A0A077ZDF8_TRITR Loading...

Zip domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZDF8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 673 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	31.9	Very low	31.8	Very low	200 Å²	200	150.6 Å²	150.6	99%	0.985	75%	0.748	S	S	*	*				0	-57	0	-96.6	165.3	78.8	0	0	113	R3 L4	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 2.88Å; M1-L4 PolarHBondContact O-N 3.12Å; M1-L4 VanDerWaalsContact O-N 3.09Å
2	Y	28.9	Very low	31.9	Very low	208 Å²	208	144.3 Å²	144.3	82%	0.816	75%	0.75	S	S	*	*	H	α-helix	trans	-60.6	-26.5	176.7	-96.4	-92.4	0	0	0	116
3	R	27.2	Very low	32	Very low	225 Å²	225	145.2 Å²	145.2	85%	0.849	76%	0.755	S	S	*	*	H	α-helix	trans	-76.5	-14	174.1	-94.7	-178.8	176	-179.9	-1.2	114.9	M1 S7	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 2.88Å; R3-S7 PolarHBondContact O-OG 3.05Å
4	L	33.9	Very low	32	Very low	149 Å²	149	147.6 Å²	147.6	78%	0.78	76%	0.757	S	S	*	*	H	α-helix	trans	-92.4	-20.6	-174.2	-99	134.7	0	0	0	113.8	M1	M1-L4 PolarHBondContact O-N 3.12Å; M1-L4 VanDerWaalsContact O-N 3.09Å
5	L	34.9	Very low	32.1	Very low	116 Å²	116	150.3 Å²	150.3	61%	0.607	77%	0.765	S	S	*	*	H	α-helix	trans	-94.6	-18.6	-178.5	-80.6	156	0	0	0	114.3
6	F	34.7	Very low	32.2	Very low	170 Å²	170	146.3 Å²	146.3	75%	0.746	76%	0.762	S	S	*	*	S	Bend	trans	-111.4	13.3	-177.8	-79.5	-82.7	0	0	0	114.8	V8	F6-V8 VanDerWaalsContact C-N 3.28Å; F6-V8 PolarHBondContact O-N 3Å
7	S	31.6	Very low	32.4	Very low	98 Å²	98	149.6 Å²	149.6	69%	0.685	77%	0.769	S	S	*	*			trans	-92.5	33.8	178.8	-61	0	0	0	0	113.4	R3	R3-S7 PolarHBondContact O-OG 3.05Å
8	V	33.9	Very low	32.8	Very low	102 Å²	102	148.9 Å²	148.9	62%	0.618	77%	0.772	S	S	*	*	S	Bend	trans	-73.6	135.9	158.1	179.4	0	0	0	0	106.3	F6 I10	F6-V8 VanDerWaalsContact C-N 3.28Å; F6-V8 PolarHBondContact O-N 3Å; V8-I10 PolarHBondContact O-N 3.01Å
9	P	30.3	Very low	33.3	Very low	99 Å²	99	147.1 Å²	147.1	64%	0.643	77%	0.768	S	S	*	*			trans	-72.3	81.4	-177.3	28.5	-28.9	0	0	0	110
10	I	32.6	Very low	33.5	Very low	140 Å²	140	151.3 Å²	151.3	72%	0.718	77%	0.773	S	S	*	*			trans	-78.3	-5.5	162.2	-63.3	178.1	0	0	0	109.9	V8 G12	V8-I10 PolarHBondContact O-N 3.01Å; I10-G12 PolarHBondContact O-N 2.78Å
11	L	30.2	Very low	33.8	Very low	150 Å²	150	153.1 Å²	153.1	79%	0.785	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-92	18.3	179.9	-87.5	157	0	0	0	115.7	L13	L11-L13 VanDerWaalsContact C-N 3.31Å
12	G	32	Very low	34.3	Very low	74 Å²	74	149.6 Å²	149.6	76%	0.763	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-79.8	-5.2	172.7	0	0	0	0	0	115.4	I10	I10-G12 PolarHBondContact O-N 2.78Å
13	L	33.6	Very low	34.8	Very low	157 Å²	157	143.8 Å²	143.8	82%	0.822	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-103.1	3.2	-172.6	-89.1	156.2	0	0	0	114.8	L11	L11-L13 VanDerWaalsContact C-N 3.31Å
14	F	32.9	Very low	35.6	Very low	178 Å²	178	141.2 Å²	141.2	78%	0.781	77%	0.766	S	S	*	*	S	Bend	trans	-112.7	4.5	-173.7	-94.9	-84.5	0	0	0	117
15	E	32.9	Very low	36.3	Very low	188 Å²	188	142.8 Å²	142.8	88%	0.879	77%	0.769	S	S	*	*			trans	-120.5	65.6	170.6	-73.1	-157.7	162	0	0	112.5
16	A	34.2	Very low	36.9	Very low	86 Å²	86	146.2 Å²	146.2	71%	0.711	77%	0.774	S	S	*	*			trans	-96.2	16.6	174.1	0	0	0	0	0	113.7
17	K	34.8	Very low	37.4	Very low	204 Å²	204	144 Å²	144	89%	0.887	78%	0.777	S	S	*	*	S	Bend	trans	-87.2	-9	-173	-145	174.1	-177.7	-177.5	0	115.2
18	V	39.8	Very low	38.4	Very low	137 Å²	137	141.8 Å²	141.8	83%	0.83	77%	0.77	S	S	*	*	S	Bend	trans	-108.7	-10.1	-173.7	179.5	0	0	0	0	114.3
19	V	42	Very low	39.4	Very low	113 Å²	113	141.4 Å²	141.4	69%	0.685	76%	0.763	S	S	*	*			trans	-96.8	10.3	-174.4	-175.1	0	0	0	0	113.3	E21	V19-E21 VanDerWaalsContact C-N 3.31Å; V19-E21 PolarHBondContact O-N 3.28Å
20	R	37.1	Very low	40.1	Very low	231 Å²	231	142.5 Å²	142.5	87%	0.872	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-7.4	-174.1	-125.4	180	-164.3	-172.2	3.6	115.6
21	E	40.8	Very low	40.7	Very low	190 Å²	190	141.4 Å²	141.4	89%	0.888	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-3.7	-171.7	-73.8	-176	163.9	0	0	116.4	V19	V19-E21 VanDerWaalsContact C-N 3.31Å; V19-E21 PolarHBondContact O-N 3.28Å
22	T	41.6	Very low	41.4	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	76%	0.755	S	S	*	*	S	Bend	trans	-113.3	19.4	-178.7	34.5	0	0	0	0	114.9	L24	T22-L24 PolarHBondContact O-N 3.18Å
23	A	39.6	Very low	42.1	Very low	86 Å²	86	143 Å²	143	71%	0.711	74%	0.738	S	S	*	*			trans	-86.7	9.8	-169.3	0	0	0	0	0	117.6
24	L	43.6	Very low	42.5	Very low	171 Å²	171	140.5 Å²	140.5	90%	0.895	72%	0.724	S	S	*	*	S	Bend	trans	-111.3	-10.6	-167.5	-91	158	0	0	0	118.7	T22	T22-L24 PolarHBondContact O-N 3.18Å
25	E	49.9	Very low	43.2	Very low	181 Å²	181	137.2 Å²	137.2	85%	0.846	71%	0.714	S	S	*	*	S	Bend	trans	-111.9	-21	-166.7	-72.3	-168.3	160.7	0	0	118.5
26	R	47.1	Very low	44	Very low	189 Å²	189	134 Å²	134	71%	0.713	70%	0.702	S	S	*	*			trans	-150.4	96.6	-178.9	-67.3	-169.4	-177.4	177.2	5.2	114.5	G28 I29	R26-G28 PolarHBondContact O-N 3.13Å; R26-G28 VanDerWaalsContact O-N 3.14Å; R26-I29 HydrophobicContact CB-CD1 3.86Å; R26-I29 HydrophobicContact CB-CG1 4.11Å; R26-I29 HydrophobicContact CG-CD1 4.32Å; R26-I29 PolarHBondContact O-N 3.22Å
27	P	44.5	Very low	44.3	Very low	123 Å²	123	138.3 Å²	138.3	80%	0.799	70%	0.7	S	S	*	*	H	α-helix	trans	-63.9	-19.4	-179.9	22.3	-30.8	0	0	0	114.6
28	G	53.9	Low	44.8	Very low	52 Å²	52	131.4 Å²	131.4	54%	0.536	68%	0.677	S	S	.	*	H	α-helix	trans	-77.3	-18.5	178.7	0	0	0	0	0	115.9	R26	R26-G28 PolarHBondContact O-N 3.13Å; R26-G28 VanDerWaalsContact O-N 3.14Å
29	I	54	Low	44.9	Very low	93 Å²	93	130.5 Å²	130.5	48%	0.477	66%	0.664	S	S	.	*	H	α-helix	trans	-81.4	-34.9	-178.4	-64.6	176.4	0	0	0	110.7	R26 L31 R32 V33	R26-I29 HydrophobicContact CB-CD1 3.86Å; R26-I29 HydrophobicContact CB-CG1 4.11Å; R26-I29 HydrophobicContact CG-CD1 4.32Å; R26-I29 PolarHBondContact O-N 3.22Å; I29-L31 VanDerWaalsContact C-N 3.31Å; I29-L31 PolarHBondContact O-N 3.33Å; I29-R32 PolarHBondContact O-N 2.97Å; I29-V33 HydrophobicContact CG2-CG2 4.1Å; I29-V33 WeakPolarHBondContact O-CG2 3.45Å; I29-V33 PolarHBondContact O-N 3.5Å
30	L	45.7	Very low	44.9	Very low	122 Å²	122	129 Å²	129	64%	0.639	65%	0.652	S	S	*	*	H	α-helix	trans	-62.4	-38.7	179.6	-141.1	92.8	0	0	0	111.8	V33 L34	L30-V33 PolarHBondContact O-N 3.5Å; L30-L34 HydrophobicContact CD2-CD1 4.16Å; L30-L34 HydrophobicContact CG-CD1 4.42Å; L30-L34 WeakPolarHBondContact O-CB 3.04Å; L30-L34 WeakPolarHBondContact O-CG 3.38Å; L30-L34 PolarHBondContact O-N 2.67Å
31	L	45	Very low	45.1	Very low	117 Å²	117	122.1 Å²	122.1	61%	0.613	64%	0.637	S	S	*	*	H	α-helix	trans	-69	-38	178.5	-158.7	74.3	0	0	0	112.1	I29 L35	I29-L31 VanDerWaalsContact C-N 3.31Å; I29-L31 PolarHBondContact O-N 3.33Å; L31-L35 HydrophobicContact CG-CD1 4.25Å; L31-L35 VanDerWaalsContact O-CB 3.32Å; L31-L35 WeakPolarHBondContact O-CB 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.15Å; L31-L35 PolarHBondContact O-N 3.49Å
32	R	44.2	Very low	45.1	Very low	192 Å²	192	118 Å²	118	73%	0.725	62%	0.621	S	S	*	*	H	α-helix	trans	-68.1	-39.6	172.5	-81.5	-171.9	-172.7	-147	1	112.2	I29 L35 I36	I29-R32 PolarHBondContact O-N 2.97Å; R32-L35 PolarHBondContact O-N 2.78Å; R32-I36 WeakPolarHBondContact O-CB 3.47Å; R32-I36 WeakPolarHBondContact O-CD1 3.45Å; R32-I36 WeakPolarHBondContact O-CG1 3.24Å; R32-I36 PolarHBondContact O-N 3.19Å
33	V	46.6	Very low	44.9	Very low	67 Å²	67	119.3 Å²	119.3	41%	0.406	62%	0.615	S	S	.	*	H	α-helix	trans	-69.1	-36.3	177.6	174	0	0	0	0	111.2	I29 L30 R37	I29-V33 HydrophobicContact CG2-CG2 4.1Å; I29-V33 WeakPolarHBondContact O-CG2 3.45Å; I29-V33 PolarHBondContact O-N 3.5Å; L30-V33 PolarHBondContact O-N 3.5Å; V33-R37 VanDerWaalsContact O-CB 3.28Å; V33-R37 WeakPolarHBondContact O-CB 3.44Å; V33-R37 PolarHBondContact O-N 3.03Å
34	L	42.9	Very low	44.9	Very low	104 Å²	104	122.4 Å²	122.4	55%	0.545	61%	0.61	S	S	.	*	H	α-helix	trans	-70.3	-39.3	174.1	-78.6	162.8	0	0	0	112.5	L30 R37 S38	L30-L34 HydrophobicContact CD2-CD1 4.16Å; L30-L34 HydrophobicContact CG-CD1 4.42Å; L30-L34 WeakPolarHBondContact O-CB 3.04Å; L30-L34 WeakPolarHBondContact O-CG 3.38Å; L30-L34 PolarHBondContact O-N 2.67Å; L34-R37 PolarHBondContact O-N 3.01Å; L34-S38 WeakPolarHBondContact O-CB 3.42Å; L34-S38 PolarHBondContact O-N 2.98Å
35	L	47.3	Very low	44.6	Very low	108 Å²	108	119.6 Å²	119.6	57%	0.565	59%	0.587	S	S	*	*	H	α-helix	trans	-70.4	-31.7	174.5	-81.7	161.5	0	0	0	113.1	L31 R32 S38	L31-L35 HydrophobicContact CG-CD1 4.25Å; L31-L35 VanDerWaalsContact O-CB 3.32Å; L31-L35 WeakPolarHBondContact O-CB 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.15Å; L31-L35 PolarHBondContact O-N 3.49Å; R32-L35 PolarHBondContact O-N 2.78Å; L35-S38 PolarHBondContact O-OG 3.49Å; L35-S38 VanDerWaalsContact O-OG 3.07Å
36	I	48.9	Very low	44	Very low	122 Å²	122	116.3 Å²	116.3	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-74.7	-34.4	172.3	-67.7	166	0	0	0	110.4	R32	R32-I36 WeakPolarHBondContact O-CB 3.47Å; R32-I36 WeakPolarHBondContact O-CD1 3.45Å; R32-I36 WeakPolarHBondContact O-CG1 3.24Å; R32-I36 PolarHBondContact O-N 3.19Å
37	R	41	Very low	43.4	Very low	176 Å²	176	111.5 Å²	111.5	66%	0.664	56%	0.555	S	S	*	*	H	α-helix	trans	-77.1	-23	175.5	-88.6	-174.6	160.8	156.9	-4.4	114.2	V33 L34 Q39 L40	V33-R37 VanDerWaalsContact O-CB 3.28Å; V33-R37 WeakPolarHBondContact O-CB 3.44Å; V33-R37 PolarHBondContact O-N 3.03Å; L34-R37 PolarHBondContact O-N 3.01Å; R37-Q39 PolarHBondContact O-N 3.45Å; R37-L40 HydrophobicContact CB-CD1 4.3Å; R37-L40 HydrophobicContact CG-CD1 4.03Å; R37-L40 WeakPolarHBondContact O-CB 3.49Å; R37-L40 PolarHBondContact O-N 2.94Å; R37-L40 VanDerWaalsContact O-N 3.15Å
38	S	44.7	Very low	43.4	Very low	59 Å²	59	111 Å²	111	41%	0.413	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-9.8	174.9	76	0	0	0	0	113.6	L34 L35 P41	L34-S38 WeakPolarHBondContact O-CB 3.42Å; L34-S38 PolarHBondContact O-N 2.98Å; L35-S38 PolarHBondContact O-OG 3.49Å; L35-S38 VanDerWaalsContact O-OG 3.07Å; S38-P41 WeakPolarHBondContact O-CD 3.34Å; S38-P41 WeakPolarHBondContact O-CG 3.32Å
39	Q	42.3	Very low	43	Very low	118 Å²	118	110.4 Å²	110.4	55%	0.551	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-13.8	172	-64.9	-72.8	-20.8	0	0	113.3	R37 K43	R37-Q39 PolarHBondContact O-N 3.45Å; Q39-K43 PolarHBondContact O-N 3.27Å
40	L	41.3	Very low	42.7	Very low	81 Å²	81	109.2 Å²	109.2	42%	0.424	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-41.6	177.2	-86.6	101.7	0	0	0	114.8	R37 L42 K43 Y44	R37-L40 HydrophobicContact CB-CD1 4.3Å; R37-L40 HydrophobicContact CG-CD1 4.03Å; R37-L40 WeakPolarHBondContact O-CB 3.49Å; R37-L40 PolarHBondContact O-N 2.94Å; R37-L40 VanDerWaalsContact O-N 3.15Å; L40-L42 VanDerWaalsContact C-N 3.31Å; L40-L42 PolarHBondContact O-N 3.38Å; L40-K43 WeakPolarHBondContact O-CB 3.45Å; L40-K43 PolarHBondContact O-N 2.76Å; L40-Y44 WeakPolarHBondContact O-CD2 3.49Å; L40-Y44 PolarHBondContact O-N 2.86Å
41	P	43	Very low	42.7	Very low	86 Å²	86	106.8 Å²	106.8	56%	0.558	50%	0.502	S	S	*	.	H	α-helix	trans	-65.7	-30.4	177.9	21.9	-32.1	0	0	0	113.4	S38 W45	S38-P41 WeakPolarHBondContact O-CD 3.34Å; S38-P41 WeakPolarHBondContact O-CG 3.32Å; P41-W45 WeakPolarHBondContact O-CB 3.32Å; P41-W45 PolarHBondContact O-N 3.44Å
42	L	40.9	Very low	43.3	Very low	105 Å²	105	102.1 Å²	102.1	55%	0.55	48%	0.478	S	S	.	.	H	α-helix	trans	-68.1	-33.3	174	-86.6	143.2	0	0	0	112.7	L40 W45 F46	L40-L42 VanDerWaalsContact C-N 3.31Å; L40-L42 PolarHBondContact O-N 3.38Å; L42-W45 PolarHBondContact O-N 3.09Å; L42-F46 PolarHBondContact O-N 3.2Å
43	K	37	Very low	44.1	Very low	153 Å²	153	97 Å²	97	67%	0.665	46%	0.461	S	S	*	.	H	α-helix	trans	-65	-43.2	176.8	-104.3	-176.6	173.9	-174.3	0	112.8	Q39 L40 W45 F46 F47	Q39-K43 PolarHBondContact O-N 3.27Å; L40-K43 WeakPolarHBondContact O-CB 3.45Å; L40-K43 PolarHBondContact O-N 2.76Å; K43-W45 VanDerWaalsContact C-N 3.35Å; K43-F46 PolarHBondContact O-N 3.36Å; K43-F47 PolarHBondContact O-N 2.96Å
44	Y	39.5	Very low	44.7	Very low	152 Å²	152	96.8 Å²	96.8	60%	0.596	46%	0.462	S	S	*	.	H	α-helix	trans	-69.1	-34.8	175.3	-66.9	-72.7	0	0	0	112	L40 F47 F48	L40-Y44 WeakPolarHBondContact O-CD2 3.49Å; L40-Y44 PolarHBondContact O-N 2.86Å; Y44-F47 WeakPolarHBondContact O-CB 3.47Å; Y44-F47 PolarHBondContact O-N 2.94Å; Y44-F48 PolarHBondContact O-N 3.29Å
45	W	36.3	Very low	46.1	Very low	112 Å²	112	95.7 Å²	95.7	42%	0.424	45%	0.453	S	S	.	.	H	α-helix	trans	-66	-39.4	176.2	-159.6	81.3	0	0	0	112.4	P41 L42 K43 F47 F48 R49 L381	P41-W45 WeakPolarHBondContact O-CB 3.32Å; P41-W45 PolarHBondContact O-N 3.44Å; L42-W45 PolarHBondContact O-N 3.09Å; K43-W45 VanDerWaalsContact C-N 3.35Å; W45-F47 VanDerWaalsContact C-N 3.35Å; W45-F48 PolarHBondContact O-N 3.39Å; W45-R49 WeakPolarHBondContact O-CB 3.26Å; W45-R49 PolarHBondContact O-N 3.23Å; W45-L381 HydrophobicContact CH2-CD2 3.92Å
46	F	38.1	Very low	47.6	Very low	112 Å²	112	95 Å²	95	49%	0.491	45%	0.45	S	S	.	.	H	α-helix	trans	-64.4	-38.1	172.8	-170.2	-100	0	0	0	112.5	L42 K43 R49 L50	L42-F46 PolarHBondContact O-N 3.2Å; K43-F46 PolarHBondContact O-N 3.36Å; F46-R49 WeakPolarHBondContact O-CB 3.44Å; F46-R49 PolarHBondContact O-N 3.03Å; F46-L50 HydrophobicContact CD1-CD1 3.73Å; F46-L50 HydrophobicContact CE1-CD1 3.21Å; F46-L50 HydrophobicContact CZ-CD1 3.67Å; F46-L50 PolarHBondContact O-N 2.89Å; F46-L50 VanDerWaalsContact O-N 3.1Å
47	F	34	Very low	49.2	Very low	87 Å²	87	90.8 Å²	90.8	38%	0.382	43%	0.43	S	S	.	.	H	α-helix	trans	-67	-42.4	177.1	-150.8	-78	0	0	0	111.9	K43 Y44 W45 R49 L50 M51 L524	K43-F47 PolarHBondContact O-N 2.96Å; Y44-F47 WeakPolarHBondContact O-CB 3.47Å; Y44-F47 PolarHBondContact O-N 2.94Å; W45-F47 VanDerWaalsContact C-N 3.35Å; F47-R49 VanDerWaalsContact C-N 3.34Å; F47-L50 PolarHBondContact O-N 3.19Å; F47-M51 WeakPolarHBondContact O-CB 3.45Å; F47-M51 PolarHBondContact O-N 3.47Å; F47-L524 HydrophobicContact CD1-CD1 4.26Å; F47-L524 HydrophobicContact CD2-CB 3.71Å; F47-L524 HydrophobicContact CD2-CD1 4.12Å; F47-L524 HydrophobicContact CD2-CD2 4.01Å; F47-L524 HydrophobicContact CD2-CG 4.17Å; F47-L524 HydrophobicContact CE1-CD1 3.83Å; F47-L524 HydrophobicContact CE2-CB 3.16Å; F47-L524 HydrophobicContact CE2-CD1 3.72Å; F47-L524 HydrophobicContact CE2-CD2 4.25Å; F47-L524 HydrophobicContact CE2-CG 3.89Å; F47-L524 HydrophobicContact CG-CD1 4.4Å; F47-L524 HydrophobicContact CG-CD2 4.46Å; F47-L524 HydrophobicContact CZ-CB 3.77Å; F47-L524 HydrophobicContact CZ-CD1 3.54Å; F47-L524 HydrophobicContact CZ-CG 4.21Å
48	F	45.7	Very low	51.4	Low	113 Å²	113	84.9 Å²	84.9	50%	0.496	41%	0.412	S	S	.	.	H	α-helix	trans	-62.8	-40.6	174	-169.9	-106.7	0	0	0	111.6	Y44 W45 L50 M51 L52	Y44-F48 PolarHBondContact O-N 3.29Å; W45-F48 PolarHBondContact O-N 3.39Å; F48-L50 PolarHBondContact O-N 2.91Å; F48-M51 PolarHBondContact O-N 3.05Å; F48-L52 HydrophobicContact CD1-CD1 3.69Å; F48-L52 HydrophobicContact CD1-CG 4.39Å; F48-L52 HydrophobicContact CE1-CD1 3.34Å; F48-L52 HydrophobicContact CE1-CG 4.18Å; F48-L52 HydrophobicContact CG-CD1 4.46Å; F48-L52 HydrophobicContact CZ-CD1 3.83Å; F48-L52 HydrophobicContact CZ-CD2 4.44Å; F48-L52 HydrophobicContact CZ-CG 4.29Å; F48-L52 WeakPolarHBondContact O-CG 3.23Å; F48-L52 PolarHBondContact O-N 3.27Å
49	R	45.1	Very low	53.4	Low	40 Å²	40	84.6 Å²	84.6	15%	0.151	41%	0.407	C	S	.	.	H	α-helix	trans	-60.3	-39.3	175.2	-175.8	-177.7	179.3	-166.3	2.6	113.1	W45 F46 F47 K53 F267 E268	W45-R49 WeakPolarHBondContact O-CB 3.26Å; W45-R49 PolarHBondContact O-N 3.23Å; F46-R49 WeakPolarHBondContact O-CB 3.44Å; F46-R49 PolarHBondContact O-N 3.03Å; F47-R49 VanDerWaalsContact C-N 3.34Å; R49-K53 WeakPolarHBondContact O-CG 3.42Å; R49-K53 PolarHBondContact O-N 3.3Å; R49-F267 HydrophobicContact CG-CE1 4.36Å; R49-E268 IonicContact CZ-OE1 3.03Å; R49-E268 VanDerWaalsContact CZ-OE1 3.3Å; R49-E268 IonicContact CZ-OE2 3.96Å; R49-E268 VanDerWaalsContact CZ-OE2 3.31Å; R49-E268 IonicContact NE-OE1 3.31Å; R49-E268 PolarHBondContact NE-OE1 3.07Å; R49-E268 IonicContact NE-OE2 3.67Å; R49-E268 PolarHBondContact NE-OE2 3.43Å; R49-E268 VanDerWaalsContact NE-OE2 3.15Å; R49-E268 IonicContact NH2-OE1 2.63Å; R49-E268 PolarHBondContact NH2-OE1 3.11Å; R49-E268 IonicContact NH2-OE2 2.65Å; R49-E268 PolarHBondContact NH2-OE2 3.33Å
50	L	46.2	Very low	55.5	Low	67 Å²	67	79.4 Å²	79.4	35%	0.351	38%	0.383	S	S	.	.	H	α-helix	trans	-78.6	-35.9	177.7	-88.6	154.2	0	0	0	112.8	F46 F47 F48 K53 L524	F46-L50 HydrophobicContact CD1-CD1 3.73Å; F46-L50 HydrophobicContact CE1-CD1 3.21Å; F46-L50 HydrophobicContact CZ-CD1 3.67Å; F46-L50 PolarHBondContact O-N 2.89Å; F46-L50 VanDerWaalsContact O-N 3.1Å; F47-L50 PolarHBondContact O-N 3.19Å; F48-L50 PolarHBondContact O-N 2.91Å; L50-K53 PolarHBondContact O-N 2.95Å; L50-L524 HydrophobicContact CB-CD2 4.06Å; L50-L524 HydrophobicContact CD1-CD2 3.48Å; L50-L524 VanDerWaalsContact CD1-CD2 3.48Å; L50-L524 HydrophobicContact CG-CD2 4.34Å
51	M	45.9	Very low	57.8	Low	72 Å²	72	75.5 Å²	75.5	36%	0.355	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-44.9	176	-159.3	-174.1	81.8	0	0	110.9	F47 F48 K53 S54 F55	F47-M51 WeakPolarHBondContact O-CB 3.45Å; F47-M51 PolarHBondContact O-N 3.47Å; F48-M51 PolarHBondContact O-N 3.05Å; M51-K53 PolarHBondContact O-N 3.39Å; M51-S54 PolarHBondContact O-N 3.25Å; M51-S54 PolarHBondContact O-OG 3.39Å; M51-F55 HydrophobicContact CE-CE2 4.16Å; M51-F55 HydrophobicContact CG-CE2 4.04Å; M51-F55 WeakPolarHBondContact O-CD2 3.35Å; M51-F55 WeakPolarHBondContact O-CE2 3.39Å
52	L	57.9	Low	60.1	Low	18 Å²	18	74.8 Å²	74.8	9%	0.094	35%	0.354	C	S	.	.	H	α-helix	trans	-63.7	-39.4	177.9	-73.4	175.7	0	0	0	113.2	F48 S54 F55 Q60 L63 F267	F48-L52 HydrophobicContact CD1-CD1 3.69Å; F48-L52 HydrophobicContact CD1-CG 4.39Å; F48-L52 HydrophobicContact CE1-CD1 3.34Å; F48-L52 HydrophobicContact CE1-CG 4.18Å; F48-L52 HydrophobicContact CG-CD1 4.46Å; F48-L52 HydrophobicContact CZ-CD1 3.83Å; F48-L52 HydrophobicContact CZ-CD2 4.44Å; F48-L52 HydrophobicContact CZ-CG 4.29Å; F48-L52 WeakPolarHBondContact O-CG 3.23Å; F48-L52 PolarHBondContact O-N 3.27Å; L52-S54 PolarHBondContact O-N 3.03Å; L52-F55 PolarHBondContact O-N 3.39Å; L52-Q60 WeakPolarHBondContact O-CG 3.07Å; L52-Q60 PolarHBondContact O-NE2 3.42Å; L52-L63 HydrophobicContact CD2-CB 3.94Å; L52-L63 HydrophobicContact CD2-CD1 3.53Å; L52-L63 HydrophobicContact CD2-CG 4.36Å; L52-F267 HydrophobicContact CB-CE2 3.93Å; L52-F267 HydrophobicContact CB-CZ 3.52Å; L52-F267 HydrophobicContact CD1-CZ 4.28Å
53	K	61	Low	62.4	Low	86 Å²	86	72.5 Å²	72.5	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-21.4	177.8	-79.1	-177.3	-179.4	-173.7	0	114.5	R49 L50 M51 Q60 F267 E268	R49-K53 WeakPolarHBondContact O-CG 3.42Å; R49-K53 PolarHBondContact O-N 3.3Å; L50-K53 PolarHBondContact O-N 2.95Å; M51-K53 PolarHBondContact O-N 3.39Å; K53-Q60 PolarHBondContact O-NE2 2.88Å; K53-F267 HydrophobicContact CD-CD1 4.04Å; K53-F267 HydrophobicContact CD-CE1 4.47Å; K53-F267 HydrophobicContact CD-CG 4.3Å; K53-F267 HydrophobicContact CG-CB 4.25Å; K53-F267 HydrophobicContact CG-CD1 3.55Å; K53-F267 HydrophobicContact CG-CD2 3.83Å; K53-F267 HydrophobicContact CG-CE1 3.77Å; K53-F267 HydrophobicContact CG-CE2 4.03Å; K53-F267 HydrophobicContact CG-CG 3.58Å; K53-F267 HydrophobicContact CG-CZ 4.01Å; K53-E268 WeakPolarHBondContact CE-OE1 3.47Å; K53-E268 IonicContact NZ-OE1 2.72Å; K53-E268 PolarHBondContact NZ-OE1 3.2Å
54	S	59.6	Low	64.8	Low	61 Å²	61	65.5 Å²	65.5	43%	0.427	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-13.2	-176.9	68.9	0	0	0	0	114.3	M51 L52	M51-S54 PolarHBondContact O-N 3.25Å; M51-S54 PolarHBondContact O-OG 3.39Å; L52-S54 PolarHBondContact O-N 3.03Å
55	F	71.5	Confident	67.3	Low	82 Å²	82	58.3 Å²	58.3	36%	0.36	29%	0.285	S	S	.	.	S	Bend	trans	-83.1	154.2	178.5	-73.3	-72.2	0	0	0	111.7	M51 L52 T59 Q60 L63	M51-F55 HydrophobicContact CE-CE2 4.16Å; M51-F55 HydrophobicContact CG-CE2 4.04Å; M51-F55 WeakPolarHBondContact O-CD2 3.35Å; M51-F55 WeakPolarHBondContact O-CE2 3.39Å; L52-F55 PolarHBondContact O-N 3.39Å; F55-T59 HydrophobicContact CB-CG2 3.8Å; F55-T59 HydrophobicContact CD1-CG2 3.65Å; F55-T59 HydrophobicContact CE1-CG2 4.44Å; F55-T59 HydrophobicContact CG-CG2 3.83Å; F55-Q60 HydrophobicContact CB-CG 4.12Å; F55-Q60 PolarHBondContact O-NE2 3.11Å; F55-L63 HydrophobicContact CD2-CD1 3.98Å; F55-L63 HydrophobicContact CE2-CD1 4.23Å; F55-L63 HydrophobicContact CG-CD1 4.42Å
56	D	80.5	Confident	70	Confident	93 Å²	93	55.1 Å²	55.1	50%	0.497	28%	0.276	S	S	.	.			trans	-57.1	144.8	172.8	-171.9	-101.1	0	0	0	111.1	I58 T59 Q60	D56-I58 PolarHBondContact O-N 3.38Å; D56-I58 PolarHBondContact OD1-N 3.04Å; D56-T59 CarbonylContact O-C 3.59Å; D56-T59 WeakPolarHBondContact O-CA 3.31Å; D56-T59 WeakPolarHBondContact O-CB 3.47Å; D56-T59 PolarHBondContact O-N 3.5Å; D56-Q60 PolarHBondContact O-N 3.04Å
57	P	82.1	Confident	72.5	Confident	33 Å²	33	53.8 Å²	53.8	21%	0.214	27%	0.27	C	S	.	.	H	α-helix	trans	-49.8	-36.1	-178.2	-30.9	37.5	0	0	0	114.3	Q60 A61	P57-Q60 WeakPolarHBondContact O-CB 3.45Å; P57-Q60 PolarHBondContact O-N 3.29Å; P57-A61 WeakPolarHBondContact O-CB 3.4Å; P57-A61 PolarHBondContact O-N 2.75Å
58	I	86.2	Confident	75.2	Confident	53 Å²	53	49.7 Å²	49.7	27%	0.272	25%	0.252	S	S	.	.	H	α-helix	trans	-67.2	-40.2	176.6	-62.7	168.8	0	0	0	110.9	D56 Q60 A61 L62 L318 A321 V322 T325	D56-I58 PolarHBondContact O-N 3.38Å; D56-I58 PolarHBondContact OD1-N 3.04Å; I58-Q60 VanDerWaalsContact C-N 3.34Å; I58-A61 PolarHBondContact O-N 3.44Å; I58-L62 PolarHBondContact O-N 2.9Å; I58-L318 HydrophobicContact CG2-CD1 3.56Å; I58-A321 HydrophobicContact CG1-CB 4.46Å; I58-V322 HydrophobicContact CD1-CG2 4.41Å; I58-T325 HydrophobicContact CG1-CG2 4.38Å
59	T	86.5	Confident	77.5	Confident	52 Å²	52	47.6 Å²	47.6	32%	0.319	24%	0.241	S	C	.	.	H	α-helix	trans	-69.8	-35	175.8	-57.2	0	0	0	0	111	F55 D56 L62 L63	F55-T59 HydrophobicContact CB-CG2 3.8Å; F55-T59 HydrophobicContact CD1-CG2 3.65Å; F55-T59 HydrophobicContact CE1-CG2 4.44Å; F55-T59 HydrophobicContact CG-CG2 3.83Å; D56-T59 CarbonylContact O-C 3.59Å; D56-T59 WeakPolarHBondContact O-CA 3.31Å; D56-T59 WeakPolarHBondContact O-CB 3.47Å; D56-T59 PolarHBondContact O-N 3.5Å; T59-L62 PolarHBondContact O-N 3.15Å; T59-L63 HydrophobicContact CG2-CD1 4.13Å; T59-L63 HydrophobicContact CG2-CG 4.43Å; T59-L63 WeakPolarHBondContact O-CB 3.4Å; T59-L63 VanDerWaalsContact O-CG 3.27Å; T59-L63 WeakPolarHBondContact O-CG 3.24Å; T59-L63 PolarHBondContact O-N 3.16Å
