²	22	84.6 Å²	84.6	13%	0.133	45%	0.449	C	S	.	.	H	α-helix	trans	-60.7	-45.9	176.3	174	0	0	0	0	110.5	R510 R530 H531 W536 E537 M538	R510-V534 HydrophobicContact CG-CG1 4.27Å; R530-V534 WeakPolarHBondContact O-CG2 3.4Å; R530-V534 PolarHBondContact O-N 3.36Å; H531-V534 PolarHBondContact O-N 3.48Å; V534-W536 VanDerWaalsContact C-N 3.31Å; V534-W536 PolarHBondContact O-N 2.85Å; V534-E537 PolarHBondContact O-N 3.39Å; V534-M538 HydrophobicContact CG1-SD 4.37Å; V534-M538 WeakPolarHBondContact O-CB 3.43Å; V534-M538 WeakPolarHBondContact O-CG 3.35Å; V534-M538 PolarHBondContact O-N 2.96Å
535	V	79.5	Confident	75.7	Confident	75 Å²	75	75 Å²	75	46%	0.455	41%	0.412	S	S	.	.	H	α-helix	trans	-61	-41.6	176.6	172.4	0	0	0	0	110.8	H531 A532 K533 M538 L539	H531-V535 WeakPolarHBondContact O-CG2 3.28Å; H531-V535 PolarHBondContact O-N 3.44Å; A532-V535 PolarHBondContact O-N 2.88Å; K533-V535 VanDerWaalsContact C-N 3.34Å; K533-V535 PolarHBondContact O-N 2.89Å; V535-M538 PolarHBondContact O-N 3.44Å; V535-L539 WeakPolarHBondContact O-CB 3.37Å; V535-L539 PolarHBondContact O-N 3.23Å
536	W	83.3	Confident	76.8	Confident	143 Å²	143	78.9 Å²	78.9	54%	0.542	40%	0.401	S	S	.	.	H	α-helix	trans	-64.8	-46.3	177.9	-178.3	-124.3	0	0	0	112.7	A532 K533 V534 M538 L539 K540	A532-W536 VanDerWaalsContact O-CB 3.27Å; A532-W536 WeakPolarHBondContact O-CB 3.44Å; A532-W536 PolarHBondContact O-N 2.89Å; K533-W536 PolarHBondContact O-N 3.29Å; V534-W536 VanDerWaalsContact C-N 3.31Å; V534-W536 PolarHBondContact O-N 2.85Å; W536-M538 VanDerWaalsContact C-N 3.33Å; W536-M538 PolarHBondContact O-N 3.38Å; W536-L539 HydrophobicContact CE3-CD2 3.98Å; W536-L539 HydrophobicContact CZ3-CD2 3.91Å; W536-L539 PolarHBondContact O-N 3.4Å; W536-K540 HydrophobicContact CZ2-CG 4.5Å; W536-K540 WeakPolarHBondContact O-CG 3.47Å; W536-K540 PolarHBondContact O-N 2.91Å
537	E	80.6	Confident	78	Confident	32 Å²	32	80.2 Å²	80.2	15%	0.15	41%	0.405	C	S	.	.	H	α-helix	trans	-65.6	-37.2	176.2	-67.6	-54.7	146.7	0	0	112	W512 S513 K533 V534 K540 F541	W512-E537 HydrophobicContact CZ3-CG 4.16Å; S513-E537 WeakPolarHBondContact OG-CB 3.48Å; K533-E537 HydrophobicContact CG-CG 4.5Å; K533-E537 WeakPolarHBondContact O-CG 3.47Å; K533-E537 PolarHBondContact O-N 2.92Å; V534-E537 PolarHBondContact O-N 3.39Å; E537-K540 IonicContact OE1-NZ 2.83Å; E537-K540 PolarHBondContact OE1-NZ 3.01Å; E537-K540 IonicContact OE2-NZ 3.02Å; E537-K540 PolarHBondContact OE2-NZ 3.14Å; E537-F541 WeakPolarHBondContact O-CB 2.96Å; E537-F541 PolarHBondContact O-N 3.26Å
538	M	78.8	Confident	78.5	Confident	65 Å²	65	78.7 Å²	78.7	32%	0.32	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-43.8	171.3	-78.5	-172.6	56.5	0	0	112	V509 R510 V534 V535 W536 F541 E542	V509-M538 HydrophobicContact CG1-CG 4.27Å; R510-M538 HydrophobicContact CB-SD 4.44Å; V534-M538 HydrophobicContact CG1-SD 4.37Å; V534-M538 WeakPolarHBondContact O-CB 3.43Å; V534-M538 WeakPolarHBondContact O-CG 3.35Å; V534-M538 PolarHBondContact O-N 2.96Å; V535-M538 PolarHBondContact O-N 3.44Å; W536-M538 VanDerWaalsContact C-N 3.33Å; W536-M538 PolarHBondContact O-N 3.38Å; M538-F541 PolarHBondContact O-N 3.38Å; M538-E542 WeakPolarHBondContact O-CB 3.41Å; M538-E542 PolarHBondContact O-N 2.89Å
539	L	83.8	Confident	78.6	Confident	88 Å²	88	73.3 Å²	73.3	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-47.4	177.5	-178.3	67.6	0	0	0	111	V535 W536 F541 E542 V543	V535-L539 WeakPolarHBondContact O-CB 3.37Å; V535-L539 PolarHBondContact O-N 3.23Å; W536-L539 HydrophobicContact CE3-CD2 3.98Å; W536-L539 HydrophobicContact CZ3-CD2 3.91Å; W536-L539 PolarHBondContact O-N 3.4Å; L539-F541 VanDerWaalsContact C-N 3.31Å; L539-F541 PolarHBondContact O-N 3.19Å; L539-E542 PolarHBondContact O-N 2.65Å; L539-V543 HydrophobicContact CD1-CG2 4.35Å; L539-V543 HydrophobicContact CG-CG2 4.42Å; L539-V543 WeakPolarHBondContact O-CB 3.32Å; L539-V543 VanDerWaalsContact O-CG2 3.3Å; L539-V543 WeakPolarHBondContact O-CG2 3.46Å; L539-V543 PolarHBondContact O-N 2.81Å