60	Q	87.5	Confident	79.8	Confident	9 Å²	9	48 Å²	48	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-44.1	172.7	-62.2	-179.2	9	0	0	111.3	L52 K53 F55 D56 P57 I58 L62 L63 G64 F256	L52-Q60 WeakPolarHBondContact O-CG 3.07Å; L52-Q60 PolarHBondContact O-NE2 3.42Å; K53-Q60 PolarHBondContact O-NE2 2.88Å; F55-Q60 HydrophobicContact CB-CG 4.12Å; F55-Q60 PolarHBondContact O-NE2 3.11Å; D56-Q60 PolarHBondContact O-N 3.04Å; P57-Q60 WeakPolarHBondContact O-CB 3.45Å; P57-Q60 PolarHBondContact O-N 3.29Å; I58-Q60 VanDerWaalsContact C-N 3.34Å; Q60-L62 PolarHBondContact O-N 2.72Å; Q60-L63 PolarHBondContact O-N 3.38Å; Q60-G64 PolarHBondContact O-N 2.95Å; Q60-F256 HydrophobicContact CB-CB 4.14Å; Q60-F256 HydrophobicContact CB-CD1 3.55Å; Q60-F256 HydrophobicContact CB-CE1 4.18Å; Q60-F256 HydrophobicContact CB-CG 3.98Å
61	A	88.8	Confident	82	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-43.2	174.4	0	0	0	0	0	112.4	P57 I58 G64 S65 F256 A321	P57-A61 WeakPolarHBondContact O-CB 3.4Å; P57-A61 PolarHBondContact O-N 2.75Å; I58-A61 PolarHBondContact O-N 3.44Å; A61-G64 PolarHBondContact O-N 3.26Å; A61-S65 WeakPolarHBondContact O-CB 3.44Å; A61-S65 PolarHBondContact O-N 2.87Å; A61-S65 PolarHBondContact O-OG 2.72Å; A61-F256 HydrophobicContact CB-CB 3.79Å; A61-A321 HydrophobicContact CB-CB 3.49Å; A61-A321 VanDerWaalsContact CB-CB 3.49Å
62	L	91.1	Very high	84.1	Confident	70 Å²	70	42.4 Å²	42.4	37%	0.366	23%	0.226	S	C	.	.	H	α-helix	trans	-64.3	-44	175.8	-176.9	65	0	0	0	111.8	I58 T59 Q60 S65 L66	I58-L62 PolarHBondContact O-N 2.9Å; T59-L62 PolarHBondContact O-N 3.15Å; Q60-L62 PolarHBondContact O-N 2.72Å; L62-S65 WeakPolarHBondContact CA-OG 3.45Å; L62-S65 PolarHBondContact O-N 2.83Å; L62-S65 PolarHBondContact O-OG 3.44Å; L62-L66 HydrophobicContact CD1-CD1 4.43Å; L62-L66 HydrophobicContact CD1-CG 4.41Å; L62-L66 HydrophobicContact CG-CD1 4.12Å; L62-L66 HydrophobicContact CG-CG 4.49Å; L62-L66 VanDerWaalsContact O-CB 3.31Å; L62-L66 WeakPolarHBondContact O-CB 3.29Å; L62-L66 WeakPolarHBondContact O-CG 3.41Å; L62-L66 PolarHBondContact O-N 3.34Å
63	L	89.9	Confident	85.8	Confident	57 Å²	57	42.5 Å²	42.5	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-68.1	-37.7	177.9	-71.1	173.3	0	0	0	112	L52 F55 T59 Q60 F67	L52-L63 HydrophobicContact CD2-CB 3.94Å; L52-L63 HydrophobicContact CD2-CD1 3.53Å; L52-L63 HydrophobicContact CD2-CG 4.36Å; F55-L63 HydrophobicContact CD2-CD1 3.98Å; F55-L63 HydrophobicContact CE2-CD1 4.23Å; F55-L63 HydrophobicContact CG-CD1 4.42Å; T59-L63 HydrophobicContact CG2-CD1 4.13Å; T59-L63 HydrophobicContact CG2-CG 4.43Å; T59-L63 WeakPolarHBondContact O-CB 3.4Å; T59-L63 VanDerWaalsContact O-CG 3.27Å; T59-L63 WeakPolarHBondContact O-CG 3.24Å; T59-L63 PolarHBondContact O-N 3.16Å; Q60-L63 PolarHBondContact O-N 3.38Å; L63-F67 WeakPolarHBondContact O-CB 3.34Å; L63-F67 PolarHBondContact O-N 3.49Å
64	G	88.4	Confident	87.3	Confident	7 Å²	7	43 Å²	43	7%	0.072	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-45.9	174	0	0	0	0	0	112.2	Q60 A61 F67 T68	Q60-G64 PolarHBondContact O-N 2.95Å; A61-G64 PolarHBondContact O-N 3.26Å; G64-F67 WeakPolarHBondContact O-CB 3.2Å; G64-F67 PolarHBondContact O-N 3.1Å; G64-T68 PolarHBondContact O-N 3.38Å
65	S	91.6	Very high	88.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-74.4	-31.1	178.8	54.1	0	0	0	0	113.8	A61 L62 F67 T68 W69 P314	A61-S65 WeakPolarHBondContact O-CB 3.44Å; A61-S65 PolarHBondContact O-N 2.87Å; A61-S65 PolarHBondContact O-OG 2.72Å; L62-S65 WeakPolarHBondContact CA-OG 3.45Å; L62-S65 PolarHBondContact O-N 2.83Å; L62-S65 PolarHBondContact O-OG 3.44Å; S65-F67 PolarHBondContact O-N 3.33Å; S65-T68 WeakPolarHBondContact CA-OG1 3.4Å; S65-T68 PolarHBondContact O-N 3.2Å; S65-T68 PolarHBondContact O-OG1 3.38Å; S65-W69 VanDerWaalsContact O-CB 3.31Å; S65-W69 WeakPolarHBondContact O-CB 3.47Å; S65-W69 PolarHBondContact O-N 3.24Å; S65-P314 WeakPolarHBondContact OG-CA 3.37Å
66	L	92.3	Very high	89.5	Confident	45 Å²	45	36.2 Å²	36.2	24%	0.236	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-32.6	168.6	-75.6	173.6	0	0	0	111.6	L62 W69 A70	L62-L66 HydrophobicContact CD1-CD1 4.43Å; L62-L66 HydrophobicContact CD1-CG 4.41Å; L62-L66 HydrophobicContact CG-CD1 4.12Å; L62-L66 HydrophobicContact CG-CG 4.49Å; L62-L66 VanDerWaalsContact O-CB 3.31Å; L62-L66 WeakPolarHBondContact O-CB 3.29Å; L62-L66 WeakPolarHBondContact O-CG 3.41Å; L62-L66 PolarHBondContact O-N 3.34Å; L66-W69 HydrophobicContact CD2-CE3 3.96Å; L66-W69 HydrophobicContact CD2-CZ3 4.25Å; L66-A70 WeakPolarHBondContact O-CB 3.32Å; L66-A70 PolarHBondContact O-N 2.76Å
67	F	91.4	Very high	90	Very high	85 Å²	85	33.5 Å²	33.5	37%	0.373	19%	0.188	S	C	.	.	H	α-helix	trans	-67	-49.1	173	165	-93.3	0	0	0	111.2	L63 G64 S65 W69 A70 V71	L63-F67 WeakPolarHBondContact O-CB 3.34Å; L63-F67 PolarHBondContact O-N 3.49Å; G64-F67 WeakPolarHBondContact O-CB 3.2Å; G64-F67 PolarHBondContact O-N 3.1Å; S65-F67 PolarHBondContact O-N 3.33Å; F67-W69 PolarHBondContact O-N 3.25Å; F67-A70 WeakPolarHBondContact O-CB 3.47Å; F67-A70 PolarHBondContact O-N 3.11Å; F67-V71 HydrophobicContact CD2-CG2 4.46Å; F67-V71 HydrophobicContact CE1-CG2 4.25Å; F67-V71 HydrophobicContact CE2-CG2 4Å; F67-V71 HydrophobicContact CZ-CG2 3.88Å; F67-V71 WeakPolarHBondContact O-CG2 3.39Å; F67-V71 PolarHBondContact O-N 3.24Å
68	T	91.3	Very high	90.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-46.8	179.1	55.6	0	0	0	0	111.2	G64 S65 A70 V71 T72 V252 A274 I277 E313	G64-T68 PolarHBondContact O-N 3.38Å; S65-T68 WeakPolarHBondContact CA-OG1 3.4Å; S65-T68 PolarHBondContact O-N 3.2Å; S65-T68 PolarHBondContact O-OG1 3.38Å; T68-A70 VanDerWaalsContact C-N 3.31Å; T68-A70 PolarHBondContact O-N 3.49Å; T68-V71 WeakPolarHBondContact O-CA 3.39Å; T68-V71 PolarHBondContact O-N 3.36Å; T68-T72 PolarHBondContact O-N 3.4Å; T68-T72 PolarHBondContact O-OG1 3.27Å; T68-T72 VanDerWaalsContact O-OG1 3.07Å; T68-V252 HydrophobicContact CG2-CG2 4.13Å; T68-A274 WeakPolarHBondContact CG2-O 3.48Å; T68-I277 HydrophobicContact CG2-CB 4.09Å; T68-I277 HydrophobicContact CG2-CG2 3.75Å; T68-E313 WeakPolarHBondContact CB-OE2 3.37Å; T68-E313 PolarHBondContact OG1-OE2 3.17Å
69	W	93.7	Very high	90.1	Very high	69 Å²	69	33.1 Å²	33.1	26%	0.261	18%	0.182	S	C	.	.	H	α-helix	trans	-58.6	-39.5	173.9	175.6	58.4	0	0	0	113	S65 L66 F67 V71 T72 A73 Q307 G310 E313 P314	S65-W69 VanDerWaalsContact O-CB 3.31Å; S65-W69 WeakPolarHBondContact O-CB 3.47Å; S65-W69 PolarHBondContact O-N 3.24Å; L66-W69 HydrophobicContact CD2-CE3 3.96Å; L66-W69 HydrophobicContact CD2-CZ3 4.25Å; F67-W69 PolarHBondContact O-N 3.25Å; W69-V71 VanDerWaalsContact C-N 3.27Å; W69-V71 PolarHBondContact O-N 2.9Å; W69-T72 WeakPolarHBondContact O-CB 3.39Å; W69-T72 PolarHBondContact O-N 3.47Å; W69-A73 WeakPolarHBondContact O-CB 3.46Å; W69-A73 PolarHBondContact O-N 3.27Å; W69-Q307 VanDerWaalsContact CZ2-OE1 3.25Å; W69-Q307 PolarHBondContact NE1-O 2.98Å; W69-G310 VanDerWaalsContact CD1-C 3.47Å; W69-E313 PolarHBondContact N-OE2 3.42Å; W69-P314 HydrophobicContact CB-CG 4.13Å; W69-P314 HydrophobicContact CG-CG 4.48Å
70	A	92.6	Very high	90.1	Very high	48 Å²	48	34.7 Å²	34.7	40%	0.397	18%	0.184	S	C	.	.	H	α-helix	trans	-64.2	-33.1	175.8	0	0	0	0	0	112.1	L66 F67 T68 L74	L66-A70 WeakPolarHBondContact O-CB 3.32Å; L66-A70 PolarHBondContact O-N 2.76Å; F67-A70 WeakPolarHBondContact O-CB 3.47Å; F67-A70 PolarHBondContact O-N 3.11Å; T68-A70 VanDerWaalsContact C-N 3.31Å; T68-A70 PolarHBondContact O-N 3.49Å; A70-L74 WeakPolarHBondContact O-CB 3.49Å; A70-L74 PolarHBondContact O-N 3.32Å
71	V	91.9	Very high	89.8	Confident	23 Å²	23	40.3 Å²	40.3	14%	0.139	21%	0.214	C	C	.	.	H	α-helix	trans	-74.4	-36.9	174.5	-174.1	0	0	0	0	111.4	F67 T68 W69 A73 L74 G75 G278 F282	F67-V71 HydrophobicContact CD2-CG2 4.46Å; F67-V71 HydrophobicContact CE1-CG2 4.25Å; F67-V71 HydrophobicContact CE2-CG2 4Å; F67-V71 HydrophobicContact CZ-CG2 3.88Å; F67-V71 WeakPolarHBondContact O-CG2 3.39Å; F67-V71 PolarHBondContact O-N 3.24Å; T68-V71 WeakPolarHBondContact O-CA 3.39Å; T68-V71 PolarHBondContact O-N 3.36Å; W69-V71 VanDerWaalsContact C-N 3.27Å; W69-V71 PolarHBondContact O-N 2.9Å; V71-A73 VanDerWaalsContact C-N 3.34Å; V71-A73 PolarHBondContact O-N 3.35Å; V71-L74 WeakPolarHBondContact O-CB 3.32Å; V71-L74 PolarHBondContact O-N 3.09Å; V71-L74 VanDerWaalsContact O-N 3.16Å; V71-G75 PolarHBondContact O-N 3.3Å; V71-G278 WeakPolarHBondContact CB-O 3.44Å; V71-G278 WeakPolarHBondContact CG1-O 3.3Å; V71-F282 HydrophobicContact CG1-CB 3.76Å; V71-F282 HydrophobicContact CG1-CD2 4.45Å
72	T	91.4	Very high	88.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56	-49.2	168.9	-38.7	0	0	0	0	110.8	T68 W69 L74 G75 S76 N281 E313	T68-T72 PolarHBondContact O-N 3.4Å; T68-T72 PolarHBondContact O-OG1 3.27Å; T68-T72 VanDerWaalsContact O-OG1 3.07Å; W69-T72 WeakPolarHBondContact O-CB 3.39Å; W69-T72 PolarHBondContact O-N 3.47Å; T72-L74 VanDerWaalsContact C-N 3.3Å; T72-L74 PolarHBondContact O-N 3.23Å; T72-G75 PolarHBondContact O-N 3.1Å; T72-G75 VanDerWaalsContact O-N 3.16Å; T72-S76 PolarHBondContact O-N 3.25Å; T72-S76 PolarHBondContact O-OG 2.92Å; T72-N281 WeakPolarHBondContact CA-O 3.45Å; T72-N281 WeakPolarHBondContact OG1-CB 3.24Å; T72-N281 PolarHBondContact OG1-ND2 2.96Å; T72-E313 PolarHBondContact OG1-OE1 3.03Å
73	A	92.8	Very high	87.3	Confident	20 Å²	20	49.2 Å²	49.2	17%	0.165	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-37.8	176.9	0	0	0	0	0	112.1	W69 V71 S76 A77 F303 Q307	W69-A73 WeakPolarHBondContact O-CB 3.46Å; W69-A73 PolarHBondContact O-N 3.27Å; V71-A73 VanDerWaalsContact C-N 3.34Å; V71-A73 PolarHBondContact O-N 3.35Å; A73-S76 PolarHBondContact O-N 3.47Å; A73-A77 WeakPolarHBondContact O-CB 3.45Å; A73-A77 PolarHBondContact O-N 2.91Å; A73-F303 WeakPolarHBondContact O-CE2 3.32Å; A73-Q307 HydrophobicContact CB-CB 3.93Å
74	L	92	Very high	85.4	Confident	96 Å²	96	51.6 Å²	51.6	50%	0.503	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-45.3	174.7	-160.3	178.9	0	0	0	110.6	A70 V71 T72 S76 A77 F282	A70-L74 WeakPolarHBondContact O-CB 3.49Å; A70-L74 PolarHBondContact O-N 3.32Å; V71-L74 WeakPolarHBondContact O-CB 3.32Å; V71-L74 PolarHBondContact O-N 3.09Å; V71-L74 VanDerWaalsContact O-N 3.16Å; T72-L74 VanDerWaalsContact C-N 3.3Å; T72-L74 PolarHBondContact O-N 3.23Å; L74-S76 PolarHBondContact O-N 2.97Å; L74-A77 WeakPolarHBondContact O-CB 3.1Å; L74-A77 PolarHBondContact O-N 3.5Å; L74-F282 HydrophobicContact CD2-CD2 3.82Å; L74-F282 HydrophobicContact CD2-CE2 3.34Å; L74-F282 HydrophobicContact CD2-CZ 4.38Å
75	G	88.3	Confident	83.5	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-56.6	-47.5	173.1	0	0	0	0	0	112.1	V71 T72 A77 F78 F282 L286	V71-G75 PolarHBondContact O-N 3.3Å; T72-G75 PolarHBondContact O-N 3.1Å; T72-G75 VanDerWaalsContact O-N 3.16Å; G75-A77 VanDerWaalsContact C-N 3.32Å; G75-A77 PolarHBondContact O-N 3.32Å; G75-F78 VanDerWaalsContact O-CB 3.24Å; G75-F78 WeakPolarHBondContact O-CB 3.17Å; G75-F78 PolarHBondContact O-N 3.38Å; G75-F282 WeakPolarHBondContact CA-O 3.49Å; G75-L286 VanDerWaalsContact O-CD2 3.31Å; G75-L286 WeakPolarHBondContact O-CD2 3.08Å
76	S	89.6	Confident	81.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.4	-30.6	176.7	-59.8	0	0	0	0	114.1	T72 A73 L74 F78 V79 G285 S289 G306 Q307	T72-S76 PolarHBondContact O-N 3.25Å; T72-S76 PolarHBondContact O-OG 2.92Å; A73-S76 PolarHBondContact O-N 3.47Å; L74-S76 PolarHBondContact O-N 2.97Å; S76-F78 PolarHBondContact O-N 2.8Å; S76-V79 WeakPolarHBondContact O-CG1 3.3Å; S76-V79 PolarHBondContact O-N 3.39Å; S76-G285 WeakPolarHBondContact CA-O 3.46Å; S76-G285 VanDerWaalsContact OG-CA 3.26Å; S76-G285 WeakPolarHBondContact OG-CA 3.25Å; S76-G285 PolarHBondContact OG-O 3.45Å; S76-S289 WeakPolarHBondContact CA-OG 3.45Å; S76-S289 PolarHBondContact O-OG 3.38Å; S76-G306 VanDerWaalsContact OG-CA 3.24Å; S76-G306 WeakPolarHBondContact OG-CA 3.36Å; S76-G306 PolarHBondContact OG-O 3.41Å; S76-Q307 PolarHBondContact OG-N 3.17Å
77	A	90.8	Very high	79	Confident	36 Å²	36	65.9 Å²	65.9	30%	0.298	35%	0.351	S	S	.	.	H	α-helix	trans	-67.5	-17.4	178.5	0	0	0	0	0	112.8	A73 L74 G75 V79 F80 F303	A73-A77 WeakPolarHBondContact O-CB 3.45Å; A73-A77 PolarHBondContact O-N 2.91Å; L74-A77 WeakPolarHBondContact O-CB 3.1Å; L74-A77 PolarHBondContact O-N 3.5Å; G75-A77 VanDerWaalsContact C-N 3.32Å; G75-A77 PolarHBondContact O-N 3.32Å; A77-V79 PolarHBondContact O-N 3.44Å; A77-V79 VanDerWaalsContact O-N 3.1Å; A77-F80 HydrophobicContact CB-CD2 4.39Å; A77-F80 WeakPolarHBondContact O-CB 3.43Å; A77-F80 VanDerWaalsContact O-CD2 3.24Å; A77-F80 WeakPolarHBondContact O-CD2 3.43Å; A77-F80 PolarHBondContact O-N 3.24Å; A77-F303 HydrophobicContact CB-CD2 4.24Å; A77-F303 HydrophobicContact CB-CE2 4.02Å
78	F	86	Confident	76.6	Confident	77 Å²	77	73.2 Å²	73.2	34%	0.338	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-60.7	-21.5	176.4	-154.4	-94.3	0	0	0	112.9	G75 S76 F80 L81 F282 L286	G75-F78 VanDerWaalsContact O-CB 3.24Å; G75-F78 WeakPolarHBondContact O-CB 3.17Å; G75-F78 PolarHBondContact O-N 3.38Å; S76-F78 PolarHBondContact O-N 2.8Å; F78-F80 PolarHBondContact O-N 2.85Å; F78-F80 VanDerWaalsContact O-N 3.11Å; F78-L81 HydrophobicContact CD2-CD1 3.64Å; F78-L81 HydrophobicContact CE2-CD1 3.61Å; F78-L81 HydrophobicContact CG-CD1 4.15Å; F78-L81 HydrophobicContact CZ-CD1 4.09Å; F78-L81 WeakPolarHBondContact O-CB 3.48Å; F78-L81 PolarHBondContact O-N 3.09Å; F78-F282 HydrophobicContact CD2-CZ 4.32Å; F78-L286 HydrophobicContact CB-CD2 3.3Å; F78-L286 HydrophobicContact CB-CG 4.47Å; F78-L286 HydrophobicContact CD1-CD2 3.68Å; F78-L286 HydrophobicContact CG-CD2 3.62Å
79	V	83.8	Confident	74.3	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.006	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-56.6	-26.1	173.4	87.8	0	0	0	0	112.6	S76 A77 L81 L82 L290 A293 K299 F303	S76-V79 WeakPolarHBondContact O-CG1 3.3Å; S76-V79 PolarHBondContact O-N 3.39Å; A77-V79 PolarHBondContact O-N 3.44Å; A77-V79 VanDerWaalsContact O-N 3.1Å; V79-L81 VanDerWaalsContact C-N 3.34Å; V79-L82 PolarHBondContact O-N 3.5Å; V79-L290 HydrophobicContact CG2-CD2 4.47Å; V79-A293 HydrophobicContact CG2-CB 3.37Å; V79-K299 HydrophobicContact CG1-CB 4.38Å; V79-K299 WeakPolarHBondContact CG1-O 3.26Å; V79-F303 HydrophobicContact CG1-CB 4.17Å
80	F	86.2	Confident	72	Confident	86 Å²	86	79.9 Å²	79.9	38%	0.377	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-72.5	-25.7	176.9	-66.1	-67	0	0	0	113.1	A77 F78 L82 K299 W300 F303	A77-F80 HydrophobicContact CB-CD2 4.39Å; A77-F80 WeakPolarHBondContact O-CB 3.43Å; A77-F80 VanDerWaalsContact O-CD2 3.24Å; A77-F80 WeakPolarHBondContact O-CD2 3.43Å; A77-F80 PolarHBondContact O-N 3.24Å; F78-F80 PolarHBondContact O-N 2.85Å; F78-F80 VanDerWaalsContact O-N 3.11Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 PolarHBondContact O-N 2.96Å; F80-K299 HydrophobicContact CD1-CB 4.04Å; F80-K299 HydrophobicContact CD1-CD 4.21Å; F80-K299 HydrophobicContact CE1-CB 3.83Å; F80-K299 PolarHBondContact O-NZ 3.48Å; F80-W300 HydrophobicContact CE1-CE3 4.48Å; F80-W300 AromaticContact CZ-CE3 3.84Å; F80-W300 HydrophobicContact CZ-CE3 3.84Å; F80-W300 HydrophobicContact CZ-CZ3 4.32Å; F80-F303 HydrophobicContact CE2-CB 3.8Å; F80-F303 AromaticContact CE2-CD1 3.97Å; F80-F303 HydrophobicContact CE2-CD1 3.97Å; F80-F303 HydrophobicContact CE2-CD2 4.09Å; F80-F303 AromaticContact CE2-CG 3.68Å; F80-F303 HydrophobicContact CE2-CG 3.68Å; F80-F303 HydrophobicContact CZ-CB 3.85Å; F80-F303 HydrophobicContact CZ-CD1 4.11Å; F80-F303 HydrophobicContact CZ-CG 4.04Å
81	L	81.6	Confident	69.7	Low	126 Å²	126	80.7 Å²	80.7	66%	0.66	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-76.1	-17.4	178.3	-61.1	177.9	0	0	0	112.9	F78 V79 K83	F78-L81 HydrophobicContact CD2-CD1 3.64Å; F78-L81 HydrophobicContact CE2-CD1 3.61Å; F78-L81 HydrophobicContact CG-CD1 4.15Å; F78-L81 HydrophobicContact CZ-CD1 4.09Å; F78-L81 WeakPolarHBondContact O-CB 3.48Å; F78-L81 PolarHBondContact O-N 3.09Å; V79-L81 VanDerWaalsContact C-N 3.34Å; L81-K83 PolarHBondContact O-N 3Å
82	L	68.9	Low	67.3	Low	68 Å²	68	88.2 Å²	88.2	36%	0.356	46%	0.464	S	S	.	.	S	Bend	trans	-68.6	120.7	172.4	-64.9	-177.2	0	0	0	110	V79 F80 L290 K299	V79-L82 PolarHBondContact O-N 3.5Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 PolarHBondContact O-N 2.96Å; L82-L290 HydrophobicContact CD1-CD2 3.45Å; L82-L290 VanDerWaalsContact CD1-CD2 3.45Å; L82-L290 HydrophobicContact CG-CD2 4.15Å; L82-K299 WeakPolarHBondContact O-CE 3.22Å; L82-K299 PolarHBondContact O-NZ 3.06Å
83	K	58.5	Low	64.9	Low	189 Å²	189	93.3 Å²	93.3	82%	0.822	49%	0.491	S	S	*	.			trans	-58.9	138.1	176.2	-74.3	-174.2	177.5	-179.2	0	110.1	L81 T85	L81-K83 PolarHBondContact O-N 3Å; K83-T85 PolarHBondContact O-N 3.48Å
84	P	51	Low	62.8	Low	108 Å²	108	98.1 Å²	98.1	70%	0.701	51%	0.508	S	S	*	.			trans	-65	109.3	174.9	26.7	-31.2	0	0	0	109.1	S86	P84-S86 PolarHBondContact O-N 3.33Å
85	T	47	Very low	60.4	Low	98 Å²	98	102.3 Å²	102.3	60%	0.601	52%	0.522	S	S	*	.			trans	-74.1	95.2	170	-51	0	0	0	0	107.6	K83 Q87	K83-T85 PolarHBondContact O-N 3.48Å; T85-Q87 PolarHBondContact O-N 3.45Å; T85-Q87 VanDerWaalsContact O-N 3.12Å
86	S	43.9	Very low	58.2	Low	82 Å²	82	104.6 Å²	104.6	57%	0.573	54%	0.541	S	S	*	.			trans	-55.6	115	167.2	168.5	0	0	0	0	108.8	P84 R88	P84-S86 PolarHBondContact O-N 3.33Å; S86-R88 PolarHBondContact O-N 3.16Å
87	Q	47.2	Very low	56.2	Low	172 Å²	172	106.9 Å²	106.9	80%	0.804	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	5	179.8	-71.2	-170.3	-21.5	0	0	114.3	T85	T85-Q87 PolarHBondContact O-N 3.45Å; T85-Q87 VanDerWaalsContact O-N 3.12Å
88	R	41.1	Very low	54.1	Low	239 Å²	239	107.6 Å²	107.6	90%	0.902	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-1.6	-176.2	-103.6	176.5	175.4	165.7	-1.5	115.8	S86	S86-R88 PolarHBondContact O-N 3.16Å
89	I	42.5	Very low	52.1	Low	125 Å²	125	106.7 Å²	106.7	64%	0.641	56%	0.557	S	S	*	*	S	Bend	trans	-131.5	45	176.1	-49.5	176.4	0	0	0	109.7	G91	I89-G91 VanDerWaalsContact C-N 3.34Å
90	L	43.9	Very low	50.6	Low	83 Å²	83	111.1 Å²	111.1	44%	0.435	58%	0.584	S	S	.	*			trans	-88.4	2.8	-174.4	-148.5	72.5	0	0	0	113.7	E97	L90-E97 WeakPolarHBondContact CD1-OE2 3.41Å
91	G	44.7	Very low	49.2	Very low	66 Å²	66	111.6 Å²	111.6	68%	0.68	58%	0.583	S	S	*	*	S	Bend	trans	-94.7	-27	-175.1	0	0	0	0	0	115.9	I89	I89-G91 VanDerWaalsContact C-N 3.34Å
92	M	42.4	Very low	48	Very low	181 Å²	181	111.3 Å²	111.3	89%	0.892	58%	0.582	S	S	*	*	S	Bend	trans	-116.3	2.3	-167.6	-67.7	-170.6	-171.5	0	0	115.4
93	L	40.4	Very low	47.6	Very low	106 Å²	106	116.8 Å²	116.8	56%	0.555	60%	0.597	S	S	*	*			trans	-131.1	36.6	-175	-91.5	162.8	0	0	0	114.2	K95 A96 E97	L93-K95 VanDerWaalsContact C-N 3.25Å; L93-K95 PolarHBondContact O-N 3.04Å; L93-K95 VanDerWaalsContact O-N 3.13Å; L93-A96 HydrophobicContact CD2-CB 3.92Å; L93-A96 PolarHBondContact O-N 3.39Å; L93-E97 PolarHBondContact O-N 3.24Å
94	K	48	Very low	47.9	Very low	122 Å²	122	109.7 Å²	109.7	53%	0.53	57%	0.572	S	S	.	*	H	α-helix	trans	-53.4	-35.1	-178.7	-80.7	-175.7	175.8	178.3	0	114.3	I98	K94-I98 WeakPolarHBondContact O-CB 3.23Å; K94-I98 VanDerWaalsContact O-CD1 3.29Å; K94-I98 WeakPolarHBondContact O-CD1 3.38Å; K94-I98 WeakPolarHBondContact O-CG1 3.44Å; K94-I98 PolarHBondContact O-N 3.43Å
95	K	41.9	Very low	48.7	Very low	183 Å²	183	106.8 Å²	106.8	80%	0.796	55%	0.552	S	S	*	*	H	α-helix	trans	-70.8	-38.9	-179.4	-72	-172.3	177.2	-177.2	0	113.4	L93 A99	L93-K95 VanDerWaalsContact C-N 3.25Å; L93-K95 PolarHBondContact O-N 3.04Å; L93-K95 VanDerWaalsContact O-N 3.13Å; K95-A99 WeakPolarHBondContact O-CB 3.31Å; K95-A99 PolarHBondContact O-N 3.45Å; K95-A99 VanDerWaalsContact O-N 3.11Å
96	A	43.7	Very low	50.1	Low	49 Å²	49	105.1 Å²	105.1	41%	0.405	54%	0.539	S	S	.	.	H	α-helix	trans	-73	-38.2	-178.9	0	0	0	0	0	111.6	L93 A99 V100	L93-A96 HydrophobicContact CD2-CB 3.92Å; L93-A96 PolarHBondContact O-N 3.39Å; A96-A99 PolarHBondContact O-N 3.18Å; A96-V100 VanDerWaalsContact O-CG2 3.31Å; A96-V100 WeakPolarHBondContact O-CG2 3.4Å; A96-V100 PolarHBondContact O-N 3.46Å
97	E	46.1	Very low	51.7	Low	47 Å²	47	105.4 Å²	105.4	22%	0.22	53%	0.534	C	S	.	.	H	α-helix	trans	-69.2	-38.8	178.4	-165.7	-178.9	171.9	0	0	112.4	L90 L93 V100 R101	L90-E97 WeakPolarHBondContact CD1-OE2 3.41Å; L93-E97 PolarHBondContact O-N 3.24Å; E97-V100 PolarHBondContact O-N 3.42Å; E97-R101 WeakPolarHBondContact O-CG 3.31Å; E97-R101 PolarHBondContact O-N 3.37Å; E97-R101 IonicContact OE1-CZ 3.31Å; E97-R101 IonicContact OE1-NE 3.63Å; E97-R101 IonicContact OE1-NH2 2.57Å; E97-R101 PolarHBondContact OE1-NH2 2.94Å
98	I	47.1	Very low	53.1	Low	52 Å²	52	97.7 Å²	97.7	27%	0.267	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-43.8	174	-67.7	168.9	0	0	0	110.6	K94 V100 R101 L102 L223	K94-I98 WeakPolarHBondContact O-CB 3.23Å; K94-I98 VanDerWaalsContact O-CD1 3.29Å; K94-I98 WeakPolarHBondContact O-CD1 3.38Å; K94-I98 WeakPolarHBondContact O-CG1 3.44Å; K94-I98 PolarHBondContact O-N 3.43Å; I98-V100 VanDerWaalsContact C-N 3.32Å; I98-V100 PolarHBondContact O-N 3.04Å; I98-R101 PolarHBondContact O-N 2.92Å; I98-L102 WeakPolarHBondContact O-CB 3.38Å; I98-L102 PolarHBondContact O-N 3.14Å; I98-L223 HydrophobicContact CD1-CD1 4.14Å; I98-L223 HydrophobicContact CG1-CD1 3.85Å; I98-L223 HydrophobicContact CG1-CD2 4.32Å; I98-L223 HydrophobicContact CG2-CD1 4.11Å
99	A	44.5	Very low	55.1	Low	58 Å²	58	86.3 Å²	86.3	48%	0.479	46%	0.455	S	S	.	.	H	α-helix	trans	-62.5	-36.5	177.9	0	0	0	0	0	112.9	K95 A96 R103	K95-A99 WeakPolarHBondContact O-CB 3.31Å; K95-A99 PolarHBondContact O-N 3.45Å; K95-A99 VanDerWaalsContact O-N 3.11Å; A96-A99 PolarHBondContact O-N 3.18Å; A99-R103 WeakPolarHBondContact O-CB 3.04Å; A99-R103 PolarHBondContact O-N 2.89Å; A99-R103 VanDerWaalsContact O-N 3.09Å
100	V	51.4	Low	57.2	Low	93 Å²	93	81.3 Å²	81.3	56%	0.564	43%	0.432	S	S	*	.	H	α-helix	trans	-69	-43.8	175.2	171.2	0	0	0	0	111.2	A96 E97 I98 R103 S104	A96-V100 VanDerWaalsContact O-CG2 3.31Å; A96-V100 WeakPolarHBondContact O-CG2 3.4Å; A96-V100 PolarHBondContact O-N 3.46Å; E97-V100 PolarHBondContact O-N 3.42Å; I98-V100 VanDerWaalsContact C-N 3.32Å; I98-V100 PolarHBondContact O-N 3.04Å; V100-R103 PolarHBondContact O-N 3.47Å; V100-S104 PolarHBondContact O-N 3.16Å; V100-S104 PolarHBondContact O-OG 2.96Å
101	R	56.9	Low	59.1	Low	97 Å²	97	78 Å²	78	37%	0.366	42%	0.416	S	S	.	.	H	α-helix	trans	-65.4	-38.7	177.1	-73.4	-177	-171.4	-165.7	6.7	112.6	E97 I98 R103 S104 V105	E97-R101 WeakPolarHBondContact O-CG 3.31Å; E97-R101 PolarHBondContact O-N 3.37Å; E97-R101 IonicContact OE1-CZ 3.31Å; E97-R101 IonicContact OE1-NE 3.63Å; E97-R101 IonicContact OE1-NH2 2.57Å; E97-R101 PolarHBondContact OE1-NH2 2.94Å; I98-R101 PolarHBondContact O-N 2.92Å; R101-R103 VanDerWaalsContact C-N 3.33Å; R101-R103 PolarHBondContact O-N 2.91Å; R101-S104 WeakPolarHBondContact CA-OG 3.47Å; R101-S104 PolarHBondContact O-N 3.37Å; R101-S104 PolarHBondContact O-OG 3.2Å; R101-V105 WeakPolarHBondContact O-CG2 3.49Å; R101-V105 PolarHBondContact O-N 3.04Å
102	L	57.6	Low	61	Low	120 Å²	120	75.7 Å²	75.7	63%	0.628	39%	0.388	S	S	*	.	H	α-helix	trans	-62.9	-40.7	173.6	-124.4	77.6	0	0	0	111.4	I98 V105 L106	I98-L102 WeakPolarHBondContact O-CB 3.38Å; I98-L102 PolarHBondContact O-N 3.14Å; L102-V105 PolarHBondContact O-N 3.37Å; L102-L106 WeakPolarHBondContact O-CB 3.31Å; L102-L106 PolarHBondContact O-N 3.16Å
103	R	60.5	Low	63.2	Low	182 Å²	182	67.1 Å²	67.1	69%	0.687	35%	0.347	S	S	*	.	H	α-helix	trans	-65.4	-38.9	178	-170.5	-178.4	-69.3	-164.5	-2.9	112.2	A99 V100 R101 L106 L107	A99-R103 WeakPolarHBondContact O-CB 3.04Å; A99-R103 PolarHBondContact O-N 2.89Å; A99-R103 VanDerWaalsContact O-N 3.09Å; V100-R103 PolarHBondContact O-N 3.47Å; R101-R103 VanDerWaalsContact C-N 3.33Å; R101-R103 PolarHBondContact O-N 2.91Å; R103-L106 PolarHBondContact O-N 3.04Å; R103-L107 HydrophobicContact CG-CD1 4.23Å; R103-L107 WeakPolarHBondContact O-CB 3.49Å; R103-L107 VanDerWaalsContact O-CG 3.26Å; R103-L107 WeakPolarHBondContact O-CG 3.14Å; R103-L107 PolarHBondContact O-N 3.27Å
104	S	63.7	Low	65.6	Low	40 Å²	40	64.2 Å²	64.2	28%	0.28	33%	0.33	S	S	.	.	H	α-helix	trans	-65.4	-38.4	175.5	46.2	0	0	0	0	112.6	V100 R101 L107 I108	V100-S104 PolarHBondContact O-N 3.16Å; V100-S104 PolarHBondContact O-OG 2.96Å; R101-S104 WeakPolarHBondContact CA-OG 3.47Å; R101-S104 PolarHBondContact O-N 3.37Å; R101-S104 PolarHBondContact O-OG 3.2Å; S104-L107 PolarHBondContact O-N 3.29Å; S104-I108 WeakPolarHBondContact O-CD1 3.19Å; S104-I108 VanDerWaalsContact O-CG1 3.23Å; S104-I108 WeakPolarHBondContact O-CG1 3.46Å; S104-I108 PolarHBondContact O-N 3.25Å
105	V	67.3	Low	67.5	Low	47 Å²	47	58.4 Å²	58.4	29%	0.285	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-48.2	176.3	169.5	0	0	0	0	110.4	R101 L102 L107 I108 D109 R357	R101-V105 WeakPolarHBondContact O-CG2 3.49Å; R101-V105 PolarHBondContact O-N 3.04Å; L102-V105 PolarHBondContact O-N 3.37Å; V105-L107 VanDerWaalsContact C-N 3.32Å; V105-L107 PolarHBondContact O-N 3.34Å; V105-I108 PolarHBondContact O-N 3.3Å; V105-I108 VanDerWaalsContact O-N 3.14Å; V105-D109 PolarHBondContact O-N 2.89Å; V105-R357 HydrophobicContact CG1-CB 4.13Å; V105-R357 VanDerWaalsContact CG1-CD 3.5Å; V105-R357 HydrophobicContact CG1-CG 4.44Å
106	L	76.7	Confident	69.7	Low	64 Å²	64	49.7 Å²	49.7	34%	0.335	27%	0.266	S	S	.	.	H	α-helix	trans	-58.5	-42.9	177.1	179.1	63.1	0	0	0	112.8	L102 R103 I108 D109 A110 I362	L102-L106 WeakPolarHBondContact O-CB 3.31Å; L102-L106 PolarHBondContact O-N 3.16Å; R103-L106 PolarHBondContact O-N 3.04Å; L106-I108 VanDerWaalsContact C-N 3.34Å; L106-D109 PolarHBondContact O-N 3.26Å; L106-A110 WeakPolarHBondContact O-CB 3.41Å; L106-A110 PolarHBondContact O-N 3.17Å; L106-I362 HydrophobicContact CD1-CB 4.26Å; L106-I362 HydrophobicContact CD1-CD1 3.36Å; L106-I362 HydrophobicContact CD1-CG1 4.36Å; L106-I362 HydrophobicContact CD1-CG2 3.85Å
107	L	78.6	Confident	72.1	Confident	87 Å²	87	47.4 Å²	47.4	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-40.7	177.2	-75.6	171.5	0	0	0	111.6	R103 S104 V105 S111	R103-L107 HydrophobicContact CG-CD1 4.23Å; R103-L107 WeakPolarHBondContact O-CB 3.49Å; R103-L107 VanDerWaalsContact O-CG 3.26Å; R103-L107 WeakPolarHBondContact O-CG 3.14Å; R103-L107 PolarHBondContact O-N 3.27Å; S104-L107 PolarHBondContact O-N 3.29Å; V105-L107 VanDerWaalsContact C-N 3.32Å; V105-L107 PolarHBondContact O-N 3.34Å; L107-S111 WeakPolarHBondContact O-CB 3.26Å; L107-S111 PolarHBondContact O-N 3.18Å; L107-S111 PolarHBondContact O-OG 2.98Å; L107-S111 VanDerWaalsContact O-OG 3.09Å
108	I	76.6	Confident	74.1	Confident	10 Å²	10	45.2 Å²	45.2	5%	0.051	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-49.8	176.8	-67.6	162.1	0	0	0	110.1	S104 V105 L106 A110 S111 L112 L290 P291 R357	S104-I108 WeakPolarHBondContact O-CD1 3.19Å; S104-I108 VanDerWaalsContact O-CG1 3.23Å; S104-I108 WeakPolarHBondContact O-CG1 3.46Å; S104-I108 PolarHBondContact O-N 3.25Å; V105-I108 PolarHBondContact O-N 3.3Å; V105-I108 VanDerWaalsContact O-N 3.14Å; L106-I108 VanDerWaalsContact C-N 3.34Å; I108-A110 PolarHBondContact O-N 3.4Å; I108-S111 WeakPolarHBondContact CA-OG 3.31Å; I108-S111 PolarHBondContact O-N 3.3Å; I108-S111 VanDerWaalsContact O-N 3.15Å; I108-S111 PolarHBondContact O-OG 3.35Å; I108-L112 HydrophobicContact CG2-CD1 3.8Å; I108-L112 HydrophobicContact CG2-CG 4.27Å; I108-L112 WeakPolarHBondContact O-CG 3.38Å; I108-L112 PolarHBondContact O-N 3.47Å; I108-L290 HydrophobicContact CD1-CB 4.47Å; I108-L290 HydrophobicContact CG1-CD1 4.3Å; I108-P291 HydrophobicContact CD1-CG 4.29Å; I108-R357 VanDerWaalsContact CG2-NH1 3.31Å
109	D	82.4	Confident	76.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-42.1	-177.4	-56.5	-9.5	0	0	0	111.6	V105 L106 G113 R357 N359	V105-D109 PolarHBondContact O-N 2.89Å; L106-D109 PolarHBondContact O-N 3.26Å; D109-G113 PolarHBondContact O-N 2.97Å; D109-R357 WeakPolarHBondContact OD1-CD 3.16Å; D109-R357 IonicContact OD1-CZ 3.53Å; D109-R357 IonicContact OD1-NE 2.99Å; D109-R357 IonicContact OD1-NH1 3.8Å; D109-R357 PolarHBondContact OD1-NH1 3.32Å; D109-R357 VanDerWaalsContact OD1-NH1 3.1Å; D109-N359 HydrophobicContact CB-CB 4.45Å; D109-N359 PolarHBondContact OD2-ND2 2.93Å
110	A	86	Confident	78.4	Confident	20 Å²	20	41.6 Å²	41.6	17%	0.165	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-42.1	173.9	0	0	0	0	0	111.8	L106 I108 F114 I362 C366	L106-A110 WeakPolarHBondContact O-CB 3.41Å; L106-A110 PolarHBondContact O-N 3.17Å; I108-A110 PolarHBondContact O-N 3.4Å; A110-F114 WeakPolarHBondContact O-CB 3.35Å; A110-F114 PolarHBondContact O-N 2.94Å; A110-I362 HydrophobicContact CB-CG2 4.19Å; A110-C366 VanDerWaalsContact CB-SG 3.59Å; A110-C366 WeakPolarHBondContact O-CB 3.19Å
111	S	84.6	Confident	80.3	Confident	15 Å²	15	37.1 Å²	37.1	11%	0.105	18%	0.184	C	C	.	.	H	α-helix	trans	-68.9	-40.8	-179	76	0	0	0	0	112.3	L107 I108 F114 S115 P283	L107-S111 WeakPolarHBondContact O-CB 3.26Å; L107-S111 PolarHBondContact O-N 3.18Å; L107-S111 PolarHBondContact O-OG 2.98Å; L107-S111 VanDerWaalsContact O-OG 3.09Å; I108-S111 WeakPolarHBondContact CA-OG 3.31Å; I108-S111 PolarHBondContact O-N 3.3Å; I108-S111 VanDerWaalsContact O-N 3.15Å; I108-S111 PolarHBondContact O-OG 3.35Å; S111-F114 PolarHBondContact O-N 3.08Å; S111-S115 PolarHBondContact O-N 3.04Å; S111-P283 VanDerWaalsContact O-CB 3.31Å; S111-P283 WeakPolarHBondContact O-CB 3.4Å
112	L	83.6	Confident	81.7	Confident	16 Å²	16	32.5 Å²	32.5	8%	0.084	17%	0.167	C	C	.	.	H	α-helix	trans	-68.1	-42.2	175.2	-70.6	173.5	0	0	0	111.4	I108 F114 S115 A116 A287 V350 E353 A354	I108-L112 HydrophobicContact CG2-CD1 3.8Å; I108-L112 HydrophobicContact CG2-CG 4.27Å; I108-L112 WeakPolarHBondContact O-CG 3.38Å; I108-L112 PolarHBondContact O-N 3.47Å; L112-F114 VanDerWaalsContact C-N 3.34Å; L112-F114 PolarHBondContact O-N 2.93Å; L112-S115 PolarHBondContact O-N 3.28Å; L112-A116 PolarHBondContact O-N 3.47Å; L112-A287 HydrophobicContact CD2-CB 4.16Å; L112-V350 HydrophobicContact CB-CG1 4.43Å; L112-V350 WeakPolarHBondContact O-CG1 3.44Å; L112-E353 HydrophobicContact CD1-CB 4.44Å; L112-E353 HydrophobicContact CD1-CG 3.78Å; L112-A354 HydrophobicContact CB-CB 3.81Å
113	G	88.8	Confident	83.2	Confident	2 Å²	2	27 Å²	27	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-57	-48.5	172.5	0	0	0	0	0	111.3	D109 S115 A116 G117 L367	D109-G113 PolarHBondContact O-N 2.97Å; G113-S115 PolarHBondContact O-N 3.42Å; G113-A116 PolarHBondContact O-N 3.47Å; G113-G117 PolarHBondContact O-N 2.9Å; G113-G117 VanDerWaalsContact O-N 3.14Å; G113-L367 WeakPolarHBondContact O-CA 3.39Å; G113-L367 VanDerWaalsContact O-CB 3.26Å; G113-L367 WeakPolarHBondContact O-CB 3.27Å; G113-L367 PolarHBondContact O-N 3.42Å
114	F	91	Very high	84.7	Confident	45 Å²	45	23 Å²	23	20%	0.197	13%	0.126	C	C	.	.	H	α-helix	trans	-57.6	-45.9	175	-178.8	-92.2	0	0	0	112.9	A110 S111 L112 G117 V118 L279 P283 C366 I373	A110-F114 WeakPolarHBondContact O-CB 3.35Å; A110-F114 PolarHBondContact O-N 2.94Å; S111-F114 PolarHBondContact O-N 3.08Å; L112-F114 VanDerWaalsContact C-N 3.34Å; L112-F114 PolarHBondContact O-N 2.93Å; F114-G117 PolarHBondContact O-N 3.28Å; F114-V118 HydrophobicContact CD1-CG2 4.15Å; F114-V118 HydrophobicContact CE1-CG2 3.72Å; F114-V118 HydrophobicContact CZ-CG2 3.95Å; F114-V118 WeakPolarHBondContact O-CG2 3.47Å; F114-V118 PolarHBondContact O-N 3.27Å; F114-V118 VanDerWaalsContact O-N 3.1Å; F114-L279 HydrophobicContact CE1-CB 4.48Å; F114-P283 HydrophobicContact CD1-CG 4.22Å; F114-C366 WeakPolarHBondContact CA-O 3.48Å; F114-C366 HydrophobicContact CB-CB 4.26Å; F114-I373 HydrophobicContact CE2-CD1 3.88Å; F114-I373 HydrophobicContact CZ-CD1 4.41Å
115	S	88	Confident	85.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-56.4	-51.6	175.4	172.4	0	0	0	0	111.4	S111 L112 G113 G117 V118 M119 E284	S111-S115 PolarHBondContact O-N 3.04Å; L112-S115 PolarHBondContact O-N 3.28Å; G113-S115 PolarHBondContact O-N 3.42Å; S115-G117 PolarHBondContact O-N 3Å; S115-G117 VanDerWaalsContact O-N 3.14Å; S115-V118 PolarHBondContact O-N 2.93Å; S115-M119 WeakPolarHBondContact O-CG 3.38Å; S115-M119 PolarHBondContact O-N 3.37Å; S115-E284 PolarHBondContact OG-OE1 3.16Å
116	A	89.6	Confident	86.4	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-53.7	-39.8	177.3	0	0	0	0	0	112.9	L112 G113 T120 V346 V350 V351 L367	L112-A116 PolarHBondContact O-N 3.47Å; G113-A116 PolarHBondContact O-N 3.47Å; A116-T120 WeakPolarHBondContact O-CB 3.5Å; A116-T120 PolarHBondContact O-N 3.35Å; A116-T120 PolarHBondContact O-OG1 2.84Å; A116-V346 HydrophobicContact CB-CG1 3.99Å; A116-V350 HydrophobicContact CB-CB 4.32Å; A116-V350 HydrophobicContact CB-CG1 3.75Å; A116-V351 HydrophobicContact CB-CG2 3.78Å; A116-L367 HydrophobicContact CB-CD1 3.92Å; A116-L367 HydrophobicContact CB-CG 4.27Å
117	G	92.1	Very high	86.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-48.7	176.3	0	0	0	0	0	113	G113 F114 S115 A121 L367 F371	G113-G117 PolarHBondContact O-N 2.9Å; G113-G117 VanDerWaalsContact O-N 3.14Å; F114-G117 PolarHBondContact O-N 3.28Å; S115-G117 PolarHBondContact O-N 3Å; S115-G117 VanDerWaalsContact O-N 3.14Å; G117-A121 PolarHBondContact O-N 3.4Å; G117-L367 VanDerWaalsContact CA-O 3.22Å; G117-L367 WeakPolarHBondContact CA-O 3.38Å; G117-F371 VanDerWaalsContact O-CA 3.31Å; G117-F371 WeakPolarHBondContact O-CA 3.42Å
118	V	90	Very high	87.3	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-63.5	-47.3	179.1	176	0	0	0	0	111	F114 S115 T120 A121 A122 G276 Q280 M374	F114-V118 HydrophobicContact CD1-CG2 4.15Å; F114-V118 HydrophobicContact CE1-CG2 3.72Å; F114-V118 HydrophobicContact CZ-CG2 3.95Å; F114-V118 WeakPolarHBondContact O-CG2 3.47Å; F114-V118 PolarHBondContact O-N 3.27Å; F114-V118 VanDerWaalsContact O-N 3.1Å; S115-V118 PolarHBondContact O-N 2.93Å; V118-T120 PolarHBondContact O-N 3.44Å; V118-A121 PolarHBondContact O-N 3.47Å; V118-A122 WeakPolarHBondContact O-CB 3.03Å; V118-A122 PolarHBondContact O-N 3.43Å; V118-G276 VanDerWaalsContact CG1-O 3.25Å; V118-G276 WeakPolarHBondContact CG1-O 3.4Å; V118-Q280 HydrophobicContact CB-CB 4.31Å; V118-Q280 HydrophobicContact CG1-CB 4.36Å; V118-Q280 HydrophobicContact CG1-CG 4.39Å; V118-M374 HydrophobicContact CG1-CB 4.34Å; V118-M374 HydrophobicContact CG1-CG 4.37Å; V118-M374 HydrophobicContact CG1-SD 4.43Å
119	M	89	Confident	87.8	Confident	2 Å²	2	19.4 Å²	19.4	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-57.8	-45.7	177.6	-69	-179.4	85.6	0	0	112.3	S115 A121 A122 S123 M342 V345 V346 V350	S115-M119 WeakPolarHBondContact O-CG 3.38Å; S115-M119 PolarHBondContact O-N 3.37Å; M119-A121 PolarHBondContact O-N 2.66Å; M119-A122 PolarHBondContact O-N 2.85Å; M119-S123 WeakPolarHBondContact O-CB 3.37Å; M119-S123 PolarHBondContact O-N 3.46Å; M119-S123 PolarHBondContact O-OG 2.91Å; M119-M342 HydrophobicContact CB-CG 4.06Å; M119-M342 HydrophobicContact CB-SD 4.19Å; M119-M342 HydrophobicContact CE-CG 3.74Å; M119-M342 HydrophobicContact CG-CG 4.45Å; M119-M342 VanDerWaalsContact O-SD 3.37Å; M119-V345 HydrophobicContact CE-CB 4.35Å; M119-V345 HydrophobicContact CE-CG1 3.94Å; M119-V346 HydrophobicContact CB-CG2 3.34Å; M119-V346 HydrophobicContact CE-CG2 4.01Å; M119-V346 HydrophobicContact CG-CG2 4.06Å; M119-V346 HydrophobicContact SD-CG2 3.65Å; M119-V350 HydrophobicContact SD-CG2 4.22Å
120	T	92.1	Very high	87.8	Confident	32 Å²	32	19.4 Å²	19.4	20%	0.196	10%	0.097	C	C	.	.	H	α-helix	trans	-62.4	-44.5	-179.3	-55.5	0	0	0	0	111.2	A116 V118 F124 I343 F371	A116-T120 WeakPolarHBondContact O-CB 3.5Å; A116-T120 PolarHBondContact O-N 3.35Å; A116-T120 PolarHBondContact O-OG1 2.84Å; V118-T120 PolarHBondContact O-N 3.44Å; T120-F124 PolarHBondContact O-N 3.17Å; T120-I343 HydrophobicContact CG2-CD1 4.27Å; T120-F371 HydrophobicContact CG2-CD2 4.27Å; T120-F371 HydrophobicContact CG2-CE2 4.13Å
121	A	90.7	Very high	87.8	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-68	-44.8	177.7	0	0	0	0	0	112	G117 V118 M119 S123 F124 W125 F371 M374	G117-A121 PolarHBondContact O-N 3.4Å; V118-A121 PolarHBondContact O-N 3.47Å; M119-A121 PolarHBondContact O-N 2.66Å; A121-S123 VanDerWaalsContact C-N 3.29Å; A121-S123 PolarHBondContact O-N 2.94Å; A121-F124 PolarHBondContact O-N 3.39Å; A121-F124 VanDerWaalsContact O-N 3.16Å; A121-W125 HydrophobicContact CB-CE3 4.02Å; A121-W125 HydrophobicContact CB-CZ3 4.04Å; A121-W125 PolarHBondContact O-N 2.91Å; A121-F371 HydrophobicContact CB-CD2 3.8Å; A121-F371 HydrophobicContact CB-CE2 4.11Å; A121-F371 HydrophobicContact CB-CG 4.2Å; A121-M374 HydrophobicContact CB-CB 3.64Å; A121-M374 HydrophobicContact CB-CG 3.6Å
122	A	86.9	Confident	88	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	I	π-helix	trans	-60.1	-40.1	178	0	0	0	0	0	112	V118 M119 F124 S126 L127 L273 M342 M374	V118-A122 WeakPolarHBondContact O-CB 3.03Å; V118-A122 PolarHBondContact O-N 3.43Å; M119-A122 PolarHBondContact O-N 2.85Å; A122-F124 VanDerWaalsContact C-N 3.26Å; A122-F124 PolarHBondContact O-N 2.88Å; A122-S126 WeakPolarHBondContact O-CA 3.48Å; A122-S126 VanDerWaalsContact O-CB 3.25Å; A122-S126 WeakPolarHBondContact O-CB 3.29Å; A122-S126 PolarHBondContact O-N 2.83Å; A122-L127 PolarHBondContact O-N 2.64Å; A122-L273 HydrophobicContact CB-CD1 4.19Å; A122-M342 HydrophobicContact CB-SD 4.32Å; A122-M374 HydrophobicContact CB-CE 3.84Å; A122-M374 HydrophobicContact CB-CG 4.36Å
123	S	89.8	Confident	88.1	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.021	12%	0.12	C	C	.	.	I	π-helix	trans	-57.2	-39.5	176.6	-65.2	0	0	0	0	112.3	M119 A121 L127 L128 M342	M119-S123 WeakPolarHBondContact O-CB 3.37Å; M119-S123 PolarHBondContact O-N 3.46Å; M119-S123 PolarHBondContact O-OG 2.91Å; A121-S123 VanDerWaalsContact C-N 3.29Å; A121-S123 PolarHBondContact O-N 2.94Å; S123-L127 WeakPolarHBondContact O-CB 3.49Å; S123-L128 VanDerWaalsContact O-CB 3.32Å; S123-L128 WeakPolarHBondContact O-CB 3.2Å; S123-L128 PolarHBondContact O-N 3.03Å; S123-M342 WeakPolarHBondContact OG-CB 3.44Å; S123-M342 VanDerWaalsContact OG-CG 3.31Å; S123-M342 WeakPolarHBondContact OG-CG 3.21Å; S123-M342 PolarHBondContact OG-SD 3.32Å
124	F	90.4	Very high	87.8	Confident	99 Å²	99	23.7 Å²	23.7	43%	0.434	12%	0.12	S	C	.	.	I	π-helix	trans	-82.4	-62	180	-173.3	-96.3	0	0	0	112.5	T120 A121 A122 L128 D129	T120-F124 PolarHBondContact O-N 3.17Å; A121-F124 PolarHBondContact O-N 3.39Å; A121-F124 VanDerWaalsContact O-N 3.16Å; A122-F124 VanDerWaalsContact C-N 3.26Å; A122-F124 PolarHBondContact O-N 2.88Å; F124-L128 HydrophobicContact CD2-CD2 4.02Å; F124-L128 HydrophobicContact CE2-CD2 4.35Å; F124-L128 PolarHBondContact O-N 3.3Å; F124-D129 PolarHBondContact O-N 2.92Å
125	W	86.1	Confident	87.5	Confident	72 Å²	72	21.6 Å²	21.6	27%	0.273	11%	0.111	S	C	.	.	I	π-helix	trans	-77.9	-31.5	-170.7	-77.1	-81.6	0	0	0	114.2	A121 P130 F371 M375 D378	A121-W125 HydrophobicContact CB-CE3 4.02Å; A121-W125 HydrophobicContact CB-CZ3 4.04Å; A121-W125 PolarHBondContact O-N 2.91Å; W125-P130 WeakPolarHBondContact O-CD 3.34Å; W125-F371 AromaticContact CH2-CE1 3.85Å; W125-F371 HydrophobicContact CH2-CE1 3.85Å; W125-F371 HydrophobicContact CH2-CE2 4.42Å; W125-F371 AromaticContact CH2-CZ 3.51Å; W125-F371 HydrophobicContact CH2-CZ 3.51Å; W125-F371 AromaticContact CZ3-CE1 3.92Å; W125-F371 HydrophobicContact CZ3-CE1 3.92Å; W125-F371 AromaticContact CZ3-CE2 3.89Å; W125-F371 HydrophobicContact CZ3-CE2 3.89Å; W125-F371 AromaticContact CZ3-CZ 3.4Å; W125-F371 HydrophobicContact CZ3-CZ 3.4Å; W125-F371 VanDerWaalsContact CZ3-CZ 3.4Å; W125-M375 HydrophobicContact CH2-CG 4.04Å; W125-M375 HydrophobicContact CZ2-CG 4Å; W125-M375 HydrophobicContact CZ3-CB 4.38Å; W125-M375 HydrophobicContact CZ3-CG 4.35Å; W125-D378 VanDerWaalsContact C-OD2 3.32Å; W125-D378 HydrophobicContact CB-CB 4.2Å; W125-D378 WeakPolarHBondContact CB-OD2 3.5Å
126	S	80.8	Confident	87.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-98.4	-17.9	-174	-50.7	0	0	0	0	113.8	A122 Y265 M374 D378	A122-S126 WeakPolarHBondContact O-CA 3.48Å; A122-S126 VanDerWaalsContact O-CB 3.25Å; A122-S126 WeakPolarHBondContact O-CB 3.29Å; A122-S126 PolarHBondContact O-N 2.83Å; S126-Y265 PolarHBondContact O-OH 3.34Å; S126-M374 WeakPolarHBondContact OG-CE 3.39Å; S126-D378 PolarHBondContact N-OD2 3.03Å; S126-D378 PolarHBondContact OG-OD2 2.97Å
127	L	85.3	Confident	87	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	I	π-helix	trans	-120.2	-59.1	-180	-61.7	176.5	0	0	0	112.6	A122 S123 P130 A131 A251 L273 L335 A338 A339 M342	A122-L127 PolarHBondContact O-N 2.64Å; S123-L127 WeakPolarHBondContact O-CB 3.49Å; L127-P130 WeakPolarHBondContact O-CD 3.2Å; L127-A131 VanDerWaalsContact O-CB 3.27Å; L127-A131 WeakPolarHBondContact O-CB 3.32Å; L127-A131 PolarHBondContact O-N 3.15Å; L127-A251 HydrophobicContact CD1-CB 4.02Å; L127-A251 HydrophobicContact CD2-CB 4.24Å; L127-L273 HydrophobicContact CD2-CD1 4.45Å; L127-L273 HydrophobicContact CD2-CD2 3.74Å; L127-L273 HydrophobicContact CG-CD1 4.39Å; L127-L335 HydrophobicContact CD2-CD2 3.7Å; L127-A338 HydrophobicContact CD1-CB 4.04Å; L127-A339 HydrophobicContact CB-CB 3.82Å; L127-A339 HydrophobicContact CD1-CB 4.17Å; L127-M342 HydrophobicContact CD1-CE 4.03Å
128	L	90.3	Very high	86.5	Confident	33 Å²	33	38.4 Å²	38.4	17%	0.173	19%	0.191	C	C	.	.	I	π-helix	trans	-71.6	-47.6	-172.4	-162.7	71.1	0	0	0	113.6	S123 F124 A131 I132 V147 F151	S123-L128 VanDerWaalsContact O-CB 3.32Å; S123-L128 WeakPolarHBondContact O-CB 3.2Å; S123-L128 PolarHBondContact O-N 3.03Å; F124-L128 HydrophobicContact CD2-CD2 4.02Å; F124-L128 HydrophobicContact CE2-CD2 4.35Å; F124-L128 PolarHBondContact O-N 3.3Å; L128-A131 WeakPolarHBondContact O-CB 3.36Å; L128-A131 PolarHBondContact O-N 3.14Å; L128-A131 VanDerWaalsContact O-N 3.12Å; L128-I132 HydrophobicContact CG-CD1 4.08Å; L128-I132 VanDerWaalsContact O-CG1 3.29Å; L128-I132 WeakPolarHBondContact O-CG1 3.34Å; L128-I132 PolarHBondContact O-N 3.26Å; L128-V147 HydrophobicContact CD1-CG1 3.63Å; L128-F151 HydrophobicContact CD1-CD2 4.21Å
129	D	87.1	Confident	86.2	Confident	67 Å²	67	42.3 Å²	42.3	36%	0.358	21%	0.206	S	C	.	.	H	α-helix	trans	-56.5	-49.5	177.1	166.9	75.9	0	0	0	112.1	F124 A131 I132 S133 K269	F124-D129 PolarHBondContact O-N 2.92Å; D129-A131 VanDerWaalsContact C-N 3.35Å; D129-A131 PolarHBondContact O-N 3.37Å; D129-I132 PolarHBondContact O-N 3.38Å; D129-S133 PolarHBondContact O-N 2.86Å; D129-K269 IonicContact OD2-NZ 2.73Å; D129-K269 PolarHBondContact OD2-NZ 3.49Å
130	P	80.9	Confident	85.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-36.6	173.3	-15.5	25.2	0	0	0	113.5	W125 L127 I132 S133 I134 Y265 K269 L335	W125-P130 WeakPolarHBondContact O-CD 3.34Å; L127-P130 WeakPolarHBondContact O-CD 3.2Å; P130-I132 VanDerWaalsContact C-N 3.34Å; P130-I132 PolarHBondContact O-N 2.9Å; P130-S133 PolarHBondContact O-N 3.2Å; P130-I134 WeakPolarHBondContact O-CB 3.36Å; P130-I134 WeakPolarHBondContact O-CD1 3.28Å; P130-I134 WeakPolarHBondContact O-CG1 3.32Å; P130-I134 PolarHBondContact O-N 3.47Å; P130-Y265 HydrophobicContact CB-CD2 3.4Å; P130-Y265 HydrophobicContact CB-CE2 3.61Å; P130-Y265 HydrophobicContact CG-CD2 4.04Å; P130-Y265 HydrophobicContact CG-CE2 3.79Å; P130-K269 HydrophobicContact CB-CD 4.42Å; P130-K269 HydrophobicContact CG-CD 3.83Å; P130-L335 HydrophobicContact CB-CD1 4.35Å
131	A	87.4	Confident	85.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-42.4	175.9	0	0	0	0	0	111.8	L127 L128 D129 G135 V147 L335	L127-A131 VanDerWaalsContact O-CB 3.27Å; L127-A131 WeakPolarHBondContact O-CB 3.32Å; L127-A131 PolarHBondContact O-N 3.15Å; L128-A131 WeakPolarHBondContact O-CB 3.36Å; L128-A131 PolarHBondContact O-N 3.14Å; L128-A131 VanDerWaalsContact O-N 3.12Å; D129-A131 VanDerWaalsContact C-N 3.35Å; D129-A131 PolarHBondContact O-N 3.37Å; A131-G135 WeakPolarHBondContact O-CA 3.34Å; A131-G135 PolarHBondContact O-N 3.23Å; A131-V147 HydrophobicContact CB-CG1 4.24Å; A131-V147 HydrophobicContact CB-CG2 4.1Å; A131-V147 WeakPolarHBondContact O-CG2 2.91Å; A131-L335 HydrophobicContact CB-CB 3.74Å; A131-L335 HydrophobicContact CB-CD1 4.26Å
132	I	88.6	Confident	85.2	Confident	80 Å²	80	63.3 Å²	63.3	41%	0.41	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-48.1	176.2	-65.8	166	0	0	0	110.3	L128 D129 P130 I134 G135 H136 V147	L128-I132 HydrophobicContact CG-CD1 4.08Å; L128-I132 VanDerWaalsContact O-CG1 3.29Å; L128-I132 WeakPolarHBondContact O-CG1 3.34Å; L128-I132 PolarHBondContact O-N 3.26Å; D129-I132 PolarHBondContact O-N 3.38Å; P130-I132 VanDerWaalsContact C-N 3.34Å; P130-I132 PolarHBondContact O-N 2.9Å; I132-I134 PolarHBondContact O-N 2.94Å; I132-G135 PolarHBondContact O-N 3.5Å; I132-H136 WeakPolarHBondContact O-CB 3.34Å; I132-H136 PolarHBondContact O-N 3.28Å; I132-V147 HydrophobicContact CG1-CG1 3.9Å; I132-V147 HydrophobicContact CG1-CG2 4.44Å
133	S	84.7	Confident	85.2	Confident	60 Å²	60	63.4 Å²	63.4	42%	0.42	30%	0.295	S	S	.	.	H	α-helix	trans	-59.4	-45.1	179.2	-179.5	0	0	0	0	112.3	D129 P130 H137	D129-S133 PolarHBondContact O-N 2.86Å; P130-S133 PolarHBondContact O-N 3.2Å; S133-H137 PolarHBondContact O-N 2.96Å