540	K	84.3	Confident	79	Confident	85 Å²	85	72.4 Å²	72.4	37%	0.37	35%	0.354	S	S	.	.	H	α-helix	trans	-55.9	-47.1	174.7	-74.4	-174.8	-154.3	164.8	0	111.5	W536 E537 V543 A544	W536-K540 HydrophobicContact CZ2-CG 4.5Å; W536-K540 WeakPolarHBondContact O-CG 3.47Å; W536-K540 PolarHBondContact O-N 2.91Å; E537-K540 IonicContact OE1-NZ 2.83Å; E537-K540 PolarHBondContact OE1-NZ 3.01Å; E537-K540 IonicContact OE2-NZ 3.02Å; E537-K540 PolarHBondContact OE2-NZ 3.14Å; K540-V543 PolarHBondContact O-N 3.03Å; K540-A544 VanDerWaalsContact O-CB 3.28Å; K540-A544 WeakPolarHBondContact O-CB 3.33Å; K540-A544 PolarHBondContact O-N 2.86Å
541	F	80.4	Confident	79.5	Confident	7 Å²	7	68.8 Å²	68.8	3%	0.031	35%	0.35	C	S	.	.	H	α-helix	trans	-60.1	-47.9	178.1	175	-106	0	0	0	110.8	R402 I405 L406 A505 K506 V509 E537 M538 L539 V543 A544 L545	R402-F541 HydrophobicContact CG-CD2 3.99Å; R402-F541 HydrophobicContact CG-CE2 4Å; I405-F541 HydrophobicContact CG2-CE2 4.32Å; I405-F541 HydrophobicContact CG2-CZ 4.03Å; L406-F541 HydrophobicContact CD1-CD2 4.21Å; L406-F541 HydrophobicContact CD1-CE2 4.39Å; L406-F541 HydrophobicContact CD2-CD2 4.34Å; L406-F541 HydrophobicContact CD2-CE2 4.16Å; L406-F541 HydrophobicContact CG-CD2 4.39Å; L406-F541 HydrophobicContact CG-CE2 4.13Å; A505-F541 HydrophobicContact CB-CE1 4.23Å; A505-F541 HydrophobicContact CB-CZ 3.72Å; K506-F541 HydrophobicContact CG-CE1 4.44Å; V509-F541 HydrophobicContact CG1-CB 4.1Å; V509-F541 HydrophobicContact CG1-CG 4.47Å; V509-F541 HydrophobicContact CG2-CB 4.11Å; V509-F541 HydrophobicContact CG2-CD1 3.93Å; V509-F541 HydrophobicContact CG2-CD2 3.72Å; V509-F541 HydrophobicContact CG2-CE1 4.28Å; V509-F541 HydrophobicContact CG2-CE2 4.09Å; V509-F541 HydrophobicContact CG2-CG 3.63Å; V509-F541 HydrophobicContact CG2-CZ 4.35Å; E537-F541 WeakPolarHBondContact O-CB 2.96Å; E537-F541 PolarHBondContact O-N 3.26Å; M538-F541 PolarHBondContact O-N 3.38Å; L539-F541 VanDerWaalsContact C-N 3.31Å; L539-F541 PolarHBondContact O-N 3.19Å; F541-V543 VanDerWaalsContact C-N 3.35Å; F541-V543 PolarHBondContact O-N 3.35Å; F541-A544 PolarHBondContact O-N 2.72Å; F541-L545 HydrophobicContact CE1-CD2 4.33Å; F541-L545 HydrophobicContact CE2-CD1 4.41Å; F541-L545 HydrophobicContact CZ-CD1 4.18Å; F541-L545 HydrophobicContact CZ-CD2 4.47Å; F541-L545 VanDerWaalsContact O-CB 3.23Å; F541-L545 WeakPolarHBondContact O-CB 3.41Å; F541-L545 PolarHBondContact O-N 2.8Å
542	E	81.2	Confident	79.6	Confident	55 Å²	55	64.1 Å²	64.1	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-36.9	-179.9	-171.7	163	174.2	0	0	112.8	M538 L539 L545 R546	M538-E542 WeakPolarHBondContact O-CB 3.41Å; M538-E542 PolarHBondContact O-N 2.89Å; L539-E542 PolarHBondContact O-N 2.65Å; E542-L545 WeakPolarHBondContact O-CB 3.45Å; E542-R546 VanDerWaalsContact O-CG 3.28Å; E542-R546 WeakPolarHBondContact O-CG 3.45Å; E542-R546 PolarHBondContact O-N 2.8Å; E542-R546 IonicContact OE1-CZ 3.83Å; E542-R546 IonicContact OE1-NE 3.79Å; E542-R546 IonicContact OE1-NH2 3.62Å; E542-R546 PolarHBondContact OE1-NH2 2.58Å
543	V	84.6	Confident	79.5	Confident	72 Å²	72	69.6 Å²	69.6	44%	0.436	34%	0.338	S	S	.	.	H	α-helix	trans	-66.6	-51.5	174	170.9	0	0	0	0	110.9	L539 K540 F541 L545 R546 L547	L539-V543 HydrophobicContact CD1-CG2 4.35Å; L539-V543 HydrophobicContact CG-CG2 4.42Å; L539-V543 WeakPolarHBondContact O-CB 3.32Å; L539-V543 VanDerWaalsContact O-CG2 3.3Å; L539-V543 WeakPolarHBondContact O-CG2 3.46Å; L539-V543 PolarHBondContact O-N 2.81Å; K540-V543 PolarHBondContact O-N 3.03Å; F541-V543 VanDerWaalsContact C-N 3.35Å; F541-V543 PolarHBondContact O-N 3.35Å; V543-L545 PolarHBondContact O-N 2.85Å; V543-R546 PolarHBondContact O-N 3.21Å; V543-R546 VanDerWaalsContact O-N 3.15Å; V543-L547 HydrophobicContact CG1-CD1 4Å; V543-L547 HydrophobicContact CG1-CG 4.43Å; V543-L547 WeakPolarHBondContact O-CG 3.46Å; V543-L547 PolarHBondContact O-N 3.01Å
544	A	82.3	Confident	79.6	Confident	34 Å²	34	70.9 Å²	70.9	28%	0.281	35%	0.348	S	S	.	.	H	α-helix	trans	-55.5	-41.3	177.8	0	0	0	0	0	111	L406 K540 F541 L547 E548	L406-A544 HydrophobicContact CD2-CB 4.08Å; K540-A544 VanDerWaalsContact O-CB 3.28Å; K540-A544 WeakPolarHBondContact O-CB 3.33Å; K540-A544 PolarHBondContact O-N 2.86Å; F541-A544 PolarHBondContact O-N 2.72Å; A544-L547 PolarHBondContact O-N 3.49Å; A544-E548 PolarHBondContact O-N 3.45Å
545	L	76	Confident	79.7	Confident	6 Å²	6	73.2 Å²	73.2	3%	0.031	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-48.3	177.2	-156.8	70.7	0	0	0	113.4	I405 L406 W442 F502 F541 E542 V543 L547 E548 T549	I405-L545 HydrophobicContact CG2-CD1 3.45Å; I405-L545 VanDerWaalsContact CG2-CD1 3.45Å; L406-L545 HydrophobicContact CD2-CD1 4.01Å; W442-L545 HydrophobicContact CH2-CD1 3.13Å; W442-L545 HydrophobicContact CH2-CD2 3.64Å; W442-L545 HydrophobicContact CH2-CG 3.26Å; W442-L545 HydrophobicContact CZ2-CD1 3.52Å; W442-L545 HydrophobicContact CZ2-CG 4.09Å; W442-L545 HydrophobicContact CZ3-CD1 4.24Å; W442-L545 HydrophobicContact CZ3-CD2 4.08Å; W442-L545 HydrophobicContact CZ3-CG 3.92Å; F502-L545 HydrophobicContact CD2-CD2 3.47Å; F502-L545 VanDerWaalsContact CD2-CD2 3.47Å; F502-L545 HydrophobicContact CE2-CD2 3.12Å; F502-L545 HydrophobicContact CZ-CD2 4.16Å; F541-L545 HydrophobicContact CE1-CD2 4.33Å; F541-L545 HydrophobicContact CE2-CD1 4.41Å; F541-L545 HydrophobicContact CZ-CD1 4.18Å; F541-L545 HydrophobicContact CZ-CD2 4.47Å; F541-L545 VanDerWaalsContact O-CB 3.23Å; F541-L545 WeakPolarHBondContact O-CB 3.41Å; F541-L545 PolarHBondContact O-N 2.8Å; E542-L545 WeakPolarHBondContact O-CB 3.45Å; V543-L545 PolarHBondContact O-N 2.85Å; L545-L547 VanDerWaalsContact C-N 3.26Å; L545-L547 PolarHBondContact O-N 2.84Å; L545-E548 PolarHBondContact O-N 3.37Å; L545-T549 PolarHBondContact O-N 3.23Å; L545-T549 PolarHBondContact O-OG1 3.46Å
546	R	80.5	Confident	79.4	Confident	164 Å²	164	69.8 Å²	69.8	62%	0.619	34%	0.341	S	S	*	.	H	α-helix	trans	-63.5	-36.3	178.6	-73.6	177.2	-171.4	-155.1	6.1	111.2	E542 V543 L550	E542-R546 VanDerWaalsContact O-CG 3.28Å; E542-R546 WeakPolarHBondContact O-CG 3.45Å; E542-R546 PolarHBondContact O-N 2.8Å; E542-R546 IonicContact OE1-CZ 3.83Å; E542-R546 IonicContact OE1-NE 3.79Å; E542-R546 IonicContact OE1-NH2 3.62Å; E542-R546 PolarHBondContact OE1-NH2 2.58Å; V543-R546 PolarHBondContact O-N 3.21Å; V543-R546 VanDerWaalsContact O-N 3.15Å; R546-L550 WeakPolarHBondContact O-CB 3.33Å; R546-L550 PolarHBondContact O-N 3.09Å
547	L	82.8	Confident	79.3	Confident	104 Å²	104	67.7 Å²	67.7	55%	0.545	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-45.1	174.3	-70.1	172.9	0	0	0	111.3	V543 A544 L545 L550 A551	V543-L547 HydrophobicContact CG1-CD1 4Å; V543-L547 HydrophobicContact CG1-CG 4.43Å; V543-L547 WeakPolarHBondContact O-CG 3.46Å; V543-L547 PolarHBondContact O-N 3.01Å; A544-L547 PolarHBondContact O-N 3.49Å; L545-L547 VanDerWaalsContact C-N 3.26Å; L545-L547 PolarHBondContact O-N 2.84Å; L547-L550 PolarHBondContact O-N 3.04Å; L547-A551 WeakPolarHBondContact O-CB 3.35Å; L547-A551 PolarHBondContact O-N 3.42Å
548	E	76.6	Confident	79.4	Confident	72 Å²	72	71.2 Å²	71.2	34%	0.336	36%	0.36	S	S	.	.	H	α-helix	trans	-60.8	-48	174.2	-79.6	-61.2	148.4	0	0	112	A544 L545 L550 A551 M552	A544-E548 PolarHBondContact O-N 3.45Å; L545-E548 PolarHBondContact O-N 3.37Å; E548-L550 VanDerWaalsContact C-N 3.3Å; E548-L550 PolarHBondContact O-N 3.03Å; E548-A551 PolarHBondContact O-N 3.17Å; E548-M552 WeakPolarHBondContact O-CG 3.31Å; E548-M552 PolarHBondContact O-N 3.47Å