134	I	82.7	Confident	85.1	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-71.7	-41.4	179	-62.2	165.4	0	0	0	111	P130 I132 H136 H137 L138 S262 Y265 L331 L335	P130-I134 WeakPolarHBondContact O-CB 3.36Å; P130-I134 WeakPolarHBondContact O-CD1 3.28Å; P130-I134 WeakPolarHBondContact O-CG1 3.32Å; P130-I134 PolarHBondContact O-N 3.47Å; I132-I134 PolarHBondContact O-N 2.94Å; I134-H136 VanDerWaalsContact C-N 3.32Å; I134-H136 PolarHBondContact O-N 3.09Å; I134-H137 PolarHBondContact O-N 3.14Å; I134-L138 HydrophobicContact CG2-CD1 3.76Å; I134-L138 HydrophobicContact CG2-CG 4.26Å; I134-L138 WeakPolarHBondContact O-CG 3.02Å; I134-L138 PolarHBondContact O-N 2.92Å; I134-S262 WeakPolarHBondContact CD1-OG 3.48Å; I134-S262 WeakPolarHBondContact CG1-OG 3.25Å; I134-Y265 HydrophobicContact CD1-CD2 4.35Å; I134-L331 HydrophobicContact CD1-CD2 3.5Å; I134-L331 VanDerWaalsContact CD1-CD2 3.5Å; I134-L331 HydrophobicContact CG2-CD2 4.3Å; I134-L335 HydrophobicContact CD1-CD1 4.05Å
135	G	85.1	Confident	85.2	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.8	-42.6	176.9	0	0	0	0	0	112	A131 I132 H137 L138 Y139 G143	A131-G135 WeakPolarHBondContact O-CA 3.34Å; A131-G135 PolarHBondContact O-N 3.23Å; I132-G135 PolarHBondContact O-N 3.5Å; G135-H137 VanDerWaalsContact C-N 3.34Å; G135-L138 PolarHBondContact O-N 2.93Å; G135-Y139 PolarHBondContact O-N 2.83Å; G135-G143 VanDerWaalsContact O-CA 3.3Å; G135-G143 WeakPolarHBondContact O-CA 3.49Å
136	H	85	Confident	85.4	Confident	129 Å²	129	68.3 Å²	68.3	60%	0.597	32%	0.319	S	S	*	.	H	α-helix	trans	-65.5	-36.3	175.9	-171.5	-119.3	0	0	0	112.2	I132 I134 E140	I132-H136 WeakPolarHBondContact O-CB 3.34Å; I132-H136 PolarHBondContact O-N 3.28Å; I134-H136 VanDerWaalsContact C-N 3.32Å; I134-H136 PolarHBondContact O-N 3.09Å; H136-E140 PolarHBondContact CD2-O 3.37Å; H136-E140 VanDerWaalsContact CD2-O 3.3Å; H136-E140 WeakPolarHBondContact O-CA 3.26Å; H136-E140 PolarHBondContact O-N 3.39Å
137	H	81.5	Confident	86	Confident	136 Å²	136	68.6 Å²	68.6	63%	0.63	32%	0.321	S	S	*	.	H	α-helix	trans	-72.6	-33.1	176.6	-169.7	-61.2	0	0	0	113.1	S133 I134 G135	S133-H137 PolarHBondContact O-N 2.96Å; I134-H137 PolarHBondContact O-N 3.14Å; G135-H137 VanDerWaalsContact C-N 3.34Å
138	L	83	Confident	86.4	Confident	89 Å²	89	72.9 Å²	72.9	47%	0.466	34%	0.343	S	S	.	.	H	α-helix	trans	-87.4	-35.5	-177.4	-71	176	0	0	0	113.7	I134 G135 P332	I134-L138 HydrophobicContact CG2-CD1 3.76Å; I134-L138 HydrophobicContact CG2-CG 4.26Å; I134-L138 WeakPolarHBondContact O-CG 3.02Å; I134-L138 PolarHBondContact O-N 2.92Å; G135-L138 PolarHBondContact O-N 2.93Å; L138-P332 HydrophobicContact CD1-CG 4.37Å
139	Y	83.7	Confident	86.6	Confident	82 Å²	82	73.7 Å²	73.7	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-125.9	12	-170.9	-59.9	-76	0	0	0	113.2	G135 K141 Y142 M146 A329 P332	G135-Y139 PolarHBondContact O-N 2.83Å; Y139-K141 PolarHBondContact O-N 3.19Å; Y139-Y142 PolarHBondContact O-N 2.77Å; Y139-M146 HydrophobicContact CE1-CE 4.46Å; Y139-M146 HydrophobicContact CE2-CE 3.97Å; Y139-M146 HydrophobicContact CE2-CG 4.37Å; Y139-A329 PolarHBondContact OH-O 3.31Å; Y139-A329 VanDerWaalsContact OH-O 3.13Å; Y139-P332 HydrophobicContact CE2-CG 4.18Å
140	E	82.5	Confident	86.9	Confident	149 Å²	149	70.5 Å²	70.5	70%	0.696	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	50.5	-127.2	-179.7	-57.4	-179.2	172.1	0	0	111.6	H136 Y142 G143	H136-E140 PolarHBondContact CD2-O 3.37Å; H136-E140 VanDerWaalsContact CD2-O 3.3Å; H136-E140 WeakPolarHBondContact O-CA 3.26Å; H136-E140 PolarHBondContact O-N 3.39Å; E140-Y142 PolarHBondContact O-N 3.32Å; E140-Y142 VanDerWaalsContact O-N 3.16Å; E140-G143 PolarHBondContact O-N 2.99Å; E140-G143 VanDerWaalsContact O-N 3.14Å
141	K	81.9	Confident	87.6	Confident	167 Å²	167	73.1 Å²	73.1	73%	0.726	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-59.6	-24.8	179.9	-171.1	177.3	179.1	-178.4	0	113.5	Y139 Y144	Y139-K141 PolarHBondContact O-N 3.19Å; K141-Y144 WeakPolarHBondContact O-CD1 3.19Å; K141-Y144 VanDerWaalsContact O-CE1 3.29Å; K141-Y144 WeakPolarHBondContact O-CE1 3.31Å
142	Y	86.4	Confident	88	Confident	160 Å²	160	78.1 Å²	78.1	63%	0.627	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-89.7	-3.2	-178.4	-58.2	-72.7	0	0	0	113.4	Y139 E140 Y144 I145	Y139-Y142 PolarHBondContact O-N 2.77Å; E140-Y142 PolarHBondContact O-N 3.32Å; E140-Y142 VanDerWaalsContact O-N 3.16Å; Y142-Y144 PolarHBondContact O-N 3.42Å; Y142-I145 HydrophobicContact CD1-CD1 3.96Å; Y142-I145 WeakPolarHBondContact O-CB 3.22Å; Y142-I145 PolarHBondContact O-N 2.86Å
143	G	85.4	Confident	88.2	Confident	2 Å²	2	76.1 Å²	76.1	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-55	-35.7	-179.9	0	0	0	0	0	114.3	G135 E140 I145 M146 V147	G135-G143 VanDerWaalsContact O-CA 3.3Å; G135-G143 WeakPolarHBondContact O-CA 3.49Å; E140-G143 PolarHBondContact O-N 2.99Å; E140-G143 VanDerWaalsContact O-N 3.14Å; G143-I145 VanDerWaalsContact C-N 3.28Å; G143-I145 PolarHBondContact O-N 3.1Å; G143-M146 PolarHBondContact O-N 2.73Å; G143-V147 PolarHBondContact O-N 3.03Å
144	Y	89.4	Confident	88.4	Confident	147 Å²	147	73.3 Å²	73.3	58%	0.576	35%	0.348	S	S	*	.	H	α-helix	trans	-65	-30	179.1	80.3	-88.4	0	0	0	113	K141 Y142 V147 L148	K141-Y144 WeakPolarHBondContact O-CD1 3.19Å; K141-Y144 VanDerWaalsContact O-CE1 3.29Å; K141-Y144 WeakPolarHBondContact O-CE1 3.31Å; Y142-Y144 PolarHBondContact O-N 3.42Å; Y144-V147 PolarHBondContact O-N 3.06Å; Y144-L148 VanDerWaalsContact O-CB 3.22Å; Y144-L148 WeakPolarHBondContact O-CB 3.09Å; Y144-L148 PolarHBondContact O-N 3.07Å
145	I	92.2	Very high	88.8	Confident	81 Å²	81	74.2 Å²	74.2	42%	0.415	36%	0.356	S	S	.	.	H	α-helix	trans	-67.6	-41.9	179.4	-58.7	178.1	0	0	0	109.7	Y142 G143 L148 S149	Y142-I145 HydrophobicContact CD1-CD1 3.96Å; Y142-I145 WeakPolarHBondContact O-CB 3.22Å; Y142-I145 PolarHBondContact O-N 2.86Å; G143-I145 VanDerWaalsContact C-N 3.28Å; G143-I145 PolarHBondContact O-N 3.1Å; I145-L148 PolarHBondContact O-N 2.86Å; I145-S149 VanDerWaalsContact O-CB 3.29Å; I145-S149 WeakPolarHBondContact O-CB 3.41Å; I145-S149 PolarHBondContact O-N 3.49Å; I145-S149 PolarHBondContact O-OG 3.05Å
146	M	90.4	Very high	89	Confident	48 Å²	48	76 Å²	76	24%	0.236	38%	0.375	C	S	.	.	H	α-helix	trans	-62.4	-45.8	176.2	-174.9	64.7	82.5	0	0	111.1	Y139 G143 S149 G150 P332 F333	Y139-M146 HydrophobicContact CE1-CE 4.46Å; Y139-M146 HydrophobicContact CE2-CE 3.97Å; Y139-M146 HydrophobicContact CE2-CG 4.37Å; G143-M146 PolarHBondContact O-N 2.73Å; M146-S149 PolarHBondContact O-OG 3.38Å; M146-G150 PolarHBondContact O-N 2.95Å; M146-P332 HydrophobicContact CG-CB 4.45Å; M146-P332 HydrophobicContact CG-CG 4.04Å; M146-F333 HydrophobicContact CG-CB 4.12Å; M146-F333 HydrophobicContact SD-CB 3.83Å; M146-F333 HydrophobicContact SD-CD2 4.03Å; M146-F333 HydrophobicContact SD-CG 4.36Å
147	V	92.4	Very high	89.1	Confident	7 Å²	7	74 Å²	74	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-48	178.4	175.7	0	0	0	0	111	L128 A131 I132 G143 Y144 S149 G150 F151 P332 S336	L128-V147 HydrophobicContact CD1-CG1 3.63Å; A131-V147 HydrophobicContact CB-CG1 4.24Å; A131-V147 HydrophobicContact CB-CG2 4.1Å; A131-V147 WeakPolarHBondContact O-CG2 2.91Å; I132-V147 HydrophobicContact CG1-CG1 3.9Å; I132-V147 HydrophobicContact CG1-CG2 4.44Å; G143-V147 PolarHBondContact O-N 3.03Å; Y144-V147 PolarHBondContact O-N 3.06Å; V147-S149 PolarHBondContact O-N 2.91Å; V147-G150 PolarHBondContact O-N 2.97Å; V147-F151 WeakPolarHBondContact O-CB 3.06Å; V147-F151 PolarHBondContact O-N 3.01Å; V147-P332 HydrophobicContact CG2-CB 4.29Å; V147-S336 WeakPolarHBondContact O-CB 3.29Å; V147-S336 PolarHBondContact O-OG 2.9Å
148	L	94.9	Very high	89.1	Confident	90 Å²	90	67.8 Å²	67.8	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-61.5	-44.4	179.5	179	61.6	0	0	0	112	Y144 I145 F151 L152	Y144-L148 VanDerWaalsContact O-CB 3.22Å; Y144-L148 WeakPolarHBondContact O-CB 3.09Å; Y144-L148 PolarHBondContact O-N 3.07Å; I145-L148 PolarHBondContact O-N 2.86Å; L148-F151 PolarHBondContact O-N 3.31Å; L148-L152 HydrophobicContact CD1-CD1 4.11Å; L148-L152 HydrophobicContact CD1-CG 4.2Å; L148-L152 HydrophobicContact CG-CD1 4.16Å; L148-L152 WeakPolarHBondContact O-CG 3.41Å; L148-L152 PolarHBondContact O-N 2.9Å
149	S	94.1	Very high	89.2	Confident	50 Å²	50	72 Å²	72	35%	0.35	35%	0.345	S	S	.	.	H	α-helix	trans	-63.4	-42.4	178	60.5	0	0	0	0	112	I145 M146 V147 A153	I145-S149 VanDerWaalsContact O-CB 3.29Å; I145-S149 WeakPolarHBondContact O-CB 3.41Å; I145-S149 PolarHBondContact O-N 3.49Å; I145-S149 PolarHBondContact O-OG 3.05Å; M146-S149 PolarHBondContact O-OG 3.38Å; V147-S149 PolarHBondContact O-N 2.91Å; S149-A153 WeakPolarHBondContact O-CB 3.23Å; S149-A153 PolarHBondContact O-N 3.22Å
150	G	93	Very high	89.1	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-64	-43.2	174	0	0	0	0	0	112.6	M146 V147 L152 A153 G154 F333 S336 F337	M146-G150 PolarHBondContact O-N 2.95Å; V147-G150 PolarHBondContact O-N 2.97Å; G150-L152 PolarHBondContact O-N 3.33Å; G150-A153 PolarHBondContact O-N 3.27Å; G150-G154 PolarHBondContact O-N 2.96Å; G150-F333 VanDerWaalsContact CA-CD2 3.42Å; G150-S336 VanDerWaalsContact CA-OG 3.23Å; G150-S336 WeakPolarHBondContact CA-OG 3.28Å; G150-F337 WeakPolarHBondContact O-CA 3.44Å
151	F	94.5	Very high	88.7	Confident	55 Å²	55	70 Å²	70	24%	0.241	34%	0.336	C	S	.	.	H	α-helix	trans	-58.6	-48.4	176.5	-178.1	-94.4	0	0	0	112.5	L128 V147 L148 G154 A155 S336 A339 G340 I343	L128-F151 HydrophobicContact CD1-CD2 4.21Å; V147-F151 WeakPolarHBondContact O-CB 3.06Å; V147-F151 PolarHBondContact O-N 3.01Å; L148-F151 PolarHBondContact O-N 3.31Å; F151-G154 PolarHBondContact O-N 2.93Å; F151-A155 PolarHBondContact O-N 2.55Å; F151-A155 VanDerWaalsContact O-N 3.16Å; F151-S336 VanDerWaalsContact CA-O 3.28Å; F151-S336 WeakPolarHBondContact CA-O 3.36Å; F151-S336 PolarHBondContact N-OG 3.45Å; F151-A339 HydrophobicContact CD2-CB 4.26Å; F151-G340 VanDerWaalsContact CD2-CA 3.48Å; F151-G340 WeakPolarHBondContact O-CA 3.36Å; F151-I343 HydrophobicContact CE2-CB 4.43Å; F151-I343 HydrophobicContact CE2-CG1 4.18Å; F151-I343 HydrophobicContact CZ-CB 4.38Å; F151-I343 HydrophobicContact CZ-CG1 4.43Å; F151-I343 HydrophobicContact CZ-CG2 4.3Å
152	L	95.7	Very high	88.1	Confident	104 Å²	104	64.1 Å²	64.1	55%	0.545	31%	0.313	S	S	.	.	H	α-helix	trans	-66.6	-37.5	176.7	-66.9	175.6	0	0	0	112	L148 G150 G156	L148-L152 HydrophobicContact CD1-CD1 4.11Å; L148-L152 HydrophobicContact CD1-CG 4.2Å; L148-L152 HydrophobicContact CG-CD1 4.16Å; L148-L152 WeakPolarHBondContact O-CG 3.41Å; L148-L152 PolarHBondContact O-N 2.9Å; G150-L152 PolarHBondContact O-N 3.33Å; L152-G156 PolarHBondContact O-N 3.47Å
153	A	93.5	Very high	87.6	Confident	39 Å²	39	61 Å²	61	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-64.1	-39.6	176.2	0	0	0	0	0	111.8	S149 G150 F157 F333 F337	S149-A153 WeakPolarHBondContact O-CB 3.23Å; S149-A153 PolarHBondContact O-N 3.22Å; G150-A153 PolarHBondContact O-N 3.27Å; A153-F157 WeakPolarHBondContact O-CB 3.31Å; A153-F157 PolarHBondContact O-N 2.87Å; A153-F333 HydrophobicContact CB-CE2 4.34Å; A153-F333 HydrophobicContact CB-CZ 3.96Å; A153-F337 HydrophobicContact CB-CD2 4.12Å
154	G	89.8	Confident	87	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.3	-48.2	175.6	0	0	0	0	0	112.9	G150 F151 F157 L158 F337	G150-G154 PolarHBondContact O-N 2.96Å; F151-G154 PolarHBondContact O-N 2.93Å; G154-F157 PolarHBondContact O-N 3.19Å; G154-L158 PolarHBondContact O-N 3.02Å; G154-F337 VanDerWaalsContact CA-CD2 3.44Å; G154-F337 WeakPolarHBondContact CA-O 3.38Å
155	A	89.6	Confident	85.7	Confident	23 Å²	23	64.7 Å²	64.7	19%	0.19	34%	0.337	C	S	.	.	H	α-helix	trans	-65.5	-41.5	176.5	0	0	0	0	0	112.1	F151 L158 R159 Y344	F151-A155 PolarHBondContact O-N 2.55Å; F151-A155 VanDerWaalsContact O-N 3.16Å; A155-L158 PolarHBondContact O-N 3.08Å; A155-R159 PolarHBondContact O-N 3.17Å; A155-R159 VanDerWaalsContact O-N 3.09Å; A155-Y344 HydrophobicContact CB-CD2 4.39Å; A155-Y344 WeakPolarHBondContact O-CD2 3.33Å
156	G	90.6	Very high	83.9	Confident	38 Å²	38	63 Å²	63	39%	0.392	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-35.9	177.2	0	0	0	0	0	113.3	L152 R159 F160	L152-G156 PolarHBondContact O-N 3.47Å; G156-R159 PolarHBondContact O-N 3.4Å; G156-F160 WeakPolarHBondContact O-CB 3.48Å; G156-F160 PolarHBondContact O-N 2.79Å
157	F	86.8	Confident	81.4	Confident	87 Å²	87	65.2 Å²	65.2	38%	0.382	36%	0.356	S	S	.	.	H	α-helix	trans	-59.8	-49.4	175	174.8	-94	0	0	0	110.8	A153 G154 F160 F161 F337	A153-F157 WeakPolarHBondContact O-CB 3.31Å; A153-F157 PolarHBondContact O-N 2.87Å; G154-F157 PolarHBondContact O-N 3.19Å; F157-F160 WeakPolarHBondContact O-CB 3.26Å; F157-F160 PolarHBondContact O-N 3.32Å; F157-F161 HydrophobicContact CD1-CD2 4.09Å; F157-F161 HydrophobicContact CD1-CE2 4.33Å; F157-F161 HydrophobicContact CD2-CD2 4.15Å; F157-F161 AromaticContact CD2-CE2 3.85Å; F157-F161 HydrophobicContact CD2-CE2 3.85Å; F157-F161 AromaticContact CE1-CD2 3.78Å; F157-F161 HydrophobicContact CE1-CD2 3.78Å; F157-F161 AromaticContact CE1-CE2 3.73Å; F157-F161 HydrophobicContact CE1-CE2 3.73Å; F157-F161 HydrophobicContact CE1-CZ 4.39Å; F157-F161 AromaticContact CE2-CD2 3.87Å; F157-F161 HydrophobicContact CE2-CD2 3.87Å; F157-F161 AromaticContact CE2-CE2 3.19Å; F157-F161 HydrophobicContact CE2-CE2 3.19Å; F157-F161 HydrophobicContact CE2-CZ 4Å; F157-F161 HydrophobicContact CG-CD2 4.27Å; F157-F161 HydrophobicContact CG-CE2 4.38Å; F157-F161 AromaticContact CZ-CD2 3.67Å; F157-F161 HydrophobicContact CZ-CD2 3.67Å; F157-F161 AromaticContact CZ-CE2 3.11Å; F157-F161 HydrophobicContact CZ-CE2 3.11Å; F157-F161 AromaticContact CZ-CZ 3.65Å; F157-F161 HydrophobicContact CZ-CZ 3.65Å; F157-F161 WeakPolarHBondContact O-CD2 3.43Å; F157-F161 PolarHBondContact O-N 3.23Å; F157-F337 HydrophobicContact CB-CE2 3.9Å; F157-F337 HydrophobicContact CB-CZ 3.88Å; F157-F337 AromaticContact CD1-CZ 3.87Å; F157-F337 HydrophobicContact CD1-CZ 3.87Å; F157-F337 HydrophobicContact CD2-CZ 4.2Å; F157-F337 HydrophobicContact CE1-CZ 4.44Å; F157-F337 HydrophobicContact CG-CE2 4.2Å; F157-F337 AromaticContact CG-CZ 3.73Å; F157-F337 HydrophobicContact CG-CZ 3.73Å
158	L	81.9	Confident	78.8	Confident	6 Å²	6	73.3 Å²	73.3	3%	0.031	39%	0.393	C	S	.	.	H	α-helix	trans	-66.6	-43.3	177.9	-72.8	-175	0	0	0	112.7	G154 A155 F160 F161 D162 P247 A341 Y344 V345	G154-L158 PolarHBondContact O-N 3.02Å; A155-L158 PolarHBondContact O-N 3.08Å; L158-F160 PolarHBondContact O-N 3.5Å; L158-F160 VanDerWaalsContact O-N 3.14Å; L158-F161 CarbonylContact O-C 3.5Å; L158-F161 WeakPolarHBondContact O-CA 3.45Å; L158-F161 WeakPolarHBondContact O-CB 3.34Å; L158-F161 PolarHBondContact O-N 3.04Å; L158-D162 PolarHBondContact O-N 3.32Å; L158-P247 HydrophobicContact CD1-CG 4.08Å; L158-P247 HydrophobicContact CD2-CG 4.28Å; L158-A341 HydrophobicContact CD1-CB 3.73Å; L158-A341 WeakPolarHBondContact CD1-O 3.25Å; L158-A341 HydrophobicContact CG-CB 4.1Å; L158-Y344 HydrophobicContact CB-CD1 3.69Å; L158-Y344 HydrophobicContact CB-CE1 4.19Å; L158-Y344 HydrophobicContact CB-CG 4.14Å; L158-Y344 HydrophobicContact CD1-CD1 4.2Å; L158-V345 HydrophobicContact CD1-CG2 3.42Å; L158-V345 VanDerWaalsContact CD1-CG2 3.42Å
159	R	84.5	Confident	76	Confident	177 Å²	177	72.7 Å²	72.7	67%	0.668	39%	0.393	S	S	*	.	H	α-helix	trans	-53.3	-38.6	172.1	-176	178.6	172.2	163.4	0.6	112.8	A155 G156 S163 Y344	A155-R159 PolarHBondContact O-N 3.17Å; A155-R159 VanDerWaalsContact O-N 3.09Å; G156-R159 PolarHBondContact O-N 3.4Å; R159-S163 WeakPolarHBondContact O-CB 3.39Å; R159-S163 PolarHBondContact O-N 2.81Å; R159-Y344 HydrophobicContact CB-CD2 4.48Å; R159-Y344 HydrophobicContact CB-CE2 3.67Å; R159-Y344 HydrophobicContact CG-CE2 4.28Å
160	F	82.4	Confident	73	Confident	124 Å²	124	72 Å²	72	54%	0.544	39%	0.388	S	S	.	.	H	α-helix	trans	-68.4	-42.7	176.1	173.7	-100.9	0	0	0	111.9	G156 F157 L158 S163 I164	G156-F160 WeakPolarHBondContact O-CB 3.48Å; G156-F160 PolarHBondContact O-N 2.79Å; F157-F160 WeakPolarHBondContact O-CB 3.26Å; F157-F160 PolarHBondContact O-N 3.32Å; L158-F160 PolarHBondContact O-N 3.5Å; L158-F160 VanDerWaalsContact O-N 3.14Å; F160-S163 WeakPolarHBondContact O-CB 3.33Å; F160-S163 PolarHBondContact O-N 3.34Å; F160-I164 HydrophobicContact CD1-CD1 3.9Å; F160-I164 HydrophobicContact CE1-CD1 3.31Å; F160-I164 HydrophobicContact CE1-CG1 4.46Å; F160-I164 HydrophobicContact CE2-CD1 4.07Å; F160-I164 HydrophobicContact CZ-CD1 3.42Å; F160-I164 VanDerWaalsContact CZ-CD1 3.42Å; F160-I164 HydrophobicContact CZ-CG1 4.39Å; F160-I164 WeakPolarHBondContact O-CG1 3.33Å; F160-I164 PolarHBondContact O-N 3.19Å; F160-I164 VanDerWaalsContact O-N 3.11Å
161	F	72.6	Confident	70.3	Confident	65 Å²	65	76.7 Å²	76.7	29%	0.285	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-43.1	174.2	-90.4	-99.8	0	0	0	111.9	F157 L158 S163 I164 F165	F157-F161 HydrophobicContact CD1-CD2 4.09Å; F157-F161 HydrophobicContact CD1-CE2 4.33Å; F157-F161 HydrophobicContact CD2-CD2 4.15Å; F157-F161 AromaticContact CD2-CE2 3.85Å; F157-F161 HydrophobicContact CD2-CE2 3.85Å; F157-F161 AromaticContact CE1-CD2 3.78Å; F157-F161 HydrophobicContact CE1-CD2 3.78Å; F157-F161 AromaticContact CE1-CE2 3.73Å; F157-F161 HydrophobicContact CE1-CE2 3.73Å; F157-F161 HydrophobicContact CE1-CZ 4.39Å; F157-F161 AromaticContact CE2-CD2 3.87Å; F157-F161 HydrophobicContact CE2-CD2 3.87Å; F157-F161 AromaticContact CE2-CE2 3.19Å; F157-F161 HydrophobicContact CE2-CE2 3.19Å; F157-F161 HydrophobicContact CE2-CZ 4Å; F157-F161 HydrophobicContact CG-CD2 4.27Å; F157-F161 HydrophobicContact CG-CE2 4.38Å; F157-F161 AromaticContact CZ-CD2 3.67Å; F157-F161 HydrophobicContact CZ-CD2 3.67Å; F157-F161 AromaticContact CZ-CE2 3.11Å; F157-F161 HydrophobicContact CZ-CE2 3.11Å; F157-F161 AromaticContact CZ-CZ 3.65Å; F157-F161 HydrophobicContact CZ-CZ 3.65Å; F157-F161 WeakPolarHBondContact O-CD2 3.43Å; F157-F161 PolarHBondContact O-N 3.23Å; L158-F161 CarbonylContact O-C 3.5Å; L158-F161 WeakPolarHBondContact O-CA 3.45Å; L158-F161 WeakPolarHBondContact O-CB 3.34Å; L158-F161 PolarHBondContact O-N 3.04Å; F161-S163 PolarHBondContact O-N 3.05Å; F161-I164 PolarHBondContact O-N 2.79Å; F161-F165 AromaticContact CD1-CD2 3.92Å; F161-F165 HydrophobicContact CD1-CD2 3.92Å; F161-F165 AromaticContact CD1-CE2 3.6Å; F161-F165 HydrophobicContact CD1-CE2 3.6Å; F161-F165 AromaticContact CE1-CE2 3.97Å; F161-F165 HydrophobicContact CE1-CE2 3.97Å; F161-F165 WeakPolarHBondContact O-CD2 3.39Å; F161-F165 PolarHBondContact O-N 2.93Å
162	D	70.8	Confident	67.3	Low	43 Å²	43	77.4 Å²	77.4	23%	0.23	43%	0.428	C	S	.	.	H	α-helix	trans	-66.7	-27.8	174.3	-64.7	-34.2	0	0	0	111.6	L158 I164 G166 Y344	L158-D162 PolarHBondContact O-N 3.32Å; D162-I164 VanDerWaalsContact C-N 3.32Å; D162-I164 PolarHBondContact O-N 3.27Å; D162-G166 WeakPolarHBondContact O-CA 3.27Å; D162-G166 PolarHBondContact O-N 3.46Å; D162-Y344 WeakPolarHBondContact OD2-CE1 3.46Å
163	S	75.9	Confident	64.3	Low	95 Å²	95	76.2 Å²	76.2	66%	0.664	43%	0.425	S	S	*	.	H	α-helix	trans	-70.1	-28.1	170	-173.9	0	0	0	0	113.3	R159 F160 F161	R159-S163 WeakPolarHBondContact O-CB 3.39Å; R159-S163 PolarHBondContact O-N 2.81Å; F160-S163 WeakPolarHBondContact O-CB 3.33Å; F160-S163 PolarHBondContact O-N 3.34Å; F161-S163 PolarHBondContact O-N 3.05Å
164	I	72.1	Confident	61.4	Low	98 Å²	98	78.7 Å²	78.7	50%	0.503	43%	0.432	S	S	.	.	H	α-helix	trans	-84.5	-45.8	179.6	-70.1	172.2	0	0	0	111.1	F160 F161 D162	F160-I164 HydrophobicContact CD1-CD1 3.9Å; F160-I164 HydrophobicContact CE1-CD1 3.31Å; F160-I164 HydrophobicContact CE1-CG1 4.46Å; F160-I164 HydrophobicContact CE2-CD1 4.07Å; F160-I164 HydrophobicContact CZ-CD1 3.42Å; F160-I164 VanDerWaalsContact CZ-CD1 3.42Å; F160-I164 HydrophobicContact CZ-CG1 4.39Å; F160-I164 WeakPolarHBondContact O-CG1 3.33Å; F160-I164 PolarHBondContact O-N 3.19Å; F160-I164 VanDerWaalsContact O-N 3.11Å; F161-I164 PolarHBondContact O-N 2.79Å; D162-I164 VanDerWaalsContact C-N 3.32Å; D162-I164 PolarHBondContact O-N 3.27Å
165	F	62.4	Low	58.8	Low	128 Å²	128	82.2 Å²	82.2	56%	0.561	46%	0.461	S	S	*	.	H	α-helix	trans	-96.3	-20.2	-175	-67.3	-74.6	0	0	0	113	F161 T167	F161-F165 AromaticContact CD1-CD2 3.92Å; F161-F165 HydrophobicContact CD1-CD2 3.92Å; F161-F165 AromaticContact CD1-CE2 3.6Å; F161-F165 HydrophobicContact CD1-CE2 3.6Å; F161-F165 AromaticContact CE1-CE2 3.97Å; F161-F165 HydrophobicContact CE1-CE2 3.97Å; F161-F165 WeakPolarHBondContact O-CD2 3.39Å; F161-F165 PolarHBondContact O-N 2.93Å; F165-T167 PolarHBondContact O-N 3.38Å
166	G	53.7	Low	56.1	Low	46 Å²	46	84.7 Å²	84.7	47%	0.474	48%	0.477	S	S	.	.			trans	-73.9	80.8	174	0	0	0	0	0	110.3	D162 E168	D162-G166 WeakPolarHBondContact O-CA 3.27Å; D162-G166 PolarHBondContact O-N 3.46Å; G166-E168 PolarHBondContact O-N 3.06Å
167	T	39	Very low	53.4	Low	94 Å²	94	86.3 Å²	86.3	58%	0.577	48%	0.48	S	S	*	.			trans	-57.1	109.8	157.8	49.1	0	0	0	0	108.4	F165 T169	F165-T167 PolarHBondContact O-N 3.38Å; T167-T169 PolarHBondContact O-N 2.94Å; T167-T169 VanDerWaalsContact O-N 3.16Å
168	E	37.1	Very low	50.9	Low	177 Å²	177	89.3 Å²	89.3	83%	0.827	50%	0.499	S	S	*	.			trans	0.6	104	146.5	-71	-81.4	165.5	0	0	112.3	G166 P170	G166-E168 PolarHBondContact O-N 3.06Å; E168-P170 VanDerWaalsContact O-CD 3.27Å; E168-P170 WeakPolarHBondContact O-CD 3.43Å; E168-P170 VanDerWaalsContact O-N 3.1Å
169	T	36.2	Very low	48.6	Very low	77 Å²	77	93.9 Å²	93.9	47%	0.472	53%	0.532	S	S	.	.			trans	-29.7	109.8	179.7	54.2	0	0	0	0	114.3	T167 V171 S172	T167-T169 PolarHBondContact O-N 2.94Å; T167-T169 VanDerWaalsContact O-N 3.16Å; T169-V171 PolarHBondContact O-N 3.2Å; T169-S172 PolarHBondContact OG1-OG 3.33Å
170	P	30.7	Very low	45.9	Very low	36 Å²	36	96.8 Å²	96.8	23%	0.234	54%	0.543	C	S	.	.	H	α-helix	trans	-67	-14.4	161.3	-15.2	29.4	0	0	0	110.7	E168 L174 L236	E168-P170 VanDerWaalsContact O-CD 3.27Å; E168-P170 WeakPolarHBondContact O-CD 3.43Å; E168-P170 VanDerWaalsContact O-N 3.1Å; P170-L174 HydrophobicContact CB-CD1 3.55Å; P170-L174 HydrophobicContact CB-CG 4.32Å; P170-L174 WeakPolarHBondContact O-CA 3.33Å; P170-L174 WeakPolarHBondContact O-CB 3.25Å; P170-L174 WeakPolarHBondContact O-CD1 3.46Å; P170-L174 WeakPolarHBondContact O-CG 3.48Å; P170-L174 PolarHBondContact O-N 3.29Å; P170-L236 HydrophobicContact CG-CD1 4.48Å
171	V	36.5	Very low	43.3	Very low	99 Å²	99	93.4 Å²	93.4	60%	0.6	54%	0.543	S	S	*	.	H	α-helix	trans	-74.1	-32	-173.5	-176.1	0	0	0	0	112.5	T169 A175	T169-V171 PolarHBondContact O-N 3.2Å; V171-A175 WeakPolarHBondContact O-CB 3.31Å