549	T	73.6	Confident	79.3	Confident	29 Å²	29	68.7 Å²	68.7	18%	0.178	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-40.4	176.7	-51.3	0	0	0	0	111.6	W442 L545 R553	W442-T549 HydrophobicContact CE3-CG2 4.47Å; W442-T549 WeakPolarHBondContact CZ3-OG1 3.46Å; L545-T549 PolarHBondContact O-N 3.23Å; L545-T549 PolarHBondContact O-OG1 3.46Å; T549-R553 WeakPolarHBondContact O-CG 3.21Å; T549-R553 PolarHBondContact O-N 3.44Å
550	L	80.1	Confident	79	Confident	92 Å²	92	68.1 Å²	68.1	48%	0.482	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-46.4	176.7	-178.8	69.4	0	0	0	111	R546 L547 E548 M552 R553 L554	R546-L550 WeakPolarHBondContact O-CB 3.33Å; R546-L550 PolarHBondContact O-N 3.09Å; L547-L550 PolarHBondContact O-N 3.04Å; E548-L550 VanDerWaalsContact C-N 3.3Å; E548-L550 PolarHBondContact O-N 3.03Å; L550-M552 VanDerWaalsContact C-N 3.34Å; L550-M552 PolarHBondContact O-N 2.87Å; L550-R553 PolarHBondContact O-N 3.1Å; L550-L554 HydrophobicContact CD1-CD1 4.47Å; L550-L554 HydrophobicContact CD1-CG 4.47Å; L550-L554 HydrophobicContact CG-CD1 4.05Å; L550-L554 HydrophobicContact CG-CG 4.43Å; L550-L554 WeakPolarHBondContact O-CB 3.49Å; L550-L554 WeakPolarHBondContact O-CG 3.42Å; L550-L554 PolarHBondContact O-N 3.01Å
551	A	78.8	Confident	78.9	Confident	44 Å²	44	66.1 Å²	66.1	36%	0.364	34%	0.34	S	S	.	.	H	α-helix	trans	-58.7	-46	177.3	0	0	0	0	0	110.9	L547 E548 R553 L554 T555	L547-A551 WeakPolarHBondContact O-CB 3.35Å; L547-A551 PolarHBondContact O-N 3.42Å; E548-A551 PolarHBondContact O-N 3.17Å; A551-R553 PolarHBondContact O-N 3.44Å; A551-L554 PolarHBondContact O-N 3.33Å; A551-T555 WeakPolarHBondContact O-CB 3.37Å; A551-T555 PolarHBondContact O-N 2.91Å; A551-T555 PolarHBondContact O-OG1 2.78Å
552	M	73.1	Confident	79.1	Confident	28 Å²	28	68.5 Å²	68.5	14%	0.138	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-46	175	-70.5	178.5	-171.7	0	0	112.2	R407 W442 E548 L550 L554 T555 A556	R407-M552 VanDerWaalsContact CD-CE 3.47Å; W442-M552 HydrophobicContact CG-SD 4.28Å; E548-M552 WeakPolarHBondContact O-CG 3.31Å; E548-M552 PolarHBondContact O-N 3.47Å; L550-M552 VanDerWaalsContact C-N 3.34Å; L550-M552 PolarHBondContact O-N 2.87Å; M552-L554 PolarHBondContact O-N 3.48Å; M552-T555 PolarHBondContact O-N 3.14Å; M552-A556 WeakPolarHBondContact O-CB 3.46Å; M552-A556 PolarHBondContact O-N 2.9Å
553	R	75	Confident	79.1	Confident	170 Å²	170	67.1 Å²	67.1	64%	0.642	35%	0.348	S	S	*	.	H	α-helix	trans	-62.2	-42.9	177.1	-74.5	175.7	-178.8	-176	0.9	112	T549 L550 A551 A556 L557	T549-R553 WeakPolarHBondContact O-CG 3.21Å; T549-R553 PolarHBondContact O-N 3.44Å; L550-R553 PolarHBondContact O-N 3.1Å; A551-R553 PolarHBondContact O-N 3.44Å; R553-A556 PolarHBondContact O-N 3.26Å; R553-L557 WeakPolarHBondContact O-CB 3.23Å; R553-L557 VanDerWaalsContact O-CG 3.23Å; R553-L557 WeakPolarHBondContact O-CG 3.47Å; R553-L557 PolarHBondContact O-N 2.89Å
554	L	80.8	Confident	79.1	Confident	102 Å²	102	73.7 Å²	73.7	53%	0.534	37%	0.365	S	S	.	.	H	α-helix	trans	-64.5	-43.7	177.3	-72.1	173.5	0	0	0	111.3	L550 A551 M552 L557 L558	L550-L554 HydrophobicContact CD1-CD1 4.47Å; L550-L554 HydrophobicContact CD1-CG 4.47Å; L550-L554 HydrophobicContact CG-CD1 4.05Å; L550-L554 HydrophobicContact CG-CG 4.43Å; L550-L554 WeakPolarHBondContact O-CB 3.49Å; L550-L554 WeakPolarHBondContact O-CG 3.42Å; L550-L554 PolarHBondContact O-N 3.01Å; A551-L554 PolarHBondContact O-N 3.33Å; M552-L554 PolarHBondContact O-N 3.48Å; L554-L557 PolarHBondContact O-N 2.77Å; L554-L558 WeakPolarHBondContact O-CB 3.27Å; L554-L558 PolarHBondContact O-N 2.95Å
555	T	78.1	Confident	79.4	Confident	71 Å²	71	77.7 Å²	77.7	44%	0.436	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-41.5	176.5	-54.4	0	0	0	0	111.2	A551 M552 L558 A559 Y577	A551-T555 WeakPolarHBondContact O-CB 3.37Å; A551-T555 PolarHBondContact O-N 2.91Å; A551-T555 PolarHBondContact O-OG1 2.78Å; M552-T555 PolarHBondContact O-N 3.14Å; T555-L558 PolarHBondContact O-N 3.31Å; T555-A559 VanDerWaalsContact O-CB 3.32Å; T555-A559 WeakPolarHBondContact O-CB 3.35Å; T555-A559 PolarHBondContact O-N 2.85Å; T555-Y577 VanDerWaalsContact CB-OH 3.26Å; T555-Y577 WeakPolarHBondContact CB-OH 3.34Å; T555-Y577 HydrophobicContact CG2-CE1 3.88Å; T555-Y577 WeakPolarHBondContact CG2-OH 3.25Å
556	A	73.2	Confident	79.6	Confident	2 Å²	2	82.5 Å²	82.5	2%	0.017	42%	0.415	C	S	.	.	H	α-helix	trans	-66.5	-37.6	174.4	0	0	0	0	0	112.2	M552 R553 R560 Y577 L578	M552-A556 WeakPolarHBondContact O-CB 3.46Å; M552-A556 PolarHBondContact O-N 2.9Å; R553-A556 PolarHBondContact O-N 3.26Å; A556-R560 WeakPolarHBondContact O-CB 3.27Å; A556-R560 PolarHBondContact O-N 3.46Å; A556-R560 PolarHBondContact O-NE 3.45Å; A556-Y577 HydrophobicContact CB-CD1 4.46Å; A556-Y577 HydrophobicContact CB-CE1 4.07Å; A556-L578 HydrophobicContact CB-CD2 4.44Å; A556-L578 WeakPolarHBondContact O-CD2 3.43Å
557	L	80.6	Confident	79.6	Confident	100 Å²	100	80.4 Å²	80.4	52%	0.524	42%	0.416	S	S	.	.	H	α-helix	trans	-66.6	-43.2	173.9	-75.5	170.3	0	0	0	111.6	R553 L554 R560 A561	R553-L557 WeakPolarHBondContact O-CB 3.23Å; R553-L557 VanDerWaalsContact O-CG 3.23Å; R553-L557 WeakPolarHBondContact O-CG 3.47Å; R553-L557 PolarHBondContact O-N 2.89Å; L554-L557 PolarHBondContact O-N 2.77Å; L557-R560 WeakPolarHBondContact O-CB 3.39Å; L557-R560 PolarHBondContact O-N 3.14Å; L557-A561 WeakPolarHBondContact O-CB 3.44Å; L557-A561 PolarHBondContact O-N 3.04Å
558	L	83.5	Confident	79.3	Confident	106 Å²	106	78 Å²	78	56%	0.555	41%	0.405	S	S	*	.	H	α-helix	trans	-62	-48.6	176.6	179.1	65.3	0	0	0	110.8	L554 T555 R560 A561 L562	L554-L558 WeakPolarHBondContact O-CB 3.27Å; L554-L558 PolarHBondContact O-N 2.95Å; T555-L558 PolarHBondContact O-N 3.31Å; L558-R560 VanDerWaalsContact C-N 3.3Å; L558-R560 PolarHBondContact O-N 2.97Å; L558-A561 WeakPolarHBondContact O-CB 3.24Å; L558-A561 PolarHBondContact O-N 3.09Å; L558-A561 VanDerWaalsContact O-N 3.14Å; L558-L562 HydrophobicContact CD1-CG 4.44Å; L558-L562 HydrophobicContact CG-CD1 4.14Å; L558-L562 HydrophobicContact CG-CG 4.48Å; L558-L562 WeakPolarHBondContact O-CG 3.43Å; L558-L562 PolarHBondContact O-N 3.17Å
559	A	76.7	Confident	78.9	Confident	12 Å²	12	79.1 Å²	79.1	10%	0.099	42%	0.419	C	S	.	.	H	α-helix	trans	-62.1	-38.1	176.7	0	0	0	0	0	111.4	T555 A561 L562 V563 L574 L578	T555-A559 VanDerWaalsContact O-CB 3.32Å; T555-A559 WeakPolarHBondContact O-CB 3.35Å; T555-A559 PolarHBondContact O-N 2.85Å; A559-A561 VanDerWaalsContact C-N 3.33Å; A559-A561 PolarHBondContact O-N 3.4Å; A559-L562 PolarHBondContact O-N 2.95Å; A559-V563 WeakPolarHBondContact O-CG2 3.32Å; A559-V563 PolarHBondContact O-N 3.4Å; A559-L574 HydrophobicContact CB-CD1 4.11Å; A559-L578 HydrophobicContact CB-CD1 4.4Å; A559-L578 HydrophobicContact CB-CD2 3.46Å; A559-L578 VanDerWaalsContact CB-CD2 3.46Å; A559-L578 HydrophobicContact CB-CG 4.26Å