172	S	31.8	Very low	41.1	Very low	70 Å²	70	97.4 Å²	97.4	49%	0.49	57%	0.573	S	S	.	*	H	α-helix	trans	-86.4	-33.8	175.5	67.1	0	0	0	0	112.6	T169 S176	T169-S172 PolarHBondContact OG1-OG 3.33Å; S172-S176 PolarHBondContact O-N 2.86Å
173	V	32.9	Very low	39.1	Very low	79 Å²	79	102.6 Å²	102.6	48%	0.479	60%	0.599	S	S	.	*	H	α-helix	trans	-82	-31.3	179.9	-179.4	0	0	0	0	112.5	S176 T177	V173-S176 PolarHBondContact O-N 3.08Å; V173-S176 PolarHBondContact O-OG 2.95Å; V173-T177 HydrophobicContact CG1-CG2 4.09Å; V173-T177 WeakPolarHBondContact O-CB 3.32Å; V173-T177 VanDerWaalsContact O-CG2 3.32Å; V173-T177 WeakPolarHBondContact O-CG2 3.42Å; V173-T177 PolarHBondContact O-N 3.41Å; V173-T177 PolarHBondContact O-OG1 2.71Å
174	L	31.6	Very low	36.8	Very low	91 Å²	91	103.8 Å²	103.8	48%	0.476	61%	0.605	S	S	.	*	H	α-helix	trans	-78	-25.8	174.1	-70.3	161.5	0	0	0	112.9	P170 S176 T177 N178	P170-L174 HydrophobicContact CB-CD1 3.55Å; P170-L174 HydrophobicContact CB-CG 4.32Å; P170-L174 WeakPolarHBondContact O-CA 3.33Å; P170-L174 WeakPolarHBondContact O-CB 3.25Å; P170-L174 WeakPolarHBondContact O-CD1 3.46Å; P170-L174 WeakPolarHBondContact O-CG 3.48Å; P170-L174 PolarHBondContact O-N 3.29Å; L174-S176 VanDerWaalsContact C-N 3.29Å; L174-T177 WeakPolarHBondContact CA-OG1 3.04Å; L174-N178 PolarHBondContact O-N 3.16Å
175	A	36.7	Very low	34.6	Very low	73 Å²	73	109 Å²	109	60%	0.603	62%	0.623	S	S	*	*	H	α-helix	trans	-68.5	-29	168.8	0	0	0	0	0	112	V171	V171-A175 WeakPolarHBondContact O-CB 3.31Å
176	S	31.7	Very low	33	Very low	76 Å²	76	111.9 Å²	111.9	53%	0.531	64%	0.639	S	S	.	*	H	α-helix	trans	-91.4	-27.8	177.6	72.6	0	0	0	0	114.2	S172 V173 L174	S172-S176 PolarHBondContact O-N 2.86Å; V173-S176 PolarHBondContact O-N 3.08Å; V173-S176 PolarHBondContact O-OG 2.95Å; L174-S176 VanDerWaalsContact C-N 3.29Å
177	T	34	Very low	31.9	Very low	72 Å²	72	117.4 Å²	117.4	44%	0.442	66%	0.656	S	S	.	*	H	α-helix	trans	-86.9	-18	-175.9	47	0	0	0	0	114.7	V173 L174 S179	V173-T177 HydrophobicContact CG1-CG2 4.09Å; V173-T177 WeakPolarHBondContact O-CB 3.32Å; V173-T177 VanDerWaalsContact O-CG2 3.32Å; V173-T177 WeakPolarHBondContact O-CG2 3.42Å; V173-T177 PolarHBondContact O-N 3.41Å; V173-T177 PolarHBondContact O-OG1 2.71Å; L174-T177 WeakPolarHBondContact CA-OG1 3.04Å; T177-S179 VanDerWaalsContact C-N 3.32Å
178	N	34.1	Very low	31.3	Very low	149 Å²	149	117.1 Å²	117.1	80%	0.797	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	5.3	176.6	-137	13.9	0	0	0	114.2	L174	L174-N178 PolarHBondContact O-N 3.16Å
179	S	33.6	Very low	30.8	Very low	102 Å²	102	115.3 Å²	115.3	71%	0.713	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	9.7	174	-67.1	0	0	0	0	113.8	T177 G181	T177-S179 VanDerWaalsContact C-N 3.32Å; S179-G181 VanDerWaalsContact C-N 3.34Å; S179-G181 PolarHBondContact O-N 2.88Å
180	R	27.9	Very low	30.4	Very low	239 Å²	239	117 Å²	117	90%	0.902	68%	0.675	S	S	*	*			trans	-96.2	62.1	169.5	-68.8	-173.7	-166.5	168.7	5.2	110.4
181	G	28.9	Very low	30.2	Very low	52 Å²	52	123.6 Å²	123.6	54%	0.536	70%	0.7	S	S	.	*	S	Bend	trans	-130.3	105.5	172.1	0	0	0	0	0	109	S179 I183	S179-G181 VanDerWaalsContact C-N 3.34Å; S179-G181 PolarHBondContact O-N 2.88Å; G181-I183 PolarHBondContact O-N 2.83Å
182	T	26.4	Very low	29.8	Very low	149 Å²	149	128.2 Å²	128.2	91%	0.914	71%	0.707	S	S	*	*			trans	-18	110.2	172.8	-34.1	0	0	0	0	115.7
183	I	28.2	Very low	29.7	Very low	153 Å²	153	133 Å²	133	79%	0.785	72%	0.722	S	S	*	*			trans	-115.6	131.8	163	-60.7	179	0	0	0	107.9	G181	G181-I183 PolarHBondContact O-N 2.83Å
184	P	27	Very low	29.2	Very low	120 Å²	120	135.4 Å²	135.4	78%	0.779	74%	0.737	S	S	*	*			trans	-65.7	143	-175.9	-13.9	28.1	0	0	0	112.3	E186	P184-E186 PolarHBondContact O-N 3.04Å
185	K	27.2	Very low	29.3	Very low	206 Å²	206	137.8 Å²	137.8	90%	0.896	76%	0.756	S	S	*	*			trans	-63.3	114.5	165.6	-72.2	174.2	174.1	175.9	0	109.1
186	E	28.2	Very low	28.9	Very low	190 Å²	190	140.1 Å²	140.1	89%	0.888	77%	0.767	S	S	*	*			trans	174.8	115.2	145.1	-103	176.8	-163.6	0	0	107.9	P184	P184-E186 PolarHBondContact O-N 3.04Å
187	L	29.5	Very low	28.8	Very low	161 Å²	161	140 Å²	140	84%	0.843	78%	0.779	S	S	*	*				172.8	89.6	125.8	-156.1	61.8	0	0	0	110
188	S	28.1	Very low	28.7	Very low	88 Å²	88	141 Å²	141	62%	0.615	79%	0.794	S	S	*	*			trans	29.9	107.5	139.1	57.2	0	0	0	0	120.5
189	T	25.1	Very low	28.4	Very low	140 Å²	140	143.5 Å²	143.5	86%	0.859	80%	0.801	S	S	*	*				37.5	116.8	118.8	55.9	0	0	0	0	119.8
190	S	28.9	Very low	28.1	Very low	112 Å²	112	142.1 Å²	142.1	78%	0.783	80%	0.803	S	S	*	*				-152	130.5	127.1	-171.6	0	0	0	0	111.6
191	K	26.4	Very low	28.2	Very low	175 Å²	175	139.9 Å²	139.9	76%	0.761	80%	0.803	S	S	*	*			trans	-58	158.2	168.9	-70.8	167.6	173.9	173.1	0	109.2
192	Y	26.7	Very low	28.1	Very low	195 Å²	195	145.8 Å²	145.8	77%	0.765	82%	0.821	S	S	*	*				-169.1	139.5	79.5	-83.7	-76.4	0	0	0	114.7
193	H	29.7	Very low	28.2	Very low	170 Å²	170	150 Å²	150	79%	0.787	82%	0.82	S	S	*	*			trans	51.6	111.1	144.8	-77.3	-57.6	0	0	0	123.9
194	T	24.1	Very low	28.4	Very low	131 Å²	131	152.7 Å²	152.7	80%	0.804	83%	0.826	S	S	*	*			trans	-70.1	136.3	149.3	-18.9	0	0	0	0	111.7
195	T	33.1	Very low	28.3	Very low	141 Å²	141	158 Å²	158	87%	0.865	83%	0.831	S	S	*	*			trans	-141	138.9	144.6	38.2	0	0	0	0	110.4
196	S	28.2	Very low	28.3	Very low	121 Å²	121	154.5 Å²	154.5	85%	0.846	83%	0.827	S	S	*	*			trans	-69.4	148.7	-173.1	47.8	0	0	0	0	115.4
197	G	30.1	Very low	28.2	Very low	75 Å²	75	154 Å²	154	77%	0.773	82%	0.824	S	S	*	*			trans	169.8	105	160.6	0	0	0	0	0	115.3
198	A	31.6	Very low	27.9	Very low	93 Å²	93	152.1 Å²	152.1	77%	0.769	82%	0.819	S	S	*	*			trans	57.1	110.3	147.4	0	0	0	0	0	121.4
199	E	27.5	Very low	27.9	Very low	201 Å²	201	153.6 Å²	153.6	94%	0.939	83%	0.825	S	S	*	*				47.5	123.7	126.9	-63	-179.7	160.8	0	0	121.1
200	G	28.1	Very low	27.8	Very low	73 Å²	73	156 Å²	156	75%	0.753	82%	0.823	S	S	*	*			trans	128.1	110.3	148.3	0	0	0	0	0	116.5
201	E	29.8	Very low	27.8	Very low	192 Å²	192	156.1 Å²	156.1	90%	0.897	82%	0.823	S	S	*	*			trans	70.3	86.8	150.7	-74	178.5	136.4	0	0	121.4	R203	E201-R203 PolarHBondContact O-N 2.92Å
202	L	26.8	Very low	27.9	Very low	176 Å²	176	153 Å²	153	92%	0.921	82%	0.823	S	S	*	*				6.6	90.2	123.4	-151.2	82	0	0	0	118.4
203	R	28.8	Very low	28	Very low	236 Å²	236	151.2 Å²	151.2	89%	0.891	83%	0.827	S	S	*	*			trans	-147.6	102.2	148.3	-153.3	171.4	-178.2	178.3	0.6	110.9	E201 R205	E201-R203 PolarHBondContact O-N 2.92Å; R203-R205 PolarHBondContact O-N 2.9Å; R203-R205 VanDerWaalsContact O-N 3.08Å
204	K	30.8	Very low	28	Very low	210 Å²	210	149.9 Å²	149.9	91%	0.913	83%	0.826	S	S	*	*			trans	-57.5	111.3	175.3	-78.2	179.5	176.5	176.7	0	109.6
205	R	24.9	Very low	28.4	Very low	233 Å²	233	148.7 Å²	148.7	88%	0.879	81%	0.814	S	S	*	*			trans	-93.5	112.1	177	-162	175.4	-170.8	170.4	1.8	107.9	R203 Q207	R203-R205 PolarHBondContact O-N 2.9Å; R203-R205 VanDerWaalsContact O-N 3.08Å; R205-Q207 PolarHBondContact O-N 3.48Å; R205-Q207 VanDerWaalsContact O-N 3.16Å
206	T	27.2	Very low	28.6	Very low	132 Å²	132	150.2 Å²	150.2	81%	0.81	81%	0.812	S	S	*	*			trans	-61.2	112.1	169.7	-57.1	0	0	0	0	108.6	T208	T206-T208 PolarHBondContact O-N 2.85Å
207	Q	25.9	Very low	29.1	Very low	179 Å²	179	150.7 Å²	150.7	84%	0.836	80%	0.803	S	S	*	*			trans	-69.7	108.6	173	-83	176.9	-19.3	0	0	109.5	R205 V209	R205-Q207 PolarHBondContact O-N 3.48Å; R205-Q207 VanDerWaalsContact O-N 3.16Å; Q207-V209 PolarHBondContact O-N 3.33Å
208	T	24.7	Very low	29.5	Very low	121 Å²	121	151.3 Å²	151.3	74%	0.742	79%	0.789	S	S	*	*			trans	-73.7	111.1	157.5	44.2	0	0	0	0	108.2	T206 F210	T206-T208 PolarHBondContact O-N 2.85Å; T208-F210 PolarHBondContact O-N 3.07Å
209	V	27.1	Very low	29.7	Very low	119 Å²	119	149.8 Å²	149.8	72%	0.721	77%	0.773	S	S	*	*			trans	-71.3	107.6	170.4	178	0	0	0	0	108.1	Q207	Q207-V209 PolarHBondContact O-N 3.33Å
210	F	23.5	Very low	30.3	Very low	191 Å²	191	142.4 Å²	142.4	84%	0.838	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-76.8	116.7	161	-109.5	-98.9	0	0	0	107.1	T208	T208-F210 PolarHBondContact O-N 3.07Å
211	C	29.7	Very low	30.8	Very low	114 Å²	114	143.7 Å²	143.7	77%	0.77	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-103.2	117.9	166	-78	0	0	0	0	108.8
212	S	27.4	Very low	31.2	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-66.4	156.4	173.2	-53.3	0	0	0	0	112.1	D214	S212-D214 PolarHBondContact O-N 3.44Å
213	D	28.5	Very low	31.6	Very low	157 Å²	157	132 Å²	132	84%	0.84	68%	0.68	S	S	*	*	S	Bend	trans	-40.5	113.6	173.6	-76.5	-48.9	0	0	0	113.3
214	D	30.4	Very low	32	Very low	143 Å²	143	129.3 Å²	129.3	77%	0.765	67%	0.67	S	S	*	*			trans	164.3	140.5	143.6	-83.5	-30.4	0	0	0	108.1	S212	S212-D214 PolarHBondContact O-N 3.44Å
215	N	33	Very low	32.2	Very low	106 Å²	106	126 Å²	126	57%	0.567	66%	0.659	S	S	*	*			trans	101.1	82.4	174.6	-50.7	-29.3	0	0	0	117.6	I217 D218	N215-I217 PolarHBondContact O-N 3.22Å; N215-D218 WeakPolarHBondContact CB-OD2 3.42Å; N215-D218 PolarHBondContact ND2-OD2 3.22Å; N215-D218 PolarHBondContact O-N 3.4Å
216	Q	36	Very low	33.2	Very low	172 Å²	172	119.7 Å²	119.7	80%	0.804	65%	0.646	S	S	*	*	H	α-helix	trans	-53.4	-13.4	157.1	-84.7	-177.4	-3.5	0	0	114.1	S219	Q216-S219 PolarHBondContact O-OG 3.36Å
217	I	39.8	Very low	33.9	Very low	131 Å²	131	116.9 Å²	116.9	67%	0.672	63%	0.629	S	S	*	*	H	α-helix	trans	-81.1	-29.7	-174.9	-62	172.8	0	0	0	112	N215 S219 V220 L221	N215-I217 PolarHBondContact O-N 3.22Å; I217-S219 PolarHBondContact O-N 3.19Å; I217-V220 PolarHBondContact O-N 3.19Å; I217-L221 PolarHBondContact O-N 3.38Å
218	D	37.4	Very low	34.7	Very low	88 Å²	88	112.4 Å²	112.4	47%	0.471	62%	0.623	S	S	.	*	H	α-helix	trans	-74.2	-30.2	-176.7	-71.3	-31	0	0	0	113.1	N215 V220 L221 C222	N215-D218 WeakPolarHBondContact CB-OD2 3.42Å; N215-D218 PolarHBondContact ND2-OD2 3.22Å; N215-D218 PolarHBondContact O-N 3.4Å; D218-V220 VanDerWaalsContact C-N 3.31Å; D218-V220 PolarHBondContact O-N 2.95Å; D218-L221 PolarHBondContact O-N 3.15Å; D218-C222 WeakPolarHBondContact O-CB 3.41Å; D218-C222 PolarHBondContact O-N 2.92Å
219	S	35.9	Very low	35.9	Very low	62 Å²	62	108.6 Å²	108.6	43%	0.434	60%	0.599	S	S	.	*	H	α-helix	trans	-64.3	-34.3	175.3	66.7	0	0	0	0	112.9	Q216 I217 L223	Q216-S219 PolarHBondContact O-OG 3.36Å; I217-S219 PolarHBondContact O-N 3.19Å; S219-L223 WeakPolarHBondContact O-CB 3.49Å; S219-L223 PolarHBondContact O-N 3.5Å
220	V	40.6	Very low	37.3	Very low	46 Å²	46	105.9 Å²	105.9	28%	0.279	59%	0.586	S	S	.	*	H	α-helix	trans	-79.2	-35	179.4	-177.5	0	0	0	0	111	I217 D218 R224	I217-V220 PolarHBondContact O-N 3.19Å; D218-V220 VanDerWaalsContact C-N 3.31Å; D218-V220 PolarHBondContact O-N 2.95Å; V220-R224 WeakPolarHBondContact O-CB 3.39Å; V220-R224 WeakPolarHBondContact O-CG 3.36Å; V220-R224 PolarHBondContact O-N 2.85Å
221	L	38.9	Very low	39.1	Very low	100 Å²	100	103.8 Å²	103.8	52%	0.524	57%	0.572	S	S	.	*	H	α-helix	trans	-69.5	-42.5	174.8	-159	78	0	0	0	111	I217 D218 L223 R224 M225	I217-L221 PolarHBondContact O-N 3.38Å; D218-L221 PolarHBondContact O-N 3.15Å; L221-L223 PolarHBondContact O-N 3.15Å; L221-R224 CarbonylContact O-C 3.59Å; L221-R224 PolarHBondContact O-N 3.44Å; L221-R224 VanDerWaalsContact O-N 3.15Å; L221-M225 WeakPolarHBondContact O-CG 3.34Å; L221-M225 PolarHBondContact O-N 3.15Å
222	C	37.4	Very low	40.5	Very low	78 Å²	78	105.9 Å²	105.9	53%	0.527	56%	0.564	S	S	.	*	H	α-helix	trans	-60.3	-44.1	172.7	-171.2	0	0	0	0	111.3	D218 R224 M225 V226	D218-C222 WeakPolarHBondContact O-CB 3.41Å; D218-C222 PolarHBondContact O-N 2.92Å; C222-R224 VanDerWaalsContact C-N 3.35Å; C222-R224 PolarHBondContact O-N 2.96Å; C222-M225 PolarHBondContact O-N 3.44Å; C222-V226 VanDerWaalsContact O-CG2 3.29Å; C222-V226 WeakPolarHBondContact O-CG2 3.22Å; C222-V226 PolarHBondContact O-N 3.18Å
223	L	36.3	Very low	41.9	Very low	45 Å²	45	106 Å²	106	24%	0.236	55%	0.548	C	S	.	.	H	α-helix	trans	-63.4	-36.9	173	-113.5	119.9	0	0	0	113.2	I98 S219 L221 V226 T227	I98-L223 HydrophobicContact CD1-CD1 4.14Å; I98-L223 HydrophobicContact CG1-CD1 3.85Å; I98-L223 HydrophobicContact CG1-CD2 4.32Å; I98-L223 HydrophobicContact CG2-CD1 4.11Å; S219-L223 WeakPolarHBondContact O-CB 3.49Å; S219-L223 PolarHBondContact O-N 3.5Å; L221-L223 PolarHBondContact O-N 3.15Å; L223-V226 PolarHBondContact O-N 3.14Å; L223-T227 WeakPolarHBondContact O-CG2 3.45Å; L223-T227 PolarHBondContact O-N 3.47Å; L223-T227 VanDerWaalsContact O-N 3.16Å; L223-T227 PolarHBondContact O-OG1 3.46Å
224	R	35.7	Very low	43.6	Very low	179 Å²	179	99 Å²	99	68%	0.675	51%	0.511	S	S	*	.	H	α-helix	trans	-69.3	-35.5	175.3	-85.7	-174.8	168.5	-177	-3.1	112.3	V220 L221 C222 T227 A228	V220-R224 WeakPolarHBondContact O-CB 3.39Å; V220-R224 WeakPolarHBondContact O-CG 3.36Å; V220-R224 PolarHBondContact O-N 2.85Å; L221-R224 CarbonylContact O-C 3.59Å; L221-R224 PolarHBondContact O-N 3.44Å; L221-R224 VanDerWaalsContact O-N 3.15Å; C222-R224 VanDerWaalsContact C-N 3.35Å; C222-R224 PolarHBondContact O-N 2.96Å; R224-T227 WeakPolarHBondContact CA-OG1 3.43Å; R224-T227 PolarHBondContact O-N 3.17Å; R224-T227 PolarHBondContact O-OG1 3.41Å; R224-A228 PolarHBondContact O-N 3.28Å
225	M	36.1	Very low	45.4	Very low	140 Å²	140	97.1 Å²	97.1	69%	0.69	50%	0.496	S	S	*	.	H	α-helix	trans	-68.6	-36.2	173.6	-71.5	180	78.3	0	0	111.7	L221 C222 T227 A228	L221-M225 WeakPolarHBondContact O-CG 3.34Å; L221-M225 PolarHBondContact O-N 3.15Å; C222-M225 PolarHBondContact O-N 3.44Å; M225-T227 VanDerWaalsContact C-N 3.27Å; M225-T227 PolarHBondContact O-N 3.08Å; M225-A228 PolarHBondContact O-N 2.99Å
226	V	46.8	Very low	46.9	Very low	100 Å²	100	95.3 Å²	95.3	61%	0.606	49%	0.486	S	S	*	.	H	α-helix	trans	-65.7	-28.9	172.5	172.9	0	0	0	0	111.9	C222 L223 T229	C222-V226 VanDerWaalsContact O-CG2 3.29Å; C222-V226 WeakPolarHBondContact O-CG2 3.22Å; C222-V226 PolarHBondContact O-N 3.18Å; L223-V226 PolarHBondContact O-N 3.14Å; V226-T229 PolarHBondContact O-OG1 2.89Å
227	T	41.8	Very low	48.2	Very low	73 Å²	73	89.2 Å²	89.2	45%	0.448	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.6	176.3	53.4	0	0	0	0	115.2	L223 R224 M225 T229	L223-T227 WeakPolarHBondContact O-CG2 3.45Å; L223-T227 PolarHBondContact O-N 3.47Å; L223-T227 VanDerWaalsContact O-N 3.16Å; L223-T227 PolarHBondContact O-OG1 3.46Å; R224-T227 WeakPolarHBondContact CA-OG1 3.43Å; R224-T227 PolarHBondContact O-N 3.17Å; R224-T227 PolarHBondContact O-OG1 3.41Å; M225-T227 VanDerWaalsContact C-N 3.27Å; M225-T227 PolarHBondContact O-N 3.08Å; T227-T229 VanDerWaalsContact C-N 3.31Å; T227-T229 PolarHBondContact O-N 3.37Å
228	A	40.8	Very low	49.8	Very low	85 Å²	85	84.1 Å²	84.1	70%	0.702	43%	0.433	S	S	*	.			trans	-93.8	28.6	-178.2	0	0	0	0	0	113.2	R224 M225	R224-A228 PolarHBondContact O-N 3.28Å; M225-A228 PolarHBondContact O-N 2.99Å
229	T	50	Low	51.6	Low	41 Å²	41	82.5 Å²	82.5	25%	0.252	43%	0.426	S	S	.	.			trans	-86.6	122.2	179	-17.7	0	0	0	0	111.2	V226 T227 R233 F295	V226-T229 PolarHBondContact O-OG1 2.89Å; T227-T229 VanDerWaalsContact C-N 3.31Å; T227-T229 PolarHBondContact O-N 3.37Å; T229-R233 HydrophobicContact CG2-CB 3.92Å; T229-R233 HydrophobicContact CG2-CG 4.22Å; T229-F295 WeakPolarHBondContact O-CE1 3.21Å
230	S	56.8	Low	53.1	Low	63 Å²	63	81 Å²	81	44%	0.441	42%	0.418	S	S	.	.			trans	-56.6	144.7	-175.5	-173.4	0	0	0	0	112	R232 R233	S230-R232 PolarHBondContact O-N 3.16Å; S230-R233 PolarHBondContact O-N 3.38Å
231	W	62.6	Low	54.7	Low	146 Å²	146	79.4 Å²	79.4	55%	0.553	41%	0.408	S	S	*	.	H	α-helix	trans	-36.9	-33.3	165.4	138.8	-90.4	0	0	0	113.1	R233 I234 F235 Y297	W231-R233 PolarHBondContact O-N 3.27Å; W231-I234 PolarHBondContact O-N 2.93Å; W231-F235 HydrophobicContact CH2-CD2 4.05Å; W231-F235 HydrophobicContact CZ2-CB 4.44Å; W231-F235 AromaticContact CZ2-CD2 3.92Å; W231-F235 HydrophobicContact CZ2-CD2 3.92Å; W231-F235 HydrophobicContact CZ2-CG 4.34Å; W231-F235 VanDerWaalsContact O-CB 3.3Å; W231-F235 WeakPolarHBondContact O-CB 3.27Å; W231-F235 PolarHBondContact O-N 3.46Å; W231-Y297 VanDerWaalsContact CE3-OH 3.24Å; W231-Y297 VanDerWaalsContact CZ3-OH 3.23Å; W231-Y297 WeakPolarHBondContact CZ3-OH 3.5Å
232	R	58	Low	56.9	Low	159 Å²	159	76.5 Å²	76.5	60%	0.6	39%	0.394	S	S	*	.	H	α-helix	trans	-53.8	-42.2	173.8	-67.6	-176.8	175.5	179.3	-1.6	114	S230 F235 L236	S230-R232 PolarHBondContact O-N 3.16Å; R232-F235 PolarHBondContact O-N 3.4Å; R232-L236 WeakPolarHBondContact O-CB 3.36Å; R232-L236 WeakPolarHBondContact O-CG 2.93Å; R232-L236 PolarHBondContact O-N 2.95Å
233	R	56.8	Low	58.8	Low	112 Å²	112	74.6 Å²	74.6	42%	0.423	38%	0.38	S	S	.	.	H	α-helix	trans	-69.3	-40.8	-179.1	-172.8	-179.6	-178.7	177.9	1.8	111.9	T229 S230 W231 L236 L237	T229-R233 HydrophobicContact CG2-CB 3.92Å; T229-R233 HydrophobicContact CG2-CG 4.22Å; S230-R233 PolarHBondContact O-N 3.38Å; W231-R233 PolarHBondContact O-N 3.27Å; R233-L236 PolarHBondContact O-N 3.24Å; R233-L237 WeakPolarHBondContact O-CB 3.42Å; R233-L237 PolarHBondContact O-N 3.26Å
234	I	64	Low	60.6	Low	11 Å²	11	73.2 Å²	73.2	6%	0.056	37%	0.372	C	S	.	.	H	α-helix	trans	-67.5	-43.5	177.7	-51.7	160.6	0	0	0	109.7	W231 L237 V238 L292 F295	W231-I234 PolarHBondContact O-N 2.93Å; I234-L237 WeakPolarHBondContact O-CB 3.32Å; I234-L237 PolarHBondContact O-N 3.46Å; I234-V238 HydrophobicContact CG2-CG2 4.42Å; I234-V238 VanDerWaalsContact O-CG2 3.27Å; I234-V238 WeakPolarHBondContact O-CG2 3.14Å; I234-V238 PolarHBondContact O-N 3.01Å; I234-L292 HydrophobicContact CG2-CD2 3.44Å; I234-L292 VanDerWaalsContact CG2-CD2 3.44Å; I234-L292 HydrophobicContact CG2-CG 3.82Å; I234-F295 HydrophobicContact CD1-CB 3.76Å; I234-F295 HydrophobicContact CD1-CD1 3.75Å; I234-F295 HydrophobicContact CD1-CD2 3.06Å; I234-F295 HydrophobicContact CD1-CE1 4.07Å; I234-F295 HydrophobicContact CD1-CE2 3.47Å; I234-F295 VanDerWaalsContact CD1-CE2 3.47Å; I234-F295 HydrophobicContact CD1-CG 3.24Å; I234-F295 HydrophobicContact CD1-CZ 3.95Å; I234-F295 HydrophobicContact CG1-CD2 3.49Å; I234-F295 VanDerWaalsContact CG1-CD2 3.49Å; I234-F295 HydrophobicContact CG1-CE2 3.41Å; I234-F295 VanDerWaalsContact CG1-CE2 3.41Å; I234-F295 HydrophobicContact CG1-CG 4.17Å; I234-F295 HydrophobicContact CG1-CZ 3.99Å
235	F	68.7	Low	63	Low	103 Å²	103	64.7 Å²	64.7	45%	0.452	34%	0.34	S	S	.	.	H	α-helix	trans	-59.3	-47.8	175.5	179.4	-98.6	0	0	0	111.4	W231 R232 L237 V238 V239	W231-F235 HydrophobicContact CH2-CD2 4.05Å; W231-F235 HydrophobicContact CZ2-CB 4.44Å; W231-F235 AromaticContact CZ2-CD2 3.92Å; W231-F235 HydrophobicContact CZ2-CD2 3.92Å; W231-F235 HydrophobicContact CZ2-CG 4.34Å; W231-F235 VanDerWaalsContact O-CB 3.3Å; W231-F235 WeakPolarHBondContact O-CB 3.27Å; W231-F235 PolarHBondContact O-N 3.46Å; R232-F235 PolarHBondContact O-N 3.4Å; F235-L237 VanDerWaalsContact C-N 3.34Å; F235-L237 PolarHBondContact O-N 3.16Å; F235-V238 PolarHBondContact O-N 3.16Å; F235-V239 HydrophobicContact CD1-CG2 4.26Å; F235-V239 HydrophobicContact CE1-CG2 3.85Å; F235-V239 HydrophobicContact CE2-CG2 4.15Å; F235-V239 HydrophobicContact CZ-CG2 3.79Å; F235-V239 WeakPolarHBondContact O-CB 3.32Å; F235-V239 VanDerWaalsContact O-CG2 3.29Å; F235-V239 WeakPolarHBondContact O-CG2 3.47Å; F235-V239 PolarHBondContact O-N 2.97Å
236	L	63.9	Low	65.3	Low	68 Å²	68	61.5 Å²	61.5	36%	0.356	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-40.8	175.6	-73.7	170.7	0	0	0	112.2	P170 R232 R233 V239 A240	P170-L236 HydrophobicContact CG-CD1 4.48Å; R232-L236 WeakPolarHBondContact O-CB 3.36Å; R232-L236 WeakPolarHBondContact O-CG 2.93Å; R232-L236 PolarHBondContact O-N 2.95Å; R233-L236 PolarHBondContact O-N 3.24Å; L236-V239 PolarHBondContact O-N 2.94Å; L236-A240 VanDerWaalsContact O-CB 3.32Å; L236-A240 WeakPolarHBondContact O-CB 3.17Å; L236-A240 PolarHBondContact O-N 2.95Å
237	L	63.6	Low	67	Low	44 Å²	44	57.3 Å²	57.3	23%	0.23	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-45.8	175.5	-179.6	70.7	0	0	0	112	R233 I234 F235 V239 A240 I241 P291	R233-L237 WeakPolarHBondContact O-CB 3.42Å; R233-L237 PolarHBondContact O-N 3.26Å; I234-L237 WeakPolarHBondContact O-CB 3.32Å; I234-L237 PolarHBondContact O-N 3.46Å; F235-L237 VanDerWaalsContact C-N 3.34Å; F235-L237 PolarHBondContact O-N 3.16Å; L237-V239 VanDerWaalsContact C-N 3.34Å; L237-A240 PolarHBondContact O-N 3.25Å; L237-I241 HydrophobicContact CD1-CD1 3.91Å; L237-I241 HydrophobicContact CD1-CG1 4.47Å; L237-I241 HydrophobicContact CG-CD1 3.93Å; L237-I241 WeakPolarHBondContact O-CG1 3.38Å; L237-I241 PolarHBondContact O-N 3.38Å; L237-P291 HydrophobicContact CD2-CG 4.4Å
238	V	73.2	Confident	69.1	Low	23 Å²	23	53.8 Å²	53.8	14%	0.139	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-42.8	177.9	173.8	0	0	0	0	110.6	I234 F235 T242 V288 L292	I234-V238 HydrophobicContact CG2-CG2 4.42Å; I234-V238 VanDerWaalsContact O-CG2 3.27Å; I234-V238 WeakPolarHBondContact O-CG2 3.14Å; I234-V238 PolarHBondContact O-N 3.01Å; F235-V238 PolarHBondContact O-N 3.16Å; V238-T242 WeakPolarHBondContact O-CB 3.33Å; V238-T242 PolarHBondContact O-N 3.07Å; V238-T242 PolarHBondContact O-OG1 3.04Å; V238-V288 HydrophobicContact CG2-CG1 3.93Å; V238-L292 HydrophobicContact CG2-CD1 4.26Å
239	V	75.3	Confident	71.5	Confident	54 Å²	54	49.8 Å²	49.8	33%	0.327	25%	0.245	S	C	.	.	H	α-helix	trans	-63.8	-46.8	177	170.8	0	0	0	0	110.9	F235 L236 L237 T242 V243	F235-V239 HydrophobicContact CD1-CG2 4.26Å; F235-V239 HydrophobicContact CE1-CG2 3.85Å; F235-V239 HydrophobicContact CE2-CG2 4.15Å; F235-V239 HydrophobicContact CZ-CG2 3.79Å; F235-V239 WeakPolarHBondContact O-CB 3.32Å; F235-V239 VanDerWaalsContact O-CG2 3.29Å; F235-V239 WeakPolarHBondContact O-CG2 3.47Å; F235-V239 PolarHBondContact O-N 2.97Å; L236-V239 PolarHBondContact O-N 2.94Å; L237-V239 VanDerWaalsContact C-N 3.34Å; V239-T242 WeakPolarHBondContact O-CB 3.42Å; V239-T242 PolarHBondContact O-N 3.41Å; V239-V243 WeakPolarHBondContact O-CG2 3.48Å; V239-V243 PolarHBondContact O-N 3.03Å
240	A	67	Low	73.3	Confident	32 Å²	32	49.7 Å²	49.7	26%	0.264	24%	0.243	S	C	.	.	H	α-helix	trans	-57.2	-52.8	177.8	0	0	0	0	0	111.5	L236 L237 T242 V243 H244	L236-A240 VanDerWaalsContact O-CB 3.32Å; L236-A240 WeakPolarHBondContact O-CB 3.17Å; L236-A240 PolarHBondContact O-N 2.95Å; L237-A240 PolarHBondContact O-N 3.25Å; A240-T242 VanDerWaalsContact C-N 3.27Å; A240-T242 PolarHBondContact O-N 2.78Å; A240-V243 PolarHBondContact O-N 2.78Å; A240-H244 PolarHBondContact O-CD2 3.34Å; A240-H244 PolarHBondContact O-N 3.37Å