560	R	77.4	Confident	78.2	Confident	76 Å²	76	81.9 Å²	81.9	29%	0.287	44%	0.437	S	S	.	.	H	α-helix	trans	-61.9	-41.7	173.4	-104.7	172.4	-70.1	-159.8	0.3	111.5	A556 L557 L558 R564 L578 T580	A556-R560 WeakPolarHBondContact O-CB 3.27Å; A556-R560 PolarHBondContact O-N 3.46Å; A556-R560 PolarHBondContact O-NE 3.45Å; L557-R560 WeakPolarHBondContact O-CB 3.39Å; L557-R560 PolarHBondContact O-N 3.14Å; L558-R560 VanDerWaalsContact C-N 3.3Å; L558-R560 PolarHBondContact O-N 2.97Å; R560-R564 WeakPolarHBondContact O-CB 3.32Å; R560-R564 PolarHBondContact O-N 2.95Å; R560-R564 WeakPolarHBondContact O-CG 3.34Å; R560-L578 PolarHBondContact NH1-O 3.02Å; R560-L578 PolarHBondContact NE-O 3.29Å; R560-L578 VanDerWaalsContact N-CD2 3.31Å; R560-L578 VanDerWaalsContact CZ-O 3.25Å; R560-L578 HydrophobicContact CG-CG 4.17Å; R560-L578 HydrophobicContact CG-CD2 3.76Å; R560-L578 HydrophobicContact CG-CD1 4.1Å; R560-L578 HydrophobicContact CG-CB 4.07Å; R560-L578 HydrophobicContact CB-CD2 4.1Å; R560-T580 PolarHBondContact NH1-O 3.26Å; R560-T580 PolarHBondContact NH2-O 3.46Å
561	A	82.6	Confident	77.2	Confident	43 Å²	43	79.6 Å²	79.6	36%	0.355	43%	0.432	S	S	.	.	H	α-helix	trans	-65.8	-44.6	176.5	0	0	0	0	0	111.5	L557 L558 A559 V563 R564 L565	L557-A561 WeakPolarHBondContact O-CB 3.44Å; L557-A561 PolarHBondContact O-N 3.04Å; L558-A561 WeakPolarHBondContact O-CB 3.24Å; L558-A561 PolarHBondContact O-N 3.09Å; L558-A561 VanDerWaalsContact O-N 3.14Å; A559-A561 VanDerWaalsContact C-N 3.33Å; A559-A561 PolarHBondContact O-N 3.4Å; A561-V563 PolarHBondContact O-N 2.93Å; A561-R564 PolarHBondContact O-N 3.31Å; A561-L565 WeakPolarHBondContact O-CB 3.37Å; A561-L565 VanDerWaalsContact O-CG 3.23Å; A561-L565 WeakPolarHBondContact O-CG 3.06Å; A561-L565 PolarHBondContact O-N 3Å
562	L	83.9	Confident	75.9	Confident	56 Å²	56	85.5 Å²	85.5	29%	0.293	45%	0.452	S	S	.	.	H	α-helix	trans	-62.6	-39.9	178.4	-70.8	173.5	0	0	0	112.6	L558 A559 L565 S566 L567 V568	L558-L562 HydrophobicContact CD1-CG 4.44Å; L558-L562 HydrophobicContact CG-CD1 4.14Å; L558-L562 HydrophobicContact CG-CG 4.48Å; L558-L562 WeakPolarHBondContact O-CG 3.43Å; L558-L562 PolarHBondContact O-N 3.17Å; A559-L562 PolarHBondContact O-N 2.95Å; L562-L565 PolarHBondContact O-N 3.37Å; L562-S566 PolarHBondContact O-N 3.03Å; L562-L567 HydrophobicContact CD2-CB 4.22Å; L562-L567 HydrophobicContact CD2-CD1 3.85Å; L562-L567 PolarHBondContact O-N 3.48Å; L562-V568 HydrophobicContact CB-CG2 4.03Å; L562-V568 HydrophobicContact CD1-CG2 4.39Å
563	V	81.4	Confident	74.8	Confident	26 Å²	26	92 Å²	92	16%	0.158	48%	0.481	C	S	.	.	H	α-helix	trans	-66.1	-44.9	174	172.7	0	0	0	0	111.1	A559 A561 L565 S566 P570 L574 L578	A559-V563 WeakPolarHBondContact O-CG2 3.32Å; A559-V563 PolarHBondContact O-N 3.4Å; A561-V563 PolarHBondContact O-N 2.93Å; V563-L565 VanDerWaalsContact C-N 3.26Å; V563-L565 PolarHBondContact O-N 3.05Å; V563-S566 PolarHBondContact O-N 3.39Å; V563-P570 HydrophobicContact CG1-CB 4.5Å; V563-L574 HydrophobicContact CG2-CD2 3.35Å; V563-L574 HydrophobicContact CG2-CG 4.33Å; V563-L578 HydrophobicContact CB-CD1 4.33Å; V563-L578 HydrophobicContact CG2-CD1 3.75Å
564	R	84.4	Confident	73.6	Confident	211 Å²	211	85.7 Å²	85.7	80%	0.796	46%	0.461	S	S	*	.	H	α-helix	trans	-62.4	-33	176.3	-77.7	-179.6	-175.2	173.5	2.3	113.1	R560 A561 S566	R560-R564 WeakPolarHBondContact O-CB 3.32Å; R560-R564 PolarHBondContact O-N 2.95Å; R560-R564 WeakPolarHBondContact O-CG 3.34Å; A561-R564 PolarHBondContact O-N 3.31Å; R564-S566 PolarHBondContact O-N 3.14Å
565	L	89.3	Confident	72.1	Confident	117 Å²	117	86.7 Å²	86.7	61%	0.613	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	3.5	176.3	-67.1	171.7	0	0	0	113	A561 L562 V563 L567	A561-L565 WeakPolarHBondContact O-CB 3.37Å; A561-L565 VanDerWaalsContact O-CG 3.23Å; A561-L565 WeakPolarHBondContact O-CG 3.06Å; A561-L565 PolarHBondContact O-N 3Å; L562-L565 PolarHBondContact O-N 3.37Å; V563-L565 VanDerWaalsContact C-N 3.26Å; V563-L565 PolarHBondContact O-N 3.05Å; L565-L567 VanDerWaalsContact O-N 3.08Å; L565-L567 PolarHBondContact O-N 3.43Å; L565-L567 HydrophobicContact CB-CG 3.99Å; L565-L567 HydrophobicContact CD1-CD1 4.22Å; L565-L567 HydrophobicContact CB-CD1 3.95Å
566	S	79.8	Confident	70.7	Confident	107 Å²	107	86 Å²	86	75%	0.748	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	21.8	-177.7	-51.5	0	0	0	0	114.2	L562 V563 R564 V568	L562-S566 PolarHBondContact O-N 3.03Å; V563-S566 PolarHBondContact O-N 3.39Å; R564-S566 PolarHBondContact O-N 3.14Å; S566-V568 VanDerWaalsContact C-N 3.35Å
567	L	80.6	Confident	69.6	Low	121 Å²	121	89.3 Å²	89.3	63%	0.634	46%	0.462	S	S	*	.	S	Bend	trans	-81.3	-19	178.6	-68.1	172.7	0	0	0	112.2	L562 L565	L562-L567 HydrophobicContact CD2-CB 4.22Å; L562-L567 HydrophobicContact CD2-CD1 3.85Å; L562-L567 PolarHBondContact O-N 3.48Å; L565-L567 VanDerWaalsContact O-N 3.08Å; L565-L567 PolarHBondContact O-N 3.43Å; L565-L567 HydrophobicContact CB-CG 3.99Å; L565-L567 HydrophobicContact CD1-CD1 4.22Å; L565-L567 HydrophobicContact CB-CD1 3.95Å
568	V	76.3	Confident	67.6	Low	52 Å²	52	85 Å²	85	32%	0.315	44%	0.44	S	S	.	.	S	Bend	trans	-134.7	132.3	176.9	-178.6	0	0	0	0	107.8	L562 S566 L574	L562-V568 HydrophobicContact CB-CG2 4.03Å; L562-V568 HydrophobicContact CD1-CG2 4.39Å; S566-V568 VanDerWaalsContact C-N 3.35Å; V568-L574 HydrophobicContact CG1-CD2 3.79Å
569	P	68.5	Low	65.7	Low	96 Å²	96	87.7 Å²	87.7	62%	0.623	45%	0.45	S	S	*	.			trans	-61.9	146.6	176.4	24.6	-32.2	0	0	0	110.3	A571	P569-A571 VanDerWaalsContact C-N 3.26Å; P569-A571 PolarHBondContact O-N 3.39Å
570	P	58.6	Low	64.1	Low	87 Å²	87	92.4 Å²	92.4	57%	0.565	48%	0.477	S	S	*	.			trans	-67.8	87.3	172.3	27.4	-31.6	0	0	0	109.5	V563 Y575	V563-P570 HydrophobicContact CG1-CB 4.5Å; P570-Y575 HydrophobicContact CB-CD2 3.92Å; P570-Y575 HydrophobicContact CB-CE2 3.49Å; P570-Y575 VanDerWaalsContact CB-CE2 3.49Å
571	A	58.4	Low	63.4	Low	45 Å²	45	93.2 Å²	93.2	37%	0.372	49%	0.487	S	S	.	.			trans	-75.4	141.9	168.3	0	0	0	0	0	109.1	P569 E573 L574 Y575	P569-A571 VanDerWaalsContact C-N 3.26Å; P569-A571 PolarHBondContact O-N 3.39Å; A571-E573 PolarHBondContact O-N 2.82Å; A571-L574 WeakPolarHBondContact O-CA 3.47Å; A571-L574 PolarHBondContact O-N 3.36Å; A571-L574 WeakPolarHBondContact O-CB 3.35Å; A571-L574 HydrophobicContact CB-CB 4.14Å; A571-Y575 PolarHBondContact O-N 3.07Å
572	E	51.7	Low	62.4	Low	167 Å²	167	95.8 Å²	95.8	78%	0.78	49%	0.494	S	S	*	.	H	α-helix	trans	-56.9	-39.1	178.8	-142.7	163.2	-163.6	0	0	111.2	L574 Y575 Q576	E572-L574 VanDerWaalsContact C-N 3.32Å; E572-L574 PolarHBondContact O-N 3.42Å; E572-Y575 PolarHBondContact O-N 3.48Å; E572-Q576 PolarHBondContact O-N 3.12Å; E572-Q576 VanDerWaalsContact O-N 3.09Å
573	E	50.9	Low	61.2	Low	164 Å²	164	98.1 Å²	98.1	77%	0.766	51%	0.505	S	S	*	.	H	α-helix	trans	-63	-33.9	172.8	-63.1	-178.3	172.2	0	0	113.3	A571 Y577	A571-E573 PolarHBondContact O-N 2.82Å; E573-Y577 PolarHBondContact O-N 3.08Å
574	L	49.9	Very low	60.1	Low	39 Å²	39	102.3 Å²	102.3	20%	0.204	53%	0.525	C	S	.	.	H	α-helix	trans	-76.4	-38.4	177.3	-161.8	70.7	0	0	0	110	A559 V563 V568 A571 E572 Q576 Y577 L578	A559-L574 HydrophobicContact CB-CD1 4.11Å; V563-L574 HydrophobicContact CG2-CD2 3.35Å; V563-L574 HydrophobicContact CG2-CG 4.33Å; V568-L574 HydrophobicContact CG1-CD2 3.79Å; A571-L574 WeakPolarHBondContact O-CA 3.47Å; A571-L574 PolarHBondContact O-N 3.36Å; A571-L574 WeakPolarHBondContact O-CB 3.35Å; A571-L574 HydrophobicContact CB-CB 4.14Å; E572-L574 VanDerWaalsContact C-N 3.32Å; E572-L574 PolarHBondContact O-N 3.42Å; L574-Q576 PolarHBondContact O-N 3.32Å; L574-Y577 CarbonylContact O-C 3.59Å; L574-Y577 WeakPolarHBondContact O-CB 3.27Å; L574-Y577 PolarHBondContact O-N 3.35Å; L574-Y577 VanDerWaalsContact O-N 3.14Å; L574-L578 WeakPolarHBondContact O-CG 3.47Å; L574-L578 PolarHBondContact O-N 3.45Å; L574-L578 WeakPolarHBondContact O-CB 3.4Å; L574-L578 VanDerWaalsContact O-CB 3.24Å; L574-L578 HydrophobicContact CG-CG 4.3Å; L574-L578 HydrophobicContact CG-CD1 3.95Å; L574-L578 HydrophobicContact CD2-CD1 4.35Å