241	I	76	Confident	74.7	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.062	22%	0.222	C	C	.	.	H	α-helix	trans	-61.6	-37.1	178.5	-66	169.9	0	0	0	111.1	L237 V243 H244 N245 E284 A287 V288	L237-I241 HydrophobicContact CD1-CD1 3.91Å; L237-I241 HydrophobicContact CD1-CG1 4.47Å; L237-I241 HydrophobicContact CG-CD1 3.93Å; L237-I241 WeakPolarHBondContact O-CG1 3.38Å; L237-I241 PolarHBondContact O-N 3.38Å; I241-V243 PolarHBondContact O-N 3.01Å; I241-H244 PolarHBondContact O-N 3.43Å; I241-N245 PolarHBondContact O-N 2.91Å; I241-N245 PolarHBondContact O-ND2 3.26Å; I241-E284 HydrophobicContact CG2-CB 4.48Å; I241-A287 HydrophobicContact CD1-CB 4.25Å; I241-V288 HydrophobicContact CB-CG2 4.07Å; I241-V288 HydrophobicContact CD1-CG2 3.44Å; I241-V288 VanDerWaalsContact CD1-CG2 3.44Å; I241-V288 HydrophobicContact CG1-CG2 4.33Å; I241-V288 HydrophobicContact CG2-CG2 3.78Å
242	T	83.8	Confident	76.1	Confident	38 Å²	38	39.8 Å²	39.8	23%	0.233	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-41.1	175.5	-55.8	0	0	0	0	111.6	V238 V239 A240 H244 N245 S309 V312	V238-T242 WeakPolarHBondContact O-CB 3.33Å; V238-T242 PolarHBondContact O-N 3.07Å; V238-T242 PolarHBondContact O-OG1 3.04Å; V239-T242 WeakPolarHBondContact O-CB 3.42Å; V239-T242 PolarHBondContact O-N 3.41Å; A240-T242 VanDerWaalsContact C-N 3.27Å; A240-T242 PolarHBondContact O-N 2.78Å; T242-H244 VanDerWaalsContact C-N 3.34Å; T242-N245 PolarHBondContact O-N 3.25Å; T242-S309 WeakPolarHBondContact OG1-CB 3.42Å; T242-V312 HydrophobicContact CG2-CG1 3.81Å; T242-V312 HydrophobicContact CG2-CG2 4.47Å; T242-V312 WeakPolarHBondContact O-CG2 3.36Å
243	V	77.5	Confident	77.6	Confident	38 Å²	38	32.2 Å²	32.2	23%	0.23	17%	0.167	C	C	.	.	H	α-helix	trans	-67.5	-36.4	176.9	172.9	0	0	0	0	111.1	V239 A240 I241 N245 I246 P247	V239-V243 WeakPolarHBondContact O-CG2 3.48Å; V239-V243 PolarHBondContact O-N 3.03Å; A240-V243 PolarHBondContact O-N 2.78Å; I241-V243 PolarHBondContact O-N 3.01Å; V243-N245 VanDerWaalsContact C-N 3.3Å; V243-N245 PolarHBondContact O-N 3.45Å; V243-I246 WeakPolarHBondContact O-CB 3.39Å; V243-I246 PolarHBondContact O-N 3.48Å; V243-I246 VanDerWaalsContact O-N 3.13Å; V243-P247 WeakPolarHBondContact O-CD 3.18Å
244	H	75	Confident	79.1	Confident	17 Å²	17	27 Å²	27	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-32.1	177.7	-63.9	169.1	0	0	0	113.9	A240 I241 T242 I246 P247 V345 D349	A240-H244 PolarHBondContact O-CD2 3.34Å; A240-H244 PolarHBondContact O-N 3.37Å; I241-H244 PolarHBondContact O-N 3.43Å; T242-H244 VanDerWaalsContact C-N 3.34Å; H244-I246 PolarHBondContact O-N 2.74Å; H244-P247 VanDerWaalsContact O-CD 3.27Å; H244-P247 WeakPolarHBondContact O-CD 3.49Å; H244-V345 HydrophobicContact CB-CG1 4.05Å; H244-V345 VanDerWaalsContact CD2-CG1 3.47Å; H244-V345 WeakPolarHBondContact CD2-CG1 3.4Å; H244-V345 VanDerWaalsContact CG-CG1 3.48Å; H244-D349 IonicContact CD2-OD2 3.66Å; H244-D349 VanDerWaalsContact CE1-CB 3.42Å; H244-D349 WeakPolarHBondContact CE1-CB 3.21Å; H244-D349 IonicContact CE1-OD2 3Å; H244-D349 PolarHBondContact CE1-OD2 3.25Å; H244-D349 IonicContact NE2-OD2 2.83Å; H244-D349 PolarHBondContact NE2-OD2 2.98Å
245	N	86.2	Confident	80.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.2	-15	176	-81.5	-69.7	0	0	0	113.3	I241 T242 V243 G249 S309 V312 E313	I241-N245 PolarHBondContact O-N 2.91Å; I241-N245 PolarHBondContact O-ND2 3.26Å; T242-N245 PolarHBondContact O-N 3.25Å; V243-N245 VanDerWaalsContact C-N 3.3Å; V243-N245 PolarHBondContact O-N 3.45Å; N245-G249 PolarHBondContact O-N 3.18Å; N245-G249 VanDerWaalsContact O-N 3.07Å; N245-S309 PolarHBondContact ND2-O 2.88Å; N245-V312 HydrophobicContact CB-CG2 3.31Å; N245-E313 HydrophobicContact CB-CG 3.82Å; N245-E313 WeakPolarHBondContact OD1-CG 3.36Å; N245-E313 PolarHBondContact OD1-OE1 3.49Å
246	I	83.8	Confident	81.1	Confident	73 Å²	73	21.9 Å²	21.9	37%	0.374	13%	0.125	S	C	.	.	H	α-helix	trans	-70.7	-56	178	-61.8	171.3	0	0	0	111.3	V243 H244 E248 G249 L250 V312 A316	V243-I246 WeakPolarHBondContact O-CB 3.39Å; V243-I246 PolarHBondContact O-N 3.48Å; V243-I246 VanDerWaalsContact O-N 3.13Å; H244-I246 PolarHBondContact O-N 2.74Å; I246-E248 PolarHBondContact O-N 3.28Å; I246-G249 PolarHBondContact O-N 3.32Å; I246-L250 WeakPolarHBondContact O-CB 3.49Å; I246-L250 PolarHBondContact O-N 2.91Å; I246-V312 HydrophobicContact CG1-CB 4.24Å; I246-V312 HydrophobicContact CG1-CG2 4.02Å; I246-A316 HydrophobicContact CG2-CB 4.2Å; I246-A316 WeakPolarHBondContact O-CB 3.36Å
247	P	82.3	Confident	82.1	Confident	11 Å²	11	18.7 Å²	18.7	7%	0.071	11%	0.108	C	C	.	.	H	α-helix	trans	-50.9	-39.2	172.4	-30.1	31.9	0	0	0	114.4	L158 V243 H244 L250 A251 A341	L158-P247 HydrophobicContact CD1-CG 4.08Å; L158-P247 HydrophobicContact CD2-CG 4.28Å; V243-P247 WeakPolarHBondContact O-CD 3.18Å; H244-P247 VanDerWaalsContact O-CD 3.27Å; H244-P247 WeakPolarHBondContact O-CD 3.49Å; P247-L250 PolarHBondContact O-N 3.47Å; P247-A251 WeakPolarHBondContact O-CB 3.36Å; P247-A251 PolarHBondContact O-N 3.14Å; P247-A341 HydrophobicContact CB-CB 4.09Å; P247-A341 HydrophobicContact CG-CB 4.17Å
248	E	86.1	Confident	82.9	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-68.9	-48.2	-179.2	-65.9	179.7	-174.9	0	0	112.4	I246 L250 A251 V252 I277 Q280 N281	I246-E248 PolarHBondContact O-N 3.28Å; E248-L250 VanDerWaalsContact C-N 3.27Å; E248-L250 PolarHBondContact O-N 2.68Å; E248-A251 WeakPolarHBondContact O-CB 3.4Å; E248-A251 PolarHBondContact O-N 3.48Å; E248-A251 VanDerWaalsContact O-N 3.16Å; E248-V252 WeakPolarHBondContact O-CG2 3.44Å; E248-V252 PolarHBondContact O-N 3.23Å; E248-I277 HydrophobicContact CB-CG2 4.03Å; E248-I277 HydrophobicContact CG-CG2 4.46Å; E248-Q280 PolarHBondContact OE1-NE2 3.44Å; E248-N281 PolarHBondContact OE2-OD1 3.42Å
249	G	90.2	Very high	83.2	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.3	-46.5	172.5	0	0	0	0	0	110.7	N245 I246 A251 V252 G253 E313 A317	N245-G249 PolarHBondContact O-N 3.18Å; N245-G249 VanDerWaalsContact O-N 3.07Å; I246-G249 PolarHBondContact O-N 3.32Å; G249-A251 VanDerWaalsContact C-N 3.33Å; G249-A251 PolarHBondContact O-N 2.81Å; G249-V252 PolarHBondContact O-N 3.45Å; G249-G253 PolarHBondContact O-N 3.5Å; G249-E313 WeakPolarHBondContact CA-O 3.39Å; G249-A317 WeakPolarHBondContact O-CA 3.11Å; G249-A317 WeakPolarHBondContact O-CB 3.43Å; G249-A317 PolarHBondContact O-N 2.87Å
250	L	88.3	Confident	83	Confident	40 Å²	40	17.6 Å²	17.6	21%	0.209	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-40.8	177.6	-159.1	147	0	0	0	111.7	I246 P247 E248 G253 V254 A338	I246-L250 WeakPolarHBondContact O-CB 3.49Å; I246-L250 PolarHBondContact O-N 2.91Å; P247-L250 PolarHBondContact O-N 3.47Å; E248-L250 VanDerWaalsContact C-N 3.27Å; E248-L250 PolarHBondContact O-N 2.68Å; L250-G253 PolarHBondContact O-N 2.82Å; L250-V254 HydrophobicContact CD2-CG2 3.65Å; L250-V254 HydrophobicContact CG-CG2 4.43Å; L250-V254 WeakPolarHBondContact O-CB 3.28Å; L250-V254 VanDerWaalsContact O-CG2 3.23Å; L250-V254 WeakPolarHBondContact O-CG2 3.29Å; L250-V254 PolarHBondContact O-N 2.88Å; L250-A338 HydrophobicContact CD2-CB 4.16Å
251	A	87.1	Confident	83.2	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.7	-46.8	175	0	0	0	0	0	112.4	L127 P247 E248 G249 G253 G255 L273 I277 A338 M342	L127-A251 HydrophobicContact CD1-CB 4.02Å; L127-A251 HydrophobicContact CD2-CB 4.24Å; P247-A251 WeakPolarHBondContact O-CB 3.36Å; P247-A251 PolarHBondContact O-N 3.14Å; E248-A251 WeakPolarHBondContact O-CB 3.4Å; E248-A251 PolarHBondContact O-N 3.48Å; E248-A251 VanDerWaalsContact O-N 3.16Å; G249-A251 VanDerWaalsContact C-N 3.33Å; G249-A251 PolarHBondContact O-N 2.81Å; A251-G253 VanDerWaalsContact C-N 3.31Å; A251-G253 PolarHBondContact O-N 3.07Å; A251-G255 PolarHBondContact O-N 3.41Å; A251-L273 HydrophobicContact CB-CD2 4.45Å; A251-L273 WeakPolarHBondContact O-CD2 3.47Å; A251-I277 HydrophobicContact CB-CD1 4.07Å; A251-A338 HydrophobicContact CB-CB 4.2Å; A251-M342 HydrophobicContact CB-CE 3.92Å
252	V	90.6	Very high	82.4	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.9	-44.1	174.3	176.4	0	0	0	0	110.7	T68 E248 G249 G255 F256 A274 I277	T68-V252 HydrophobicContact CG2-CG2 4.13Å; E248-V252 WeakPolarHBondContact O-CG2 3.44Å; E248-V252 PolarHBondContact O-N 3.23Å; G249-V252 PolarHBondContact O-N 3.45Å; V252-G255 PolarHBondContact O-N 2.95Å; V252-F256 HydrophobicContact CG1-CD2 3.78Å; V252-F256 HydrophobicContact CG1-CE2 3.95Å; V252-F256 WeakPolarHBondContact O-CD2 3.41Å; V252-F256 PolarHBondContact O-N 3.39Å; V252-A274 HydrophobicContact CG1-CB 4.4Å; V252-I277 HydrophobicContact CG2-CB 4.45Å; V252-I277 HydrophobicContact CG2-CD1 3.53Å; V252-I277 HydrophobicContact CG2-CG2 4.4Å
253	G	90.1	Very high	81.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-52.3	178.7	0	0	0	0	0	113.6	G249 L250 A251 G255 G257 A317 A321	G249-G253 PolarHBondContact O-N 3.5Å; L250-G253 PolarHBondContact O-N 2.82Å; A251-G253 VanDerWaalsContact C-N 3.31Å; A251-G253 PolarHBondContact O-N 3.07Å; G253-G255 VanDerWaalsContact C-N 3.33Å; G253-G257 PolarHBondContact O-N 3.35Å; G253-A317 WeakPolarHBondContact CA-O 3.48Å; G253-A321 WeakPolarHBondContact O-CA 3.34Å
254	V	87.9	Confident	80.6	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-41.3	177.6	171.6	0	0	0	0	110.5	L250 G257 A258 V324 L335	L250-V254 HydrophobicContact CD2-CG2 3.65Å; L250-V254 HydrophobicContact CG-CG2 4.43Å; L250-V254 WeakPolarHBondContact O-CB 3.28Å; L250-V254 VanDerWaalsContact O-CG2 3.23Å; L250-V254 WeakPolarHBondContact O-CG2 3.29Å; L250-V254 PolarHBondContact O-N 2.88Å; V254-G257 PolarHBondContact O-N 3.39Å; V254-A258 WeakPolarHBondContact O-CB 3.38Å; V254-A258 PolarHBondContact O-N 3.42Å; V254-V324 HydrophobicContact CB-CG2 4.02Å; V254-V324 HydrophobicContact CG1-CG2 3.77Å; V254-V324 HydrophobicContact CG2-CG2 3.83Å; V254-L335 HydrophobicContact CG1-CB 4.42Å; V254-L335 HydrophobicContact CG1-CD2 3.47Å; V254-L335 VanDerWaalsContact CG1-CD2 3.47Å; V254-L335 HydrophobicContact CG1-CG 3.7Å
255	G	86.3	Confident	80.4	Confident	0 Å²	0	22 Å²	22	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-53.4	177.9	0	0	0	0	0	112.4	A251 V252 G253 A258 Y265	A251-G255 PolarHBondContact O-N 3.41Å; V252-G255 PolarHBondContact O-N 2.95Å; G253-G255 VanDerWaalsContact C-N 3.33Å; G255-A258 PolarHBondContact O-N 2.94Å; G255-Y265 WeakPolarHBondContact CA-OH 3.37Å; G255-Y265 WeakPolarHBondContact O-CE1 3.12Å
256	F	88.4	Confident	80	Confident	8 Å²	8	23.9 Å²	23.9	4%	0.035	16%	0.16	C	C	.	.	H	α-helix	trans	-69	-34.5	176.6	-80.1	-68	0	0	0	113.1	Q60 A61 V252 A258 V259 F267 A270 A274	Q60-F256 HydrophobicContact CB-CB 4.14Å; Q60-F256 HydrophobicContact CB-CD1 3.55Å; Q60-F256 HydrophobicContact CB-CE1 4.18Å; Q60-F256 HydrophobicContact CB-CG 3.98Å; A61-F256 HydrophobicContact CB-CB 3.79Å; V252-F256 HydrophobicContact CG1-CD2 3.78Å; V252-F256 HydrophobicContact CG1-CE2 3.95Å; V252-F256 WeakPolarHBondContact O-CD2 3.41Å; V252-F256 PolarHBondContact O-N 3.39Å; F256-A258 PolarHBondContact O-N 2.88Å; F256-V259 HydrophobicContact CD1-CG2 4.36Å; F256-V259 VanDerWaalsContact O-CB 3.32Å; F256-V259 WeakPolarHBondContact O-CB 3.4Å; F256-V259 WeakPolarHBondContact O-CG2 3.38Å; F256-V259 PolarHBondContact O-N 3.29Å; F256-V259 VanDerWaalsContact O-N 3.15Å; F256-F267 HydrophobicContact CD1-CE2 4.47Å; F256-F267 HydrophobicContact CE1-CD2 4.23Å; F256-F267 AromaticContact CE1-CE2 3.85Å; F256-F267 HydrophobicContact CE1-CE2 3.85Å; F256-F267 HydrophobicContact CE1-CZ 4.48Å; F256-A270 HydrophobicContact CD1-CB 3.57Å; F256-A270 HydrophobicContact CD2-CB 4.49Å; F256-A270 HydrophobicContact CE1-CB 3.71Å; F256-A270 HydrophobicContact CG-CB 3.99Å; F256-A270 HydrophobicContact CZ-CB 4.25Å; F256-A274 HydrophobicContact CE2-CB 3.71Å; F256-A274 HydrophobicContact CZ-CB 4.15Å
257	G	84.5	Confident	79.9	Confident	1 Å²	1	21 Å²	21	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-28.2	175	0	0	0	0	0	113.7	G253 V254 V259	G253-G257 PolarHBondContact O-N 3.35Å; V254-G257 PolarHBondContact O-N 3.39Å; G257-V259 VanDerWaalsContact C-N 3.33Å
258	A	81.1	Confident	79.7	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-9.5	176.8	0	0	0	0	0	114	V254 G255 F256 G260 T261 Y265 L331	V254-A258 WeakPolarHBondContact O-CB 3.38Å; V254-A258 PolarHBondContact O-N 3.42Å; G255-A258 PolarHBondContact O-N 2.94Å; F256-A258 PolarHBondContact O-N 2.88Å; A258-G260 PolarHBondContact O-N 3.39Å; A258-G260 VanDerWaalsContact O-N 3.13Å; A258-T261 PolarHBondContact O-N 3.25Å; A258-Y265 HydrophobicContact CB-CD1 3.77Å; A258-Y265 HydrophobicContact CB-CD2 4.45Å; A258-Y265 HydrophobicContact CB-CE1 4.26Å; A258-Y265 HydrophobicContact CB-CG 3.9Å; A258-L331 HydrophobicContact CB-CD1 3.77Å; A258-L331 HydrophobicContact CB-CD2 4.09Å; A258-L331 HydrophobicContact CB-CG 4.14Å
259	V	80	Confident	79.2	Confident	24 Å²	24	21.7 Å²	21.7	15%	0.145	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	114.3	-177.5	176.3	0	0	0	0	110.2	F256 G257 Y265 F267 A270	F256-V259 HydrophobicContact CD1-CG2 4.36Å; F256-V259 VanDerWaalsContact O-CB 3.32Å; F256-V259 WeakPolarHBondContact O-CB 3.4Å; F256-V259 WeakPolarHBondContact O-CG2 3.38Å; F256-V259 PolarHBondContact O-N 3.29Å; F256-V259 VanDerWaalsContact O-N 3.15Å; G257-V259 VanDerWaalsContact C-N 3.33Å; V259-Y265 HydrophobicContact CG2-CD1 4.46Å; V259-F267 HydrophobicContact CG1-CB 3.87Å; V259-F267 HydrophobicContact CG1-CD2 4.43Å; V259-F267 HydrophobicContact CG2-CB 4.5Å; V259-A270 HydrophobicContact CG2-CB 3.58Å
260	G	71.6	Confident	78.9	Confident	73 Å²	73	21.7 Å²	21.7	75%	0.753	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	89	-0.6	178.5	0	0	0	0	0	115	A258	A258-G260 PolarHBondContact O-N 3.39Å; A258-G260 VanDerWaalsContact O-N 3.13Å
261	T	69.3	Low	78.8	Confident	52 Å²	52	20.5 Å²	20.5	32%	0.319	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-32.6	175.8	-54.1	0	0	0	0	112.9	A258 H328 L331	A258-T261 PolarHBondContact O-N 3.25Å; T261-H328 HydrophobicContact CG2-CB 4.16Å; T261-H328 WeakPolarHBondContact CG2-ND1 2.99Å; T261-L331 HydrophobicContact CG2-CD1 3.72Å
262	S	61.1	Low	78.6	Confident	34 Å²	34	20.5 Å²	20.5	24%	0.238	14%	0.139	C	C	.	.	S	Bend	trans	-142.1	158.8	-176.6	63.7	0	0	0	0	111.6	I134 G264	I134-S262 WeakPolarHBondContact CD1-OG 3.48Å; I134-S262 WeakPolarHBondContact CG1-OG 3.25Å; S262-G264 PolarHBondContact O-N 2.88Å
263	T	60.5	Low	78.3	Confident	125 Å²	125	20.5 Å²	20.5	77%	0.767	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.6	-179	47.8	0	0	0	0	113.5
264	G	61.3	Low	78.2	Confident	15 Å²	15	20.7 Å²	20.7	16%	0.155	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-22.3	-175.1	0	0	0	0	0	116.4	S262	S262-G264 PolarHBondContact O-N 2.88Å
265	Y	70.8	Confident	78.2	Confident	4 Å²	4	22.5 Å²	22.5	2%	0.016	15%	0.149	C	C	.	.			trans	-104.2	109.1	-178.3	-151.4	-84.7	0	0	0	111.8	S126 P130 I134 G255 A258 V259 K269 A270 L335	S126-Y265 PolarHBondContact O-OH 3.34Å; P130-Y265 HydrophobicContact CB-CD2 3.4Å; P130-Y265 HydrophobicContact CB-CE2 3.61Å; P130-Y265 HydrophobicContact CG-CD2 4.04Å; P130-Y265 HydrophobicContact CG-CE2 3.79Å; I134-Y265 HydrophobicContact CD1-CD2 4.35Å; G255-Y265 WeakPolarHBondContact CA-OH 3.37Å; G255-Y265 WeakPolarHBondContact O-CE1 3.12Å; A258-Y265 HydrophobicContact CB-CD1 3.77Å; A258-Y265 HydrophobicContact CB-CD2 4.45Å; A258-Y265 HydrophobicContact CB-CE1 4.26Å; A258-Y265 HydrophobicContact CB-CG 3.9Å; V259-Y265 HydrophobicContact CG2-CD1 4.46Å; Y265-K269 HydrophobicContact CE1-CB 4.17Å; Y265-K269 HydrophobicContact CE2-CB 4.35Å; Y265-A270 HydrophobicContact CE1-CB 3.9Å; Y265-L335 HydrophobicContact CD2-CD1 4.19Å; Y265-L335 HydrophobicContact CE2-CD1 4.21Å; Y265-L335 HydrophobicContact CE2-CD2 4.14Å
266	T	77.8	Confident	78.1	Confident	40 Å²	40	22.5 Å²	22.5	25%	0.245	15%	0.149	C	C	.	.			trans	-98.9	155.8	-177.5	68.9	0	0	0	0	111.5	E268 K269 A270 Y382	T266-E268 PolarHBondContact O-N 3.16Å; T266-E268 VanDerWaalsContact O-N 3.08Å; T266-E268 PolarHBondContact OG1-N 3.26Å; T266-K269 PolarHBondContact O-N 3.13Å; T266-K269 PolarHBondContact OG1-N 3.31Å; T266-A270 PolarHBondContact O-N 3.07Å; T266-Y382 HydrophobicContact CG2-CE2 4.49Å
267	F	83.1	Confident	78.1	Confident	12 Å²	12	22.1 Å²	22.1	5%	0.053	15%	0.148	C	C	.	.	H	α-helix	trans	-51	-30.9	167.4	176.1	-90.6	0	0	0	112.6	R49 L52 K53 F256 V259 A270 R271	R49-F267 HydrophobicContact CG-CE1 4.36Å; L52-F267 HydrophobicContact CB-CE2 3.93Å; L52-F267 HydrophobicContact CB-CZ 3.52Å; L52-F267 HydrophobicContact CD1-CZ 4.28Å; K53-F267 HydrophobicContact CD-CD1 4.04Å; K53-F267 HydrophobicContact CD-CE1 4.47Å; K53-F267 HydrophobicContact CD-CG 4.3Å; K53-F267 HydrophobicContact CG-CB 4.25Å; K53-F267 HydrophobicContact CG-CD1 3.55Å; K53-F267 HydrophobicContact CG-CD2 3.83Å; K53-F267 HydrophobicContact CG-CE1 3.77Å; K53-F267 HydrophobicContact CG-CE2 4.03Å; K53-F267 HydrophobicContact CG-CG 3.58Å; K53-F267 HydrophobicContact CG-CZ 4.01Å; F256-F267 HydrophobicContact CD1-CE2 4.47Å; F256-F267 HydrophobicContact CE1-CD2 4.23Å; F256-F267 AromaticContact CE1-CE2 3.85Å; F256-F267 HydrophobicContact CE1-CE2 3.85Å; F256-F267 HydrophobicContact CE1-CZ 4.48Å; V259-F267 HydrophobicContact CG1-CB 3.87Å; V259-F267 HydrophobicContact CG1-CD2 4.43Å; V259-F267 HydrophobicContact CG2-CB 4.5Å; F267-A270 PolarHBondContact O-N 2.95Å; F267-R271 HydrophobicContact CE1-CB 4.22Å; F267-R271 WeakPolarHBondContact O-CB 3.36Å; F267-R271 PolarHBondContact O-N 3.44Å
268	E	76.6	Confident	78.2	Confident	5 Å²	5	22.1 Å²	22.1	2%	0.023	15%	0.148	C	C	.	.	H	α-helix	trans	-66.8	-41.9	178.6	-49.8	-63.1	153.1	0	0	111.2	R49 K53 T266 R271 N272 P384	R49-E268 IonicContact CZ-OE1 3.03Å; R49-E268 VanDerWaalsContact CZ-OE1 3.3Å; R49-E268 IonicContact CZ-OE2 3.96Å; R49-E268 VanDerWaalsContact CZ-OE2 3.31Å; R49-E268 IonicContact NE-OE1 3.31Å; R49-E268 PolarHBondContact NE-OE1 3.07Å; R49-E268 IonicContact NE-OE2 3.67Å; R49-E268 PolarHBondContact NE-OE2 3.43Å; R49-E268 VanDerWaalsContact NE-OE2 3.15Å; R49-E268 IonicContact NH2-OE1 2.63Å; R49-E268 PolarHBondContact NH2-OE1 3.11Å; R49-E268 IonicContact NH2-OE2 2.65Å; R49-E268 PolarHBondContact NH2-OE2 3.33Å; K53-E268 WeakPolarHBondContact CE-OE1 3.47Å; K53-E268 IonicContact NZ-OE1 2.72Å; K53-E268 PolarHBondContact NZ-OE1 3.2Å; T266-E268 PolarHBondContact O-N 3.16Å; T266-E268 VanDerWaalsContact O-N 3.08Å; T266-E268 PolarHBondContact OG1-N 3.26Å; E268-R271 PolarHBondContact O-N 2.84Å; E268-R271 IonicContact OE2-CZ 3.7Å; E268-R271 IonicContact OE2-NH1 3.86Å; E268-R271 PolarHBondContact OE2-NH1 2.96Å; E268-R271 IonicContact OE2-NH2 3.3Å; E268-R271 PolarHBondContact OE2-NH2 3.42Å; E268-N272 WeakPolarHBondContact O-CB 3.46Å; E268-N272 PolarHBondContact O-N 2.9Å; E268-N272 PolarHBondContact O-OD1 2.97Å; E268-N272 VanDerWaalsContact O-OD1 3.06Å; E268-P384 HydrophobicContact CG-CG 4.34Å
269	K	76.8	Confident	78.4	Confident	20 Å²	20	25.3 Å²	25.3	9%	0.087	17%	0.165	C	C	.	.	H	α-helix	trans	-62.3	-47.2	173.5	-68.8	-162.2	172.2	-165.6	0	111.2	D129 P130 Y265 T266 R271 N272 L273 Y382	D129-K269 IonicContact OD2-NZ 2.73Å; D129-K269 PolarHBondContact OD2-NZ 3.49Å; P130-K269 HydrophobicContact CB-CD 4.42Å; P130-K269 HydrophobicContact CG-CD 3.83Å; Y265-K269 HydrophobicContact CE1-CB 4.17Å; Y265-K269 HydrophobicContact CE2-CB 4.35Å; T266-K269 PolarHBondContact O-N 3.13Å; T266-K269 PolarHBondContact OG1-N 3.31Å; K269-R271 VanDerWaalsContact C-N 3.33Å; K269-R271 PolarHBondContact O-N 3.33Å; K269-N272 PolarHBondContact O-N 2.77Å; K269-L273 WeakPolarHBondContact O-CB 3.42Å; K269-L273 PolarHBondContact O-N 2.99Å; K269-Y382 HydrophobicContact CD-CE2 4.15Å; K269-Y382 VanDerWaalsContact CE-CE2 3.47Å; K269-Y382 HydrophobicContact CG-CD2 4.14Å; K269-Y382 HydrophobicContact CG-CE2 3.79Å
270	A	84.6	Confident	78.8	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57.3	-45.5	177	0	0	0	0	0	112.3	F256 V259 Y265 T266 F267 A274	F256-A270 HydrophobicContact CD1-CB 3.57Å; F256-A270 HydrophobicContact CD2-CB 4.49Å; F256-A270 HydrophobicContact CE1-CB 3.71Å; F256-A270 HydrophobicContact CG-CB 3.99Å; F256-A270 HydrophobicContact CZ-CB 4.25Å; V259-A270 HydrophobicContact CG2-CB 3.58Å; Y265-A270 HydrophobicContact CE1-CB 3.9Å; T266-A270 PolarHBondContact O-N 3.07Å; F267-A270 PolarHBondContact O-N 2.95Å; A270-A274 PolarHBondContact O-N 3.19Å
271	R	84.9	Confident	79.7	Confident	16 Å²	16	20.7 Å²	20.7	6%	0.06	12%	0.122	C	C	.	.	H	α-helix	trans	-65.7	-45.1	178.2	-176.1	-158.5	63.1	-140.4	-16.6	111.4	F267 E268 K269 L273 A274 I275	F267-R271 HydrophobicContact CE1-CB 4.22Å; F267-R271 WeakPolarHBondContact O-CB 3.36Å; F267-R271 PolarHBondContact O-N 3.44Å; E268-R271 PolarHBondContact O-N 2.84Å; E268-R271 IonicContact OE2-CZ 3.7Å; E268-R271 IonicContact OE2-NH1 3.86Å; E268-R271 PolarHBondContact OE2-NH1 2.96Å; E268-R271 IonicContact OE2-NH2 3.3Å; E268-R271 PolarHBondContact OE2-NH2 3.42Å; K269-R271 VanDerWaalsContact C-N 3.33Å; K269-R271 PolarHBondContact O-N 3.33Å; R271-L273 VanDerWaalsContact C-N 3.31Å; R271-L273 PolarHBondContact O-N 2.92Å; R271-A274 PolarHBondContact O-N 3.49Å; R271-I275 HydrophobicContact CG-CD1 3.85Å; R271-I275 HydrophobicContact CG-CG1 4.34Å; R271-I275 VanDerWaalsContact O-CG1 3.29Å; R271-I275 WeakPolarHBondContact O-CG1 3.18Å; R271-I275 PolarHBondContact O-N 3.45Å
272	N	82.4	Confident	80.5	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.1	-42.3	-179.6	-67.4	-2.3	0	0	0	111.1	E268 K269 A274 I275 G276 D378 L381	E268-N272 WeakPolarHBondContact O-CB 3.46Å; E268-N272 PolarHBondContact O-N 2.9Å; E268-N272 PolarHBondContact O-OD1 2.97Å; E268-N272 VanDerWaalsContact O-OD1 3.06Å; K269-N272 PolarHBondContact O-N 2.77Å; N272-A274 PolarHBondContact O-N 2.91Å; N272-I275 PolarHBondContact O-N 3.01Å; N272-G276 PolarHBondContact O-N 3.01Å; N272-D378 WeakPolarHBondContact CB-OD1 3.2Å; N272-D378 PolarHBondContact ND2-OD1 3.37Å; N272-D378 VanDerWaalsContact ND2-OD1 3.07Å; N272-L381 WeakPolarHBondContact ND2-CB 3.4Å; N272-L381 WeakPolarHBondContact OD1-CB 3.23Å; N272-L381 VanDerWaalsContact OD1-CD1 3.26Å; N272-L381 WeakPolarHBondContact OD1-CD1 3.34Å
273	L	84.4	Confident	81.5	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-54.8	-50.9	171.5	176.7	61.4	0	0	0	111.3	A122 L127 A251 K269 R271 I275 G276 I277	A122-L273 HydrophobicContact CB-CD1 4.19Å; L127-L273 HydrophobicContact CD2-CD1 4.45Å; L127-L273 HydrophobicContact CD2-CD2 3.74Å; L127-L273 HydrophobicContact CG-CD1 4.39Å; A251-L273 HydrophobicContact CB-CD2 4.45Å; A251-L273 WeakPolarHBondContact O-CD2 3.47Å; K269-L273 WeakPolarHBondContact O-CB 3.42Å; K269-L273 PolarHBondContact O-N 2.99Å; R271-L273 VanDerWaalsContact C-N 3.31Å; R271-L273 PolarHBondContact O-N 2.92Å; L273-I275 VanDerWaalsContact C-N 3.33Å; L273-I275 PolarHBondContact O-N 3.42Å; L273-G276 PolarHBondContact O-N 2.99Å; L273-I277 HydrophobicContact CD1-CD1 3.78Å; L273-I277 HydrophobicContact CD1-CG1 4.24Å; L273-I277 HydrophobicContact CG-CD1 4.01Å; L273-I277 WeakPolarHBondContact O-CG1 3.37Å; L273-I277 PolarHBondContact O-N 3.4Å