575	Y	48.1	Very low	58.5	Low	123 Å²	123	95.5 Å²	95.5	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-42.4	174.1	-105.2	-83.4	0	0	0	112.4	P570 A571 E572 Y577 L578 E579	P570-Y575 HydrophobicContact CB-CD2 3.92Å; P570-Y575 HydrophobicContact CB-CE2 3.49Å; P570-Y575 VanDerWaalsContact CB-CE2 3.49Å; A571-Y575 PolarHBondContact O-N 3.07Å; E572-Y575 PolarHBondContact O-N 3.48Å; Y575-Y577 VanDerWaalsContact C-N 3.29Å; Y575-Y577 PolarHBondContact O-N 3.44Å; Y575-L578 CarbonylContact O-C 3.56Å; Y575-L578 PolarHBondContact O-N 3.03Å; Y575-E579 PolarHBondContact O-N 3.49Å
576	Q	47.9	Very low	56.5	Low	56 Å²	56	94.1 Å²	94.1	26%	0.262	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-33.8	173.3	-73.5	173.5	-2.4	0	0	113.1	E450 E572 L574 L578	E450-Q576 PolarHBondContact OE1-NE2 3.48Å; E450-Q576 PolarHBondContact OE2-NE2 3.34Å; E572-Q576 PolarHBondContact O-N 3.12Å; E572-Q576 VanDerWaalsContact O-N 3.09Å; L574-Q576 PolarHBondContact O-N 3.32Å; Q576-L578 VanDerWaalsContact C-N 3.33Å
577	Y	50.4	Low	54.8	Low	71 Å²	71	93.1 Å²	93.1	28%	0.278	48%	0.484	S	S	.	.	H	α-helix	trans	-71.4	-29.4	172.2	-170.8	-101.5	0	0	0	112.2	T555 A556 E573 L574 Y575 T580	T555-Y577 VanDerWaalsContact CB-OH 3.26Å; T555-Y577 WeakPolarHBondContact CB-OH 3.34Å; T555-Y577 HydrophobicContact CG2-CE1 3.88Å; T555-Y577 WeakPolarHBondContact CG2-OH 3.25Å; A556-Y577 HydrophobicContact CB-CD1 4.46Å; A556-Y577 HydrophobicContact CB-CE1 4.07Å; E573-Y577 PolarHBondContact O-N 3.08Å; L574-Y577 CarbonylContact O-C 3.59Å; L574-Y577 WeakPolarHBondContact O-CB 3.27Å; L574-Y577 PolarHBondContact O-N 3.35Å; L574-Y577 VanDerWaalsContact O-N 3.14Å; Y575-Y577 VanDerWaalsContact C-N 3.29Å; Y575-Y577 PolarHBondContact O-N 3.44Å; Y577-T580 PolarHBondContact O-OG1 2.92Å
578	L	39.4	Very low	52.8	Low	11 Å²	11	91 Å²	91	6%	0.058	47%	0.472	C	S	.	.	H	α-helix	trans	-96.1	-18.7	-170.9	-71.8	-175.6	0	0	0	116.3	A556 A559 R560 V563 L574 Y575 Q576 T580	A556-L578 HydrophobicContact CB-CD2 4.44Å; A556-L578 WeakPolarHBondContact O-CD2 3.43Å; A559-L578 HydrophobicContact CB-CD1 4.4Å; A559-L578 HydrophobicContact CB-CD2 3.46Å; A559-L578 VanDerWaalsContact CB-CD2 3.46Å; A559-L578 HydrophobicContact CB-CG 4.26Å; R560-L578 PolarHBondContact NH1-O 3.02Å; R560-L578 PolarHBondContact NE-O 3.29Å; R560-L578 VanDerWaalsContact N-CD2 3.31Å; R560-L578 VanDerWaalsContact CZ-O 3.25Å; R560-L578 HydrophobicContact CG-CG 4.17Å; R560-L578 HydrophobicContact CG-CD2 3.76Å; R560-L578 HydrophobicContact CG-CD1 4.1Å; R560-L578 HydrophobicContact CG-CB 4.07Å; R560-L578 HydrophobicContact CB-CD2 4.1Å; V563-L578 HydrophobicContact CB-CD1 4.33Å; V563-L578 HydrophobicContact CG2-CD1 3.75Å; L574-L578 WeakPolarHBondContact O-CG 3.47Å; L574-L578 PolarHBondContact O-N 3.45Å; L574-L578 WeakPolarHBondContact O-CB 3.4Å; L574-L578 VanDerWaalsContact O-CB 3.24Å; L574-L578 HydrophobicContact CG-CG 4.3Å; L574-L578 HydrophobicContact CG-CD1 3.95Å; L574-L578 HydrophobicContact CD2-CD1 4.35Å; Y575-L578 CarbonylContact O-C 3.56Å; Y575-L578 PolarHBondContact O-N 3.03Å; Q576-L578 VanDerWaalsContact C-N 3.33Å; L578-T580 PolarHBondContact O-N 2.81Å
579	E	44	Very low	50.9	Low	162 Å²	162	94.3 Å²	94.3	76%	0.757	49%	0.485	S	S	*	.			trans	-71.6	4.3	171.3	-76.5	-169.7	163.8	0	0	113.5	Y575	Y575-E579 PolarHBondContact O-N 3.49Å
580	T	42.9	Very low	49.3	Very low	110 Å²	110	94.1 Å²	94.1	68%	0.675	47%	0.473	S	S	*	.			trans	-80	0	174	54.4	0	0	0	0	115.1	R560 Y577 L578	R560-T580 PolarHBondContact NH1-O 3.26Å; R560-T580 PolarHBondContact NH2-O 3.46Å; Y577-T580 PolarHBondContact O-OG1 2.92Å; L578-T580 PolarHBondContact O-N 2.81Å

Retrieved 580 of 580 residues in 177.1 ms (Link to these results)

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