274	A	89.3	Confident	82.6	Confident	4 Å²	4	14.6 Å²	14.6	3%	0.033	8%	0.077	C	C	.	.	H	α-helix	trans	-64.6	-34.3	179.9	0	0	0	0	0	113.2	T68 V252 F256 A270 R271 N272 G278	T68-A274 WeakPolarHBondContact CG2-O 3.48Å; V252-A274 HydrophobicContact CG1-CB 4.4Å; F256-A274 HydrophobicContact CE2-CB 3.71Å; F256-A274 HydrophobicContact CZ-CB 4.15Å; A270-A274 PolarHBondContact O-N 3.19Å; R271-A274 PolarHBondContact O-N 3.49Å; N272-A274 PolarHBondContact O-N 2.91Å; A274-G278 PolarHBondContact O-N 3.11Å
275	I	86.4	Confident	83.8	Confident	39 Å²	39	13.9 Å²	13.9	20%	0.2	7%	0.07	C	C	.	.	H	α-helix	trans	-70.5	-41.6	173.5	-61.2	166	0	0	0	110.4	R271 N272 L273 G278 L279 M377	R271-I275 HydrophobicContact CG-CD1 3.85Å; R271-I275 HydrophobicContact CG-CG1 4.34Å; R271-I275 VanDerWaalsContact O-CG1 3.29Å; R271-I275 WeakPolarHBondContact O-CG1 3.18Å; R271-I275 PolarHBondContact O-N 3.45Å; N272-I275 PolarHBondContact O-N 3.01Å; L273-I275 VanDerWaalsContact C-N 3.33Å; L273-I275 PolarHBondContact O-N 3.42Å; I275-G278 PolarHBondContact O-N 3.03Å; I275-L279 HydrophobicContact CG2-CD1 4.36Å; I275-L279 HydrophobicContact CG2-CG 4.45Å; I275-L279 WeakPolarHBondContact O-CG 3.22Å; I275-L279 PolarHBondContact O-N 3.41Å; I275-M377 HydrophobicContact CB-CE 3.79Å; I275-M377 HydrophobicContact CG2-CE 3.28Å
276	G	84.6	Confident	84.4	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-56.4	-54.2	175	0	0	0	0	0	111.5	V118 N272 L273 G278 L279 Q280	V118-G276 VanDerWaalsContact CG1-O 3.25Å; V118-G276 WeakPolarHBondContact CG1-O 3.4Å; N272-G276 PolarHBondContact O-N 3.01Å; L273-G276 PolarHBondContact O-N 2.99Å; G276-G278 VanDerWaalsContact C-N 3.33Å; G276-G278 PolarHBondContact O-N 2.88Å; G276-L279 WeakPolarHBondContact O-CB 3.27Å; G276-L279 PolarHBondContact O-N 3.22Å; G276-L279 VanDerWaalsContact O-N 3.08Å; G276-Q280 PolarHBondContact O-N 3.28Å
277	I	88.1	Confident	84.4	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-58.1	-46.6	175	-67	171.5	0	0	0	110.1	T68 E248 A251 V252 L273 L279 Q280 N281 M342	T68-I277 HydrophobicContact CG2-CB 4.09Å; T68-I277 HydrophobicContact CG2-CG2 3.75Å; E248-I277 HydrophobicContact CB-CG2 4.03Å; E248-I277 HydrophobicContact CG-CG2 4.46Å; A251-I277 HydrophobicContact CB-CD1 4.07Å; V252-I277 HydrophobicContact CG2-CB 4.45Å; V252-I277 HydrophobicContact CG2-CD1 3.53Å; V252-I277 HydrophobicContact CG2-CG2 4.4Å; L273-I277 HydrophobicContact CD1-CD1 3.78Å; L273-I277 HydrophobicContact CD1-CG1 4.24Å; L273-I277 HydrophobicContact CG-CD1 4.01Å; L273-I277 WeakPolarHBondContact O-CG1 3.37Å; L273-I277 PolarHBondContact O-N 3.4Å; I277-L279 VanDerWaalsContact C-N 3.27Å; I277-L279 PolarHBondContact O-N 2.93Å; I277-L279 VanDerWaalsContact O-N 3.17Å; I277-Q280 WeakPolarHBondContact O-CG 3.01Å; I277-Q280 PolarHBondContact O-N 2.98Å; I277-Q280 VanDerWaalsContact O-N 3.16Å; I277-N281 PolarHBondContact O-N 3.21Å; I277-N281 PolarHBondContact O-OD1 3.28Å; I277-M342 HydrophobicContact CD1-CE 4.38Å
278	G	88.2	Confident	84.4	Confident	1 Å²	1	12.3 Å²	12.3	1%	0.01	6%	0.061	C	C	.	.	H	α-helix	trans	-54.3	-40.7	175.2	0	0	0	0	0	113.6	V71 A274 I275 G276 Q280 N281	V71-G278 WeakPolarHBondContact CB-O 3.44Å; V71-G278 WeakPolarHBondContact CG1-O 3.3Å; A274-G278 PolarHBondContact O-N 3.11Å; I275-G278 PolarHBondContact O-N 3.03Å; G276-G278 VanDerWaalsContact C-N 3.33Å; G276-G278 PolarHBondContact O-N 2.88Å; G278-Q280 PolarHBondContact O-N 2.98Å; G278-N281 PolarHBondContact O-N 3.34Å
279	L	84.3	Confident	84.8	Confident	68 Å²	68	12 Å²	12	36%	0.356	6%	0.06	S	C	.	.	H	α-helix	trans	-64.2	-35.5	-179	-76	169.4	0	0	0	113.6	F114 I275 G276 I277 P283 M377	F114-L279 HydrophobicContact CE1-CB 4.48Å; I275-L279 HydrophobicContact CG2-CD1 4.36Å; I275-L279 HydrophobicContact CG2-CG 4.45Å; I275-L279 WeakPolarHBondContact O-CG 3.22Å; I275-L279 PolarHBondContact O-N 3.41Å; G276-L279 WeakPolarHBondContact O-CB 3.27Å; G276-L279 PolarHBondContact O-N 3.22Å; G276-L279 VanDerWaalsContact O-N 3.08Å; I277-L279 VanDerWaalsContact C-N 3.27Å; I277-L279 PolarHBondContact O-N 2.93Å; I277-L279 VanDerWaalsContact O-N 3.17Å; L279-P283 VanDerWaalsContact O-CD 3.23Å; L279-P283 WeakPolarHBondContact O-CD 3.31Å; L279-M377 HydrophobicContact CD1-CE 4.09Å; L279-M377 HydrophobicContact CD1-SD 3.61Å
280	Q	88.9	Confident	84.9	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-83.8	-25.7	178	58.9	173.1	69	0	0	113.2	V118 E248 G276 I277 G278 F282 P283 E284	V118-Q280 HydrophobicContact CB-CB 4.31Å; V118-Q280 HydrophobicContact CG1-CB 4.36Å; V118-Q280 HydrophobicContact CG1-CG 4.39Å; E248-Q280 PolarHBondContact OE1-NE2 3.44Å; G276-Q280 PolarHBondContact O-N 3.28Å; I277-Q280 WeakPolarHBondContact O-CG 3.01Å; I277-Q280 PolarHBondContact O-N 2.98Å; I277-Q280 VanDerWaalsContact O-N 3.16Å; G278-Q280 PolarHBondContact O-N 2.98Å; Q280-F282 PolarHBondContact O-N 2.99Å; Q280-P283 VanDerWaalsContact O-CB 3.26Å; Q280-P283 WeakPolarHBondContact O-CB 3.38Å; Q280-P283 WeakPolarHBondContact O-CD 3.41Å; Q280-P283 WeakPolarHBondContact O-CG 3.08Å; Q280-E284 PolarHBondContact O-N 3.23Å
281	N	90	Very high	84.3	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.9	-25.5	178.3	-73.4	27.3	0	0	0	112	T72 E248 I277 G278 E284 G285 E313	T72-N281 WeakPolarHBondContact CA-O 3.45Å; T72-N281 WeakPolarHBondContact OG1-CB 3.24Å; T72-N281 PolarHBondContact OG1-ND2 2.96Å; E248-N281 PolarHBondContact OE2-OD1 3.42Å; I277-N281 PolarHBondContact O-N 3.21Å; I277-N281 PolarHBondContact O-OD1 3.28Å; G278-N281 PolarHBondContact O-N 3.34Å; N281-E284 PolarHBondContact O-N 3.46Å; N281-G285 PolarHBondContact O-N 3.3Å; N281-E313 PolarHBondContact ND2-OE1 3.43Å; N281-E313 PolarHBondContact ND2-OE2 3.36Å
282	F	87	Confident	84	Confident	65 Å²	65	12.3 Å²	12.3	29%	0.285	6%	0.064	S	C	.	.	H	α-helix	trans	-61	-57	172.3	-177.6	-70.9	0	0	0	111.9	V71 L74 G75 F78 Q280 E284 G285 L286	V71-F282 HydrophobicContact CG1-CB 3.76Å; V71-F282 HydrophobicContact CG1-CD2 4.45Å; L74-F282 HydrophobicContact CD2-CD2 3.82Å; L74-F282 HydrophobicContact CD2-CE2 3.34Å; L74-F282 HydrophobicContact CD2-CZ 4.38Å; G75-F282 WeakPolarHBondContact CA-O 3.49Å; F78-F282 HydrophobicContact CD2-CZ 4.32Å; Q280-F282 PolarHBondContact O-N 2.99Å; F282-E284 VanDerWaalsContact C-N 3.28Å; F282-E284 PolarHBondContact O-N 3.44Å; F282-G285 PolarHBondContact O-N 3.05Å; F282-L286 HydrophobicContact CD1-CD1 3.8Å; F282-L286 HydrophobicContact CD1-CG 4.45Å; F282-L286 HydrophobicContact CE1-CD1 3.53Å; F282-L286 HydrophobicContact CE1-CG 4.28Å; F282-L286 PolarHBondContact O-N 3.15Å
283	P	82.5	Confident	83.7	Confident	9 Å²	9	13.5 Å²	13.5	6%	0.058	7%	0.074	C	C	.	.	H	α-helix	trans	-44.4	-43.2	165.9	-35.9	35	0	0	0	116.6	S111 F114 L279 Q280 L286 A287	S111-P283 VanDerWaalsContact O-CB 3.31Å; S111-P283 WeakPolarHBondContact O-CB 3.4Å; F114-P283 HydrophobicContact CD1-CG 4.22Å; L279-P283 VanDerWaalsContact O-CD 3.23Å; L279-P283 WeakPolarHBondContact O-CD 3.31Å; Q280-P283 VanDerWaalsContact O-CB 3.26Å; Q280-P283 WeakPolarHBondContact O-CB 3.38Å; Q280-P283 WeakPolarHBondContact O-CD 3.41Å; Q280-P283 WeakPolarHBondContact O-CG 3.08Å; P283-L286 VanDerWaalsContact O-CB 3.31Å; P283-L286 WeakPolarHBondContact O-CB 3.5Å; P283-L286 PolarHBondContact O-N 3.42Å; P283-A287 WeakPolarHBondContact O-CB 3.37Å; P283-A287 PolarHBondContact O-N 3.03Å
284	E	81.8	Confident	82.8	Confident	9 Å²	9	17.7 Å²	17.7	4%	0.042	11%	0.109	C	C	.	.	H	α-helix	trans	-72.3	-41.2	-176.4	-69	179.5	-157.3	0	0	112.4	S115 I241 Q280 N281 F282 L286 A287 V288	S115-E284 PolarHBondContact OG-OE1 3.16Å; I241-E284 HydrophobicContact CG2-CB 4.48Å; Q280-E284 PolarHBondContact O-N 3.23Å; N281-E284 PolarHBondContact O-N 3.46Å; F282-E284 VanDerWaalsContact C-N 3.28Å; F282-E284 PolarHBondContact O-N 3.44Å; E284-L286 PolarHBondContact O-N 3.1Å; E284-A287 PolarHBondContact O-N 3.03Å; E284-V288 PolarHBondContact O-N 3.1Å; E284-V288 VanDerWaalsContact O-N 3.08Å
285	G	87.1	Confident	81.8	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.5	-34.6	171.5	0	0	0	0	0	112.3	S76 N281 F282 S289	S76-G285 WeakPolarHBondContact CA-O 3.46Å; S76-G285 VanDerWaalsContact OG-CA 3.26Å; S76-G285 WeakPolarHBondContact OG-CA 3.25Å; S76-G285 PolarHBondContact OG-O 3.45Å; N281-G285 PolarHBondContact O-N 3.3Å; F282-G285 PolarHBondContact O-N 3.05Å; G285-S289 WeakPolarHBondContact O-CB 3.41Å; G285-S289 PolarHBondContact O-N 3.21Å; G285-S289 PolarHBondContact O-OG 3.14Å
286	L	83.9	Confident	81	Confident	17 Å²	17	22.7 Å²	22.7	9%	0.089	15%	0.148	C	C	.	.	H	α-helix	trans	-69.8	-45.1	171.4	-73.3	169.9	0	0	0	112.4	G75 F78 F282 P283 E284 V288 S289 L290	G75-L286 VanDerWaalsContact O-CD2 3.31Å; G75-L286 WeakPolarHBondContact O-CD2 3.08Å; F78-L286 HydrophobicContact CB-CD2 3.3Å; F78-L286 HydrophobicContact CB-CG 4.47Å; F78-L286 HydrophobicContact CD1-CD2 3.68Å; F78-L286 HydrophobicContact CG-CD2 3.62Å; F282-L286 HydrophobicContact CD1-CD1 3.8Å; F282-L286 HydrophobicContact CD1-CG 4.45Å; F282-L286 HydrophobicContact CE1-CD1 3.53Å; F282-L286 HydrophobicContact CE1-CG 4.28Å; F282-L286 PolarHBondContact O-N 3.15Å; P283-L286 VanDerWaalsContact O-CB 3.31Å; P283-L286 WeakPolarHBondContact O-CB 3.5Å; P283-L286 PolarHBondContact O-N 3.42Å; E284-L286 PolarHBondContact O-N 3.1Å; L286-V288 PolarHBondContact O-N 3.37Å; L286-S289 PolarHBondContact O-N 2.65Å; L286-L290 HydrophobicContact CB-CD1 4.21Å; L286-L290 HydrophobicContact CD2-CD1 3.94Å; L286-L290 HydrophobicContact CD2-CG 4.16Å; L286-L290 VanDerWaalsContact O-CB 3.3Å; L286-L290 WeakPolarHBondContact O-CB 3.35Å; L286-L290 VanDerWaalsContact O-CG 3.31Å; L286-L290 WeakPolarHBondContact O-CG 3.49Å; L286-L290 PolarHBondContact O-N 3.31Å
287	A	76.9	Confident	80.7	Confident	4 Å²	4	26.1 Å²	26.1	3%	0.033	16%	0.161	C	C	.	.	H	α-helix	trans	-62.4	-27.6	-177	0	0	0	0	0	113	L112 I241 P283 E284 P291	L112-A287 HydrophobicContact CD2-CB 4.16Å; I241-A287 HydrophobicContact CD1-CB 4.25Å; P283-A287 WeakPolarHBondContact O-CB 3.37Å; P283-A287 PolarHBondContact O-N 3.03Å; E284-A287 PolarHBondContact O-N 3.03Å; A287-P291 WeakPolarHBondContact O-CD 3.5Å; A287-P291 WeakPolarHBondContact O-CG 3.36Å
288	V	82.9	Confident	80.5	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-84.2	-51.5	172.5	175.9	0	0	0	0	112.2	V238 I241 E284 L286 P291 L292	V238-V288 HydrophobicContact CG2-CG1 3.93Å; I241-V288 HydrophobicContact CB-CG2 4.07Å; I241-V288 HydrophobicContact CD1-CG2 3.44Å; I241-V288 VanDerWaalsContact CD1-CG2 3.44Å; I241-V288 HydrophobicContact CG1-CG2 4.33Å; I241-V288 HydrophobicContact CG2-CG2 3.78Å; E284-V288 PolarHBondContact O-N 3.1Å; E284-V288 VanDerWaalsContact O-N 3.08Å; L286-V288 PolarHBondContact O-N 3.37Å; V288-P291 WeakPolarHBondContact O-CD 3.43Å; V288-L292 HydrophobicContact CG1-CD1 3.82Å; V288-L292 WeakPolarHBondContact O-CD1 3.45Å; V288-L292 WeakPolarHBondContact O-CG 3.03Å; V288-L292 PolarHBondContact O-N 2.99Å
289	S	86.2	Confident	80.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-72.9	-35.9	-168.7	62.9	0	0	0	0	113.3	S76 G285 L286 A293 S302	S76-S289 WeakPolarHBondContact CA-OG 3.45Å; S76-S289 PolarHBondContact O-OG 3.38Å; G285-S289 WeakPolarHBondContact O-CB 3.41Å; G285-S289 PolarHBondContact O-N 3.21Å; G285-S289 PolarHBondContact O-OG 3.14Å; L286-S289 PolarHBondContact O-N 2.65Å; S289-A293 WeakPolarHBondContact O-CB 3.41Å; S289-A293 PolarHBondContact O-N 3.14Å; S289-A293 VanDerWaalsContact O-N 3.11Å; S289-S302 WeakPolarHBondContact CB-O 3.32Å; S289-S302 WeakPolarHBondContact O-CB 3.47Å
290	L	78.5	Confident	80.7	Confident	16 Å²	16	36.4 Å²	36.4	8%	0.084	21%	0.207	C	C	.	.	H	α-helix	trans	-68.8	-48.6	-177.5	-65.5	179.7	0	0	0	112.5	V79 L82 I108 L286 L292 A293 A294	V79-L290 HydrophobicContact CG2-CD2 4.47Å; L82-L290 HydrophobicContact CD1-CD2 3.45Å; L82-L290 VanDerWaalsContact CD1-CD2 3.45Å; L82-L290 HydrophobicContact CG-CD2 4.15Å; I108-L290 HydrophobicContact CD1-CB 4.47Å; I108-L290 HydrophobicContact CG1-CD1 4.3Å; L286-L290 HydrophobicContact CB-CD1 4.21Å; L286-L290 HydrophobicContact CD2-CD1 3.94Å; L286-L290 HydrophobicContact CD2-CG 4.16Å; L286-L290 VanDerWaalsContact O-CB 3.3Å; L286-L290 WeakPolarHBondContact O-CB 3.35Å; L286-L290 VanDerWaalsContact O-CG 3.31Å; L286-L290 WeakPolarHBondContact O-CG 3.49Å; L286-L290 PolarHBondContact O-N 3.31Å; L290-L292 PolarHBondContact O-N 3.33Å; L290-A293 PolarHBondContact O-N 3.44Å; L290-A294 PolarHBondContact O-N 3.44Å
291	P	73.1	Confident	80.6	Confident	20 Å²	20	38.4 Å²	38.4	13%	0.13	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-46	175.8	-26.4	38.1	0	0	0	112.1	I108 L237 A287 V288 A293 A294 F295	I108-P291 HydrophobicContact CD1-CG 4.29Å; L237-P291 HydrophobicContact CD2-CG 4.4Å; A287-P291 WeakPolarHBondContact O-CD 3.5Å; A287-P291 WeakPolarHBondContact O-CG 3.36Å; V288-P291 WeakPolarHBondContact O-CD 3.43Å; P291-A293 VanDerWaalsContact C-N 3.3Å; P291-A293 PolarHBondContact O-N 3.31Å; P291-A294 CarbonylContact O-C 3.58Å; P291-A294 WeakPolarHBondContact O-CA 3.33Å; P291-A294 WeakPolarHBondContact O-CB 3.41Å; P291-A294 PolarHBondContact O-N 3.42Å; P291-F295 HydrophobicContact CB-CD2 4.49Å; P291-F295 HydrophobicContact CB-CE2 4.43Å; P291-F295 WeakPolarHBondContact O-CD2 3.5Å; P291-F295 PolarHBondContact O-N 3.25Å
292	L	77.1	Confident	80.4	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-55.1	-45.3	178.4	-80.8	167.7	0	0	0	112.1	I234 V238 V288 L290 A294 F295 Y297 Y305	I234-L292 HydrophobicContact CG2-CD2 3.44Å; I234-L292 VanDerWaalsContact CG2-CD2 3.44Å; I234-L292 HydrophobicContact CG2-CG 3.82Å; V238-L292 HydrophobicContact CG2-CD1 4.26Å; V288-L292 HydrophobicContact CG1-CD1 3.82Å; V288-L292 WeakPolarHBondContact O-CD1 3.45Å; V288-L292 WeakPolarHBondContact O-CG 3.03Å; V288-L292 PolarHBondContact O-N 2.99Å; L290-L292 PolarHBondContact O-N 3.33Å; L292-A294 VanDerWaalsContact C-N 3.34Å; L292-A294 PolarHBondContact O-N 2.92Å; L292-F295 PolarHBondContact O-N 2.88Å; L292-Y297 HydrophobicContact CD2-CD2 3.82Å; L292-Y297 HydrophobicContact CD2-CE2 3.95Å; L292-Y297 HydrophobicContact CD2-CG 4.16Å; L292-Y297 WeakPolarHBondContact O-CB 3.5Å; L292-Y297 WeakPolarHBondContact O-CD2 3.44Å; L292-Y297 PolarHBondContact O-N 3.4Å; L292-Y305 VanDerWaalsContact CD1-CB 3.41Å; L292-Y305 HydrophobicContact CD1-CD2 4.06Å; L292-Y305 HydrophobicContact CD1-CG 4.01Å
293	A	77	Confident	80.7	Confident	25 Å²	25	36.8 Å²	36.8	21%	0.207	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-36.1	175.9	0	0	0	0	0	112.8	V79 S289 L290 P291 F295 G296 S302	V79-A293 HydrophobicContact CG2-CB 3.37Å; S289-A293 WeakPolarHBondContact O-CB 3.41Å; S289-A293 PolarHBondContact O-N 3.14Å; S289-A293 VanDerWaalsContact O-N 3.11Å; L290-A293 PolarHBondContact O-N 3.44Å; P291-A293 VanDerWaalsContact C-N 3.3Å; P291-A293 PolarHBondContact O-N 3.31Å; A293-F295 VanDerWaalsContact C-N 3.29Å; A293-F295 PolarHBondContact O-N 3.07Å; A293-G296 PolarHBondContact O-N 3.42Å; A293-S302 WeakPolarHBondContact CA-OG 3.37Å; A293-S302 PolarHBondContact N-OG 2.89Å
294	A	66.3	Low	81.1	Confident	88 Å²	88	38.7 Å²	38.7	73%	0.727	22%	0.222	S	C	*	.	H	α-helix	trans	-66.4	-30.1	175.5	0	0	0	0	0	112.9	L290 P291 L292 G296	L290-A294 PolarHBondContact O-N 3.44Å; P291-A294 CarbonylContact O-C 3.58Å; P291-A294 WeakPolarHBondContact O-CA 3.33Å; P291-A294 WeakPolarHBondContact O-CB 3.41Å; P291-A294 PolarHBondContact O-N 3.42Å; L292-A294 VanDerWaalsContact C-N 3.34Å; L292-A294 PolarHBondContact O-N 2.92Å; A294-G296 PolarHBondContact O-N 3.37Å
295	F	67.9	Low	81.4	Confident	81 Å²	81	43.3 Å²	43.3	36%	0.355	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	4.4	174.4	-76.1	-74.3	0	0	0	114.2	T229 I234 P291 L292 A293 Y297	T229-F295 WeakPolarHBondContact O-CE1 3.21Å; I234-F295 HydrophobicContact CD1-CB 3.76Å; I234-F295 HydrophobicContact CD1-CD1 3.75Å; I234-F295 HydrophobicContact CD1-CD2 3.06Å; I234-F295 HydrophobicContact CD1-CE1 4.07Å; I234-F295 HydrophobicContact CD1-CE2 3.47Å; I234-F295 VanDerWaalsContact CD1-CE2 3.47Å; I234-F295 HydrophobicContact CD1-CG 3.24Å; I234-F295 HydrophobicContact CD1-CZ 3.95Å; I234-F295 HydrophobicContact CG1-CD2 3.49Å; I234-F295 VanDerWaalsContact CG1-CD2 3.49Å; I234-F295 HydrophobicContact CG1-CE2 3.41Å; I234-F295 VanDerWaalsContact CG1-CE2 3.41Å; I234-F295 HydrophobicContact CG1-CG 4.17Å; I234-F295 HydrophobicContact CG1-CZ 3.99Å; P291-F295 HydrophobicContact CB-CD2 4.49Å; P291-F295 HydrophobicContact CB-CE2 4.43Å; P291-F295 WeakPolarHBondContact O-CD2 3.5Å; P291-F295 PolarHBondContact O-N 3.25Å; L292-F295 PolarHBondContact O-N 2.88Å; A293-F295 VanDerWaalsContact C-N 3.29Å; A293-F295 PolarHBondContact O-N 3.07Å; F295-Y297 HydrophobicContact CB-CD2 4.47Å
296	G	68.5	Low	81.4	Confident	67 Å²	67	43.3 Å²	43.3	69%	0.691	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.2	8.6	174.3	0	0	0	0	0	115	A293 A294	A293-G296 PolarHBondContact O-N 3.42Å; A294-G296 PolarHBondContact O-N 3.37Å
297	Y	78.1	Confident	81.8	Confident	73 Å²	73	43.5 Å²	43.5	29%	0.286	24%	0.24	S	C	.	.			trans	-63.3	148.3	166.6	-76	-99.5	0	0	0	110.2	W231 L292 F295 Y305	W231-Y297 VanDerWaalsContact CE3-OH 3.24Å; W231-Y297 VanDerWaalsContact CZ3-OH 3.23Å; W231-Y297 WeakPolarHBondContact CZ3-OH 3.5Å; L292-Y297 HydrophobicContact CD2-CD2 3.82Å; L292-Y297 HydrophobicContact CD2-CE2 3.95Å; L292-Y297 HydrophobicContact CD2-CG 4.16Å; L292-Y297 WeakPolarHBondContact O-CB 3.5Å; L292-Y297 WeakPolarHBondContact O-CD2 3.44Å; L292-Y297 PolarHBondContact O-N 3.4Å; F295-Y297 HydrophobicContact CB-CD2 4.47Å; Y297-Y305 HydrophobicContact CD1-CE2 4.2Å; Y297-Y305 HydrophobicContact CE1-CE2 4.19Å
298	S	85.6	Confident	82.4	Confident	63 Å²	63	46.8 Å²	46.8	44%	0.441	26%	0.257	S	S	.	.			trans	-59.9	145	174.3	85.7	0	0	0	0	109.6	W300 S301 S302	S298-W300 PolarHBondContact O-N 3.48Å; S298-W300 VanDerWaalsContact O-N 3.09Å; S298-S301 WeakPolarHBondContact O-CA 3.41Å; S298-S301 WeakPolarHBondContact O-CB 3.47Å; S298-S301 PolarHBondContact O-N 2.95Å; S298-S301 WeakPolarHBondContact OG-CB 3.25Å; S298-S301 PolarHBondContact OG-N 3.48Å; S298-S301 PolarHBondContact OG-OG 3.22Å; S298-S302 PolarHBondContact O-N 3.25Å; S298-S302 PolarHBondContact O-OG 3.19Å
299	K	85.7	Confident	82.7	Confident	67 Å²	67	46.9 Å²	46.9	29%	0.291	26%	0.257	S	S	.	.	H	α-helix	trans	-51.9	-37.3	177.8	-65.7	-174.5	174	-170.9	0	112.4	V79 F80 L82 F303	V79-K299 HydrophobicContact CG1-CB 4.38Å; V79-K299 WeakPolarHBondContact CG1-O 3.26Å; F80-K299 HydrophobicContact CD1-CB 4.04Å; F80-K299 HydrophobicContact CD1-CD 4.21Å; F80-K299 HydrophobicContact CE1-CB 3.83Å; F80-K299 PolarHBondContact O-NZ 3.48Å; L82-K299 WeakPolarHBondContact O-CE 3.22Å; L82-K299 PolarHBondContact O-NZ 3.06Å; K299-F303 WeakPolarHBondContact O-CB 3.45Å; K299-F303 PolarHBondContact O-N 2.9Å
300	W	89.7	Confident	82.7	Confident	155 Å²	155	46.9 Å²	46.9	59%	0.587	26%	0.257	S	S	*	.	H	α-helix	trans	-66.9	-44.9	176.5	-172.5	-102.9	0	0	0	112.1	F80 S298 F303 M304	F80-W300 HydrophobicContact CE1-CE3 4.48Å; F80-W300 AromaticContact CZ-CE3 3.84Å; F80-W300 HydrophobicContact CZ-CE3 3.84Å; F80-W300 HydrophobicContact CZ-CZ3 4.32Å; S298-W300 PolarHBondContact O-N 3.48Å; S298-W300 VanDerWaalsContact O-N 3.09Å; W300-F303 HydrophobicContact CE3-CD1 4.11Å; W300-F303 HydrophobicContact CH2-CD1 4.36Å; W300-F303 HydrophobicContact CH2-CE1 4.19Å; W300-F303 AromaticContact CZ3-CD1 3.98Å; W300-F303 HydrophobicContact CZ3-CD1 3.98Å; W300-F303 HydrophobicContact CZ3-CE1 4.09Å; W300-F303 PolarHBondContact O-N 2.88Å; W300-M304 HydrophobicContact CH2-CE 4.11Å; W300-M304 HydrophobicContact CZ2-CE 3.78Å; W300-M304 HydrophobicContact CZ2-SD 4.22Å; W300-M304 WeakPolarHBondContact O-CB 3.26Å; W300-M304 VanDerWaalsContact O-CG 3.26Å; W300-M304 WeakPolarHBondContact O-CG 3.38Å; W300-M304 PolarHBondContact O-N 3.05Å
301	S	86.7	Confident	83.3	Confident	41 Å²	41	50.4 Å²	50.4	29%	0.287	27%	0.274	S	S	.	.	H	α-helix	trans	-60.6	-46.3	174.9	-57	0	0	0	0	111.2	S298 F303 M304 Y305	S298-S301 WeakPolarHBondContact O-CA 3.41Å; S298-S301 WeakPolarHBondContact O-CB 3.47Å; S298-S301 PolarHBondContact O-N 2.95Å; S298-S301 WeakPolarHBondContact OG-CB 3.25Å; S298-S301 PolarHBondContact OG-N 3.48Å; S298-S301 PolarHBondContact OG-OG 3.22Å; S301-F303 VanDerWaalsContact C-N 3.34Å; S301-F303 PolarHBondContact O-N 3.31Å; S301-M304 PolarHBondContact O-N 2.93Å; S301-Y305 WeakPolarHBondContact O-CD2 3.44Å; S301-Y305 PolarHBondContact O-N 2.82Å
302	S	86.4	Confident	84.1	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-40.5	177.8	-56.3	0	0	0	0	112.8	S289 A293 S298 G306	S289-S302 WeakPolarHBondContact CB-O 3.32Å; S289-S302 WeakPolarHBondContact O-CB 3.47Å; A293-S302 WeakPolarHBondContact CA-OG 3.37Å; A293-S302 PolarHBondContact N-OG 2.89Å; S298-S302 PolarHBondContact O-N 3.25Å; S298-S302 PolarHBondContact O-OG 3.19Å; S302-G306 PolarHBondContact O-N 2.89Å; S302-G306 VanDerWaalsContact O-N 3.1Å
303	F	92.2	Very high	84.8	Confident	32 Å²	32	50.8 Å²	50.8	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-45.2	173	168.2	-116.1	0	0	0	111.7	A73 A77 V79 F80 K299 W300 S301 G306 Q307	A73-F303 WeakPolarHBondContact O-CE2 3.32Å; A77-F303 HydrophobicContact CB-CD2 4.24Å; A77-F303 HydrophobicContact CB-CE2 4.02Å; V79-F303 HydrophobicContact CG1-CB 4.17Å; F80-F303 HydrophobicContact CE2-CB 3.8Å; F80-F303 AromaticContact CE2-CD1 3.97Å; F80-F303 HydrophobicContact CE2-CD1 3.97Å; F80-F303 HydrophobicContact CE2-CD2 4.09Å; F80-F303 AromaticContact CE2-CG 3.68Å; F80-F303 HydrophobicContact CE2-CG 3.68Å; F80-F303 HydrophobicContact CZ-CB 3.85Å; F80-F303 HydrophobicContact CZ-CD1 4.11Å; F80-F303 HydrophobicContact CZ-CG 4.04Å; K299-F303 WeakPolarHBondContact O-CB 3.45Å; K299-F303 PolarHBondContact O-N 2.9Å; W300-F303 HydrophobicContact CE3-CD1 4.11Å; W300-F303 HydrophobicContact CH2-CD1 4.36Å; W300-F303 HydrophobicContact CH2-CE1 4.19Å; W300-F303 AromaticContact CZ3-CD1 3.98Å; W300-F303 HydrophobicContact CZ3-CD1 3.98Å; W300-F303 HydrophobicContact CZ3-CE1 4.09Å; W300-F303 PolarHBondContact O-N 2.88Å; S301-F303 VanDerWaalsContact C-N 3.34Å; S301-F303 PolarHBondContact O-N 3.31Å; F303-G306 PolarHBondContact O-N 3.43Å; F303-Q307 HydrophobicContact CZ-CG 4.49Å; F303-Q307 WeakPolarHBondContact O-CG 3.35Å; F303-Q307 PolarHBondContact O-N 2.68Å
304	M	91.3	Very high	85.5	Confident	49 Å²	49	50.5 Å²	50.5	24%	0.241	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-47.9	178.3	-74	-66.6	101.3	0	0	111.9	W300 S301 G306 Q307 L308	W300-M304 HydrophobicContact CH2-CE 4.11Å; W300-M304 HydrophobicContact CZ2-CE 3.78Å; W300-M304 HydrophobicContact CZ2-SD 4.22Å; W300-M304 WeakPolarHBondContact O-CB 3.26Å; W300-M304 VanDerWaalsContact O-CG 3.26Å; W300-M304 WeakPolarHBondContact O-CG 3.38Å; W300-M304 PolarHBondContact O-N 3.05Å; S301-M304 PolarHBondContact O-N 2.93Å; M304-G306 VanDerWaalsContact C-N 3.31Å; M304-G306 PolarHBondContact O-N 3.3Å; M304-Q307 HydrophobicContact CE-CG 4.1Å; M304-Q307 PolarHBondContact O-N 3.48Å; M304-L308 WeakPolarHBondContact O-CB 3.37Å; M304-L308 WeakPolarHBondContact O-CD1 3.36Å; M304-L308 WeakPolarHBondContact O-CG 3.38Å; M304-L308 PolarHBondContact O-N 3.2Å
305	Y	87.6	Confident	86.7	Confident	105 Å²	105	52.3 Å²	52.3	41%	0.412	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-36.8	177	-74.4	-63.8	0	0	0	112.5	L292 Y297 S301 S309	L292-Y305 VanDerWaalsContact CD1-CB 3.41Å; L292-Y305 HydrophobicContact CD1-CD2 4.06Å; L292-Y305 HydrophobicContact CD1-CG 4.01Å; Y297-Y305 HydrophobicContact CD1-CE2 4.2Å; Y297-Y305 HydrophobicContact CE1-CE2 4.19Å; S301-Y305 WeakPolarHBondContact O-CD2 3.44Å; S301-Y305 PolarHBondContact O-N 2.82Å; Y305-S309 PolarHBondContact O-N 2.92Å
306	G	88.2	Confident	87.8	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-70.4	-37.7	177.9	0	0	0	0	0	114.7	S76 S302 F303 M304 S309	S76-G306 VanDerWaalsContact OG-CA 3.24Å; S76-G306 WeakPolarHBondContact OG-CA 3.36Å; S76-G306 PolarHBondContact OG-O 3.41Å; S302-G306 PolarHBondContact O-N 2.89Å; S302-G306 VanDerWaalsContact O-N 3.1Å; F303-G306 PolarHBondContact O-N 3.43Å; M304-G306 VanDerWaalsContact C-N 3.31Å; M304-G306 PolarHBondContact O-N 3.3Å; G306-S309 PolarHBondContact O-OG 3.04Å
307	Q	91.7	Very high	88.9	Confident	22 Å²	22	45.9 Å²	45.9	10%	0.103	23%	0.225	C	C	.	.	H	α-helix	trans	-78.6	-31.8	175.2	72.4	81.2	8.6	0	0	112.1	W69 A73 S76 F303 M304 S309 G310 M311	W69-Q307 VanDerWaalsContact CZ2-OE1 3.25Å; W69-Q307 PolarHBondContact NE1-O 2.98Å; A73-Q307 HydrophobicContact CB-CB 3.93Å; S76-Q307 PolarHBondContact OG-N 3.17Å; F303-Q307 HydrophobicContact CZ-CG 4.49Å; F303-Q307 WeakPolarHBondContact O-CG 3.35Å; F303-Q307 PolarHBondContact O-N 2.68Å; M304-Q307 HydrophobicContact CE-CG 4.1Å; M304-Q307 PolarHBondContact O-N 3.48Å; Q307-S309 VanDerWaalsContact C-N 3.31Å; Q307-S309 PolarHBondContact O-N 3.18Å; Q307-G310 PolarHBondContact O-N 3.44Å; Q307-M311 PolarHBondContact O-N 2.8Å
308	L	90.4	Very high	89.6	Confident	73 Å²	73	46 Å²	46	38%	0.382	23%	0.23	S	C	.	.	H	α-helix	trans	-67.8	-30.4	178.2	-76	172	0	0	0	112.1	M304 G310 M311	M304-L308 WeakPolarHBondContact O-CB 3.37Å; M304-L308 WeakPolarHBondContact O-CD1 3.36Å; M304-L308 WeakPolarHBondContact O-CG 3.38Å; M304-L308 PolarHBondContact O-N 3.2Å; L308-G310 VanDerWaalsContact C-N 3.28Å; L308-G310 PolarHBondContact O-N 3.06Å; L308-M311 HydrophobicContact CD2-CE 3.5Å; L308-M311 HydrophobicContact CD2-SD 3.93Å; L308-M311 WeakPolarHBondContact O-CB 3.35Å; L308-M311 PolarHBondContact O-N 3.24Å; L308-M311 VanDerWaalsContact O-N 3.17Å
309	S	88	Confident	89.7	Confident	2 Å²	2	46 Å²	46	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-63.5	-33.4	174.7	58.9	0	0	0	0	112.5	T242 N245 Y305 G306 Q307	T242-S309 WeakPolarHBondContact OG1-CB 3.42Å; N245-S309 PolarHBondContact ND2-O 2.88Å; Y305-S309 PolarHBondContact O-N 2.92Å; G306-S309 PolarHBondContact O-OG 3.04Å; Q307-S309 VanDerWaalsContact C-N 3.31Å; Q307-S309 PolarHBondContact O-N 3.18Å
310	G	87.9	Confident	89.8	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-6.3	174.6	0	0	0	0	0	114.7	W69 Q307 L308 V312 E313	W69-G310 VanDerWaalsContact CD1-C 3.47Å; Q307-G310 PolarHBondContact O-N 3.44Å; L308-G310 VanDerWaalsContact C-N 3.28Å; L308-G310 PolarHBondContact O-N 3.06Å; G310-V312 PolarHBondContact O-N 2.93Å; G310-E313 WeakPolarHBondContact CA-OE1 3.36Å; G310-E313 WeakPolarHBondContact O-CB 3.38Å; G310-E313 VanDerWaalsContact O-CG 3.25Å; G310-E313 WeakPolarHBondContact O-CG 3.13Å; G310-E313 PolarHBondContact O-N 3.4Å; G310-E313 VanDerWaalsContact O-N 3.08Å
311	M	89.7	Confident	89.7	Confident	90 Å²	90	35.7 Å²	35.7	44%	0.443	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-11.9	-178.5	-167.1	167.3	71.1	0	0	112.9	Q307 L308 E313 P314	Q307-M311 PolarHBondContact O-N 2.8Å; L308-M311 HydrophobicContact CD2-CE 3.5Å; L308-M311 HydrophobicContact CD2-SD 3.93Å; L308-M311 WeakPolarHBondContact O-CB 3.35Å; L308-M311 PolarHBondContact O-N 3.24Å; L308-M311 VanDerWaalsContact O-N 3.17Å; M311-E313 VanDerWaalsContact C-N 3.3Å; M311-P314 WeakPolarHBondContact O-CD 3.31Å
312	V	90.9	Very high	89.7	Confident	34 Å²	34	37 Å²	37	21%	0.206	20%	0.201	C	C	.	.	H	α-helix	trans	-74	-21.3	171.9	-57.8	0	0	0	0	112.3	T242 N245 I246 G310 L315 A316	T242-V312 HydrophobicContact CG2-CG1 3.81Å; T242-V312 HydrophobicContact CG2-CG2 4.47Å; T242-V312 WeakPolarHBondContact O-CG2 3.36Å; N245-V312 HydrophobicContact CB-CG2 3.31Å; I246-V312 HydrophobicContact CG1-CB 4.24Å; I246-V312 HydrophobicContact CG1-CG2 4.02Å; G310-V312 PolarHBondContact O-N 2.93Å; V312-L315 PolarHBondContact O-N 3.15Å; V312-A316 WeakPolarHBondContact O-CB 3.42Å; V312-A316 PolarHBondContact O-N 3.27Å
313	E	90.6	Very high	89.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-48	-177.3	-51.7	162.1	-142.3	0	0	112	T68 W69 T72 N245 G249 N281 G310 M311 L315 A316 A317	T68-E313 WeakPolarHBondContact CB-OE2 3.37Å; T68-E313 PolarHBondContact OG1-OE2 3.17Å; W69-E313 PolarHBondContact N-OE2 3.42Å; T72-E313 PolarHBondContact OG1-OE1 3.03Å; N245-E313 HydrophobicContact CB-CG 3.82Å; N245-E313 WeakPolarHBondContact OD1-CG 3.36Å; N245-E313 PolarHBondContact OD1-OE1 3.49Å; G249-E313 WeakPolarHBondContact CA-O 3.39Å; N281-E313 PolarHBondContact ND2-OE1 3.43Å; N281-E313 PolarHBondContact ND2-OE2 3.36Å; G310-E313 WeakPolarHBondContact CA-OE1 3.36Å; G310-E313 WeakPolarHBondContact O-CB 3.38Å; G310-E313 VanDerWaalsContact O-CG 3.25Å; G310-E313 WeakPolarHBondContact O-CG 3.13Å; G310-E313 PolarHBondContact O-N 3.4Å; G310-E313 VanDerWaalsContact O-N 3.08Å; M311-E313 VanDerWaalsContact C-N 3.3Å; E313-L315 VanDerWaalsContact C-N 3.28Å; E313-L315 PolarHBondContact O-N 3.33Å; E313-A316 PolarHBondContact O-N 3.33Å; E313-A317 WeakPolarHBondContact O-CB 3.32Å; E313-A317 PolarHBondContact O-N 3.34Å
314	P	92.6	Very high	89	Confident	18 Å²	18	37.2 Å²	37.2	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-31.7	177.2	-22.8	36.1	0	0	0	113.9	S65 W69 M311 L318	S65-P314 WeakPolarHBondContact OG-CA 3.37Å; W69-P314 HydrophobicContact CB-CG 4.13Å; W69-P314 HydrophobicContact CG-CG 4.48Å; M311-P314 WeakPolarHBondContact O-CD 3.31Å; P314-L318 WeakPolarHBondContact O-CB 3.23Å; P314-L318 PolarHBondContact O-N 2.84Å
315	L	91.9	Very high	88.2	Confident	126 Å²	126	37.2 Å²	37.2	66%	0.66	22%	0.215	S	C	*	.	H	α-helix	trans	-69.9	-47.7	176.7	-64.2	175.4	0	0	0	110.9	V312 E313 A317 L318 A319	V312-L315 PolarHBondContact O-N 3.15Å; E313-L315 VanDerWaalsContact C-N 3.28Å; E313-L315 PolarHBondContact O-N 3.33Å; L315-A317 VanDerWaalsContact C-N 3.34Å; L315-L318 PolarHBondContact O-N 2.98Å; L315-A319 PolarHBondContact O-N 3.47Å; L315-A319 VanDerWaalsContact O-N 3.08Å
316	A	90.5	Very high	87.6	Confident	13 Å²	13	35.9 Å²	35.9	11%	0.107	23%	0.226	C	C	.	.	H	α-helix	trans	-66.5	-35.8	177	0	0	0	0	0	112	I246 V312 E313 A319 G320	I246-A316 HydrophobicContact CG2-CB 4.2Å; I246-A316 WeakPolarHBondContact O-CB 3.36Å; V312-A316 WeakPolarHBondContact O-CB 3.42Å; V312-A316 PolarHBondContact O-N 3.27Å; E313-A316 PolarHBondContact O-N 3.33Å; A316-A319 PolarHBondContact O-N 2.83Å; A316-G320 PolarHBondContact O-N 2.97Å
317	A	91.6	Very high	86.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-40.4	175.6	0	0	0	0	0	112.8	G249 G253 E313 L315 G320 A321	G249-A317 WeakPolarHBondContact O-CA 3.11Å; G249-A317 WeakPolarHBondContact O-CB 3.43Å; G249-A317 PolarHBondContact O-N 2.87Å; G253-A317 WeakPolarHBondContact CA-O 3.48Å; E313-A317 WeakPolarHBondContact O-CB 3.32Å; E313-A317 PolarHBondContact O-N 3.34Å; L315-A317 VanDerWaalsContact C-N 3.34Å; A317-G320 PolarHBondContact O-N 2.98Å; A317-A321 VanDerWaalsContact O-CB 3.31Å; A317-A321 WeakPolarHBondContact O-CB 3.15Å; A317-A321 PolarHBondContact O-N 2.82Å
318	L	91.6	Very high	86	Confident	75 Å²	75	44.9 Å²	44.9	39%	0.393	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-45	173.5	-175.2	63	0	0	0	110.9	I58 P314 L315 G320 A321 V322	I58-L318 HydrophobicContact CG2-CD1 3.56Å; P314-L318 WeakPolarHBondContact O-CB 3.23Å; P314-L318 PolarHBondContact O-N 2.84Å; L315-L318 PolarHBondContact O-N 2.98Å; L318-G320 PolarHBondContact O-N 3.13Å; L318-A321 PolarHBondContact O-N 3.46Å; L318-V322 HydrophobicContact CD1-CG2 4.3Å; L318-V322 WeakPolarHBondContact O-CB 3.34Å; L318-V322 VanDerWaalsContact O-CG2 3.25Å; L318-V322 WeakPolarHBondContact O-CG2 3.31Å; L318-V322 PolarHBondContact O-N 3.29Å
319	A	89.6	Confident	85.4	Confident	63 Å²	63	44.2 Å²	44.2	52%	0.521	27%	0.274	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176.7	0	0	0	0	0	112.1	L315 A316 G323	L315-A319 PolarHBondContact O-N 3.47Å; L315-A319 VanDerWaalsContact O-N 3.08Å; A316-A319 PolarHBondContact O-N 2.83Å; A319-G323 PolarHBondContact O-N 3.38Å
320	G	87.5	Confident	85.1	Confident	6 Å²	6	46.9 Å²	46.9	6%	0.062	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-44.7	176.9	0	0	0	0	0	113	A316 A317 L318 G323 V324	A316-G320 PolarHBondContact O-N 2.97Å; A317-G320 PolarHBondContact O-N 2.98Å; L318-G320 PolarHBondContact O-N 3.13Å; G320-G323 PolarHBondContact O-N 3.04Å; G320-V324 WeakPolarHBondContact O-CG2 3.42Å; G320-V324 PolarHBondContact O-N 3.43Å
321	A	87.4	Confident	84.8	Confident	0 Å²	0	47 Å²	47	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-46.2	178.2	0	0	0	0	0	111.9	I58 A61 G253 A317 L318 G323 V324 T325	I58-A321 HydrophobicContact CG1-CB 4.46Å; A61-A321 HydrophobicContact CB-CB 3.49Å; A61-A321 VanDerWaalsContact CB-CB 3.49Å; G253-A321 WeakPolarHBondContact O-CA 3.34Å; A317-A321 VanDerWaalsContact O-CB 3.31Å; A317-A321 WeakPolarHBondContact O-CB 3.15Å; A317-A321 PolarHBondContact O-N 2.82Å; L318-A321 PolarHBondContact O-N 3.46Å; A321-G323 PolarHBondContact O-N 3.5Å; A321-V324 PolarHBondContact O-N 3.07Å; A321-T325 VanDerWaalsContact O-CG2 3.31Å; A321-T325 WeakPolarHBondContact O-CG2 3.33Å; A321-T325 PolarHBondContact O-N 3.4Å; A321-T325 PolarHBondContact O-OG1 3.14Å; A321-T325 VanDerWaalsContact O-OG1 3.13Å
322	V	86.6	Confident	84.7	Confident	69 Å²	69	42.7 Å²	42.7	42%	0.418	27%	0.267	S	S	.	.	H	α-helix	trans	-61.6	-45.2	176.4	172.3	0	0	0	0	110.5	I58 L318 V324 T325 A326	I58-V322 HydrophobicContact CD1-CG2 4.41Å; L318-V322 HydrophobicContact CD1-CG2 4.3Å; L318-V322 WeakPolarHBondContact O-CB 3.34Å; L318-V322 VanDerWaalsContact O-CG2 3.25Å; L318-V322 WeakPolarHBondContact O-CG2 3.31Å; L318-V322 PolarHBondContact O-N 3.29Å; V322-V324 PolarHBondContact O-N 2.95Å; V322-T325 WeakPolarHBondContact CA-OG1 3.41Å; V322-T325 PolarHBondContact O-N 3.09Å; V322-T325 PolarHBondContact O-OG1 3.49Å; V322-A326 WeakPolarHBondContact O-CB 3.41Å; V322-A326 PolarHBondContact O-N 3.29Å
323	G	83.3	Confident	84.7	Confident	36 Å²	36	43.5 Å²	43.5	37%	0.371	27%	0.268	S	S	.	.	H	α-helix	trans	-57.4	-45.6	178.4	0	0	0	0	0	113.4	A319 G320 A321 A326 M327	A319-G323 PolarHBondContact O-N 3.38Å; G320-G323 PolarHBondContact O-N 3.04Å; A321-G323 PolarHBondContact O-N 3.5Å; G323-A326 PolarHBondContact O-N 3.42Å; G323-M327 PolarHBondContact O-N 3.21Å; G323-M327 VanDerWaalsContact O-N 3.14Å
324	V	79.3	Confident	84.5	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-69.6	-39.4	179.2	173.8	0	0	0	0	112.3	V254 G320 A321 V322 A326 M327 L331	V254-V324 HydrophobicContact CB-CG2 4.02Å; V254-V324 HydrophobicContact CG1-CG2 3.77Å; V254-V324 HydrophobicContact CG2-CG2 3.83Å; G320-V324 WeakPolarHBondContact O-CG2 3.42Å; G320-V324 PolarHBondContact O-N 3.43Å; A321-V324 PolarHBondContact O-N 3.07Å; V322-V324 PolarHBondContact O-N 2.95Å; V324-A326 VanDerWaalsContact C-N 3.27Å; V324-A326 PolarHBondContact O-N 3.39Å; V324-M327 CarbonylContact O-C 3.54Å; V324-M327 PolarHBondContact O-N 3.47Å; V324-L331 HydrophobicContact CG1-CB 4.45Å; V324-L331 HydrophobicContact CG1-CD1 3.83Å; V324-L331 HydrophobicContact CG1-CG 3.88Å
325	T	75.6	Confident	84.3	Confident	49 Å²	49	43.5 Å²	43.5	30%	0.301	27%	0.268	S	S	.	.	H	α-helix	trans	-67.2	-28.4	176.9	57.6	0	0	0	0	112.8	I58 A321 V322	I58-T325 HydrophobicContact CG1-CG2 4.38Å; A321-T325 VanDerWaalsContact O-CG2 3.31Å; A321-T325 WeakPolarHBondContact O-CG2 3.33Å; A321-T325 PolarHBondContact O-N 3.4Å; A321-T325 PolarHBondContact O-OG1 3.14Å; A321-T325 VanDerWaalsContact O-OG1 3.13Å; V322-T325 WeakPolarHBondContact CA-OG1 3.41Å; V322-T325 PolarHBondContact O-N 3.09Å; V322-T325 PolarHBondContact O-OG1 3.49Å
326	A	74.4	Confident	84.2	Confident	77 Å²	77	37.5 Å²	37.5	64%	0.636	24%	0.237	S	C	*	.	H	α-helix	trans	-79.9	-30.3	176.8	0	0	0	0	0	113.1	V322 G323 V324	V322-A326 WeakPolarHBondContact O-CB 3.41Å; V322-A326 PolarHBondContact O-N 3.29Å; G323-A326 PolarHBondContact O-N 3.42Å; V324-A326 VanDerWaalsContact C-N 3.27Å; V324-A326 PolarHBondContact O-N 3.39Å
327	M	73.3	Confident	84.3	Confident	111 Å²	111	38.8 Å²	38.8	55%	0.547	24%	0.24	S	C	.	.			trans	-136.2	71.7	-169.7	-61	-179.1	72.5	0	0	112.2	G323 V324 A329 L330	G323-M327 PolarHBondContact O-N 3.21Å; G323-M327 VanDerWaalsContact O-N 3.14Å; V324-M327 CarbonylContact O-C 3.54Å; V324-M327 PolarHBondContact O-N 3.47Å; M327-A329 PolarHBondContact O-N 3Å; M327-A329 VanDerWaalsContact O-N 3.13Å; M327-L330 HydrophobicContact CB-CB 4.03Å; M327-L330 HydrophobicContact CE-CD2 4.15Å; M327-L330 WeakPolarHBondContact O-CB 3.42Å; M327-L330 PolarHBondContact O-N 2.87Å; M327-L330 HydrophobicContact SD-CD2 4.34Å
328	H	73.8	Confident	84.1	Confident	99 Å²	99	38.9 Å²	38.9	46%	0.458	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-55.1	-33.1	-179.6	-68.4	-53	0	0	0	114.4	T261 L330 L331	T261-H328 HydrophobicContact CG2-CB 4.16Å; T261-H328 WeakPolarHBondContact CG2-ND1 2.99Å; H328-L330 PolarHBondContact O-N 3.4Å; H328-L331 WeakPolarHBondContact O-CB 3.43Å; H328-L331 PolarHBondContact O-N 3.14Å
329	A	76.6	Confident	84	Confident	59 Å²	59	35.3 Å²	35.3	49%	0.488	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-65.5	-26	176.7	0	0	0	0	0	113.1	Y139 M327 L331	Y139-A329 PolarHBondContact OH-O 3.31Å; Y139-A329 VanDerWaalsContact OH-O 3.13Å; M327-A329 PolarHBondContact O-N 3Å; M327-A329 VanDerWaalsContact O-N 3.13Å; A329-L331 VanDerWaalsContact C-N 3.33Å
330	L	82	Confident	84.1	Confident	59 Å²	59	32.3 Å²	32.3	31%	0.309	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-90.3	2.3	-179.9	-159.3	68.6	0	0	0	112.4	M327 H328 F333 S334	M327-L330 HydrophobicContact CB-CB 4.03Å; M327-L330 HydrophobicContact CE-CD2 4.15Å; M327-L330 WeakPolarHBondContact O-CB 3.42Å; M327-L330 PolarHBondContact O-N 2.87Å; M327-L330 HydrophobicContact SD-CD2 4.34Å; H328-L330 PolarHBondContact O-N 3.4Å; L330-F333 HydrophobicContact CD1-CB 3.72Å; L330-F333 HydrophobicContact CD1-CD1 3.72Å; L330-F333 HydrophobicContact CD1-CG 3.76Å; L330-F333 HydrophobicContact CD2-CD1 4.38Å; L330-F333 HydrophobicContact CG-CB 4.04Å; L330-F333 HydrophobicContact CG-CD1 3.9Å; L330-F333 HydrophobicContact CG-CG 4.25Å; L330-F333 WeakPolarHBondContact O-CB 3.44Å; L330-F333 PolarHBondContact O-N 3.31Å; L330-S334 WeakPolarHBondContact O-CB 3.5Å; L330-S334 PolarHBondContact O-N 3.46Å; L330-S334 PolarHBondContact O-OG 2.91Å
331	L	82.9	Confident	84.1	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-51.2	-179.4	-165.8	165.8	0	0	0	113.2	I134 A258 T261 V324 H328 A329 F333 S334 L335	I134-L331 HydrophobicContact CD1-CD2 3.5Å; I134-L331 VanDerWaalsContact CD1-CD2 3.5Å; I134-L331 HydrophobicContact CG2-CD2 4.3Å; A258-L331 HydrophobicContact CB-CD1 3.77Å; A258-L331 HydrophobicContact CB-CD2 4.09Å; A258-L331 HydrophobicContact CB-CG 4.14Å; T261-L331 HydrophobicContact CG2-CD1 3.72Å; V324-L331 HydrophobicContact CG1-CB 4.45Å; V324-L331 HydrophobicContact CG1-CD1 3.83Å; V324-L331 HydrophobicContact CG1-CG 3.88Å; H328-L331 WeakPolarHBondContact O-CB 3.43Å; H328-L331 PolarHBondContact O-N 3.14Å; A329-L331 VanDerWaalsContact C-N 3.33Å; L331-F333 VanDerWaalsContact C-N 3.25Å; L331-F333 PolarHBondContact O-N 3.14Å; L331-S334 PolarHBondContact O-N 2.77Å; L331-S334 VanDerWaalsContact O-N 3.1Å; L331-L335 HydrophobicContact CD2-CD1 3.49Å; L331-L335 VanDerWaalsContact CD2-CD1 3.49Å; L331-L335 HydrophobicContact CD2-CG 4.05Å; L331-L335 PolarHBondContact O-N 3.31Å
332	P	87.4	Confident	84	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-35.1	178.3	23.6	-33.8	0	0	0	112.5	L138 Y139 M146 V147 S336	L138-P332 HydrophobicContact CD1-CG 4.37Å; Y139-P332 HydrophobicContact CE2-CG 4.18Å; M146-P332 HydrophobicContact CG-CB 4.45Å; M146-P332 HydrophobicContact CG-CG 4.04Å; V147-P332 HydrophobicContact CG2-CB 4.29Å; P332-S336 WeakPolarHBondContact O-CB 3.5Å; P332-S336 PolarHBondContact O-N 2.94Å; P332-S336 VanDerWaalsContact O-N 3.16Å; P332-S336 PolarHBondContact O-OG 3.3Å
333	F	90.4	Very high	84.2	Confident	51 Å²	51	30.7 Å²	30.7	22%	0.224	19%	0.185	C	C	.	.	H	α-helix	trans	-66.7	-41.3	173.9	179.8	-86.4	0	0	0	112	M146 G150 A153 L330 L331 S336 F337	M146-F333 HydrophobicContact CG-CB 4.12Å; M146-F333 HydrophobicContact SD-CB 3.83Å; M146-F333 HydrophobicContact SD-CD2 4.03Å; M146-F333 HydrophobicContact SD-CG 4.36Å; G150-F333 VanDerWaalsContact CA-CD2 3.42Å; A153-F333 HydrophobicContact CB-CE2 4.34Å; A153-F333 HydrophobicContact CB-CZ 3.96Å; L330-F333 HydrophobicContact CD1-CB 3.72Å; L330-F333 HydrophobicContact CD1-CD1 3.72Å; L330-F333 HydrophobicContact CD1-CG 3.76Å; L330-F333 HydrophobicContact CD2-CD1 4.38Å; L330-F333 HydrophobicContact CG-CB 4.04Å; L330-F333 HydrophobicContact CG-CD1 3.9Å; L330-F333 HydrophobicContact CG-CG 4.25Å; L330-F333 WeakPolarHBondContact O-CB 3.44Å; L330-F333 PolarHBondContact O-N 3.31Å; L331-F333 VanDerWaalsContact C-N 3.25Å; L331-F333 PolarHBondContact O-N 3.14Å; F333-S336 PolarHBondContact O-N 3.39Å; F333-S336 PolarHBondContact O-OG 3.29Å; F333-S336 VanDerWaalsContact O-OG 3.11Å; F333-F337 HydrophobicContact CE1-CB 4.46Å; F333-F337 HydrophobicContact CE1-CD2 4.37Å; F333-F337 WeakPolarHBondContact O-CB 3.45Å; F333-F337 PolarHBondContact O-N 2.88Å
334	S	86.6	Confident	84.4	Confident	19 Å²	19	31.3 Å²	31.3	13%	0.133	18%	0.176	C	C	.	.	H	α-helix	trans	-69.1	-41.3	-177.4	-56.7	0	0	0	0	111.9	L330 L331 A338	L330-S334 WeakPolarHBondContact O-CB 3.5Å; L330-S334 PolarHBondContact O-N 3.46Å; L330-S334 PolarHBondContact O-OG 2.91Å; L331-S334 PolarHBondContact O-N 2.77Å; L331-S334 VanDerWaalsContact O-N 3.1Å; S334-A338 PolarHBondContact O-N 2.87Å
335	L	87.9	Confident	84.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-45	173.9	-77.2	173.2	0	0	0	111.3	L127 P130 A131 I134 V254 Y265 L331 A338 A339	L127-L335 HydrophobicContact CD2-CD2 3.7Å; P130-L335 HydrophobicContact CB-CD1 4.35Å; A131-L335 HydrophobicContact CB-CB 3.74Å; A131-L335 HydrophobicContact CB-CD1 4.26Å; I134-L335 HydrophobicContact CD1-CD1 4.05Å; V254-L335 HydrophobicContact CG1-CB 4.42Å; V254-L335 HydrophobicContact CG1-CD2 3.47Å; V254-L335 VanDerWaalsContact CG1-CD2 3.47Å; V254-L335 HydrophobicContact CG1-CG 3.7Å; Y265-L335 HydrophobicContact CD2-CD1 4.19Å; Y265-L335 HydrophobicContact CE2-CD1 4.21Å; Y265-L335 HydrophobicContact CE2-CD2 4.14Å; L331-L335 HydrophobicContact CD2-CD1 3.49Å; L331-L335 VanDerWaalsContact CD2-CD1 3.49Å; L331-L335 HydrophobicContact CD2-CG 4.05Å; L331-L335 PolarHBondContact O-N 3.31Å; L335-A338 PolarHBondContact O-N 3.46Å; L335-A339 PolarHBondContact O-N 3.45Å
336	S	91.1	Very high	85.1	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-71.2	-34.3	179.8	70.9	0	0	0	0	112.4	V147 G150 F151 P332 F333 A339 G340	V147-S336 WeakPolarHBondContact O-CB 3.29Å; V147-S336 PolarHBondContact O-OG 2.9Å; G150-S336 VanDerWaalsContact CA-OG 3.23Å; G150-S336 WeakPolarHBondContact CA-OG 3.28Å; F151-S336 VanDerWaalsContact CA-O 3.28Å; F151-S336 WeakPolarHBondContact CA-O 3.36Å; F151-S336 PolarHBondContact N-OG 3.45Å; P332-S336 WeakPolarHBondContact O-CB 3.5Å; P332-S336 PolarHBondContact O-N 2.94Å; P332-S336 VanDerWaalsContact O-N 3.16Å; P332-S336 PolarHBondContact O-OG 3.3Å; F333-S336 PolarHBondContact O-N 3.39Å; F333-S336 PolarHBondContact O-OG 3.29Å; F333-S336 VanDerWaalsContact O-OG 3.11Å; S336-A339 WeakPolarHBondContact O-CB 3.32Å; S336-A339 PolarHBondContact O-N 3.46Å; S336-G340 PolarHBondContact O-N 3.25Å
337	F	91	Very high	85.8	Confident	40 Å²	40	31.6 Å²	31.6	18%	0.175	16%	0.16	C	C	.	.	H	α-helix	trans	-57.3	-48.8	169.8	179.5	-83.8	0	0	0	111.6	G150 A153 G154 F157 F333 A339 G340 A341	G150-F337 WeakPolarHBondContact O-CA 3.44Å; A153-F337 HydrophobicContact CB-CD2 4.12Å; G154-F337 VanDerWaalsContact CA-CD2 3.44Å; G154-F337 WeakPolarHBondContact CA-O 3.38Å; F157-F337 HydrophobicContact CB-CE2 3.9Å; F157-F337 HydrophobicContact CB-CZ 3.88Å; F157-F337 AromaticContact CD1-CZ 3.87Å; F157-F337 HydrophobicContact CD1-CZ 3.87Å; F157-F337 HydrophobicContact CD2-CZ 4.2Å; F157-F337 HydrophobicContact CE1-CZ 4.44Å; F157-F337 HydrophobicContact CG-CE2 4.2Å; F157-F337 AromaticContact CG-CZ 3.73Å; F157-F337 HydrophobicContact CG-CZ 3.73Å; F333-F337 HydrophobicContact CE1-CB 4.46Å; F333-F337 HydrophobicContact CE1-CD2 4.37Å; F333-F337 WeakPolarHBondContact O-CB 3.45Å; F333-F337 PolarHBondContact O-N 2.88Å; F337-A339 VanDerWaalsContact C-N 3.32Å; F337-A339 PolarHBondContact O-N 3.24Å; F337-G340 PolarHBondContact O-N 2.63Å; F337-A341 WeakPolarHBondContact O-CB 3.37Å; F337-A341 PolarHBondContact O-N 3.33Å
338	A	87.3	Confident	86.2	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-41.2	175.7	0	0	0	0	0	111.9	L127 L250 A251 S334 L335 M342	L127-A338 HydrophobicContact CD1-CB 4.04Å; L250-A338 HydrophobicContact CD2-CB 4.16Å; A251-A338 HydrophobicContact CB-CB 4.2Å; S334-A338 PolarHBondContact O-N 2.87Å; L335-A338 PolarHBondContact O-N 3.46Å; A338-M342 WeakPolarHBondContact O-CB 3.14Å; A338-M342 PolarHBondContact O-N 2.97Å
339	A	91	Very high	86.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-43.8	176.4	0	0	0	0	0	112.5	L127 F151 L335 S336 F337 M342 I343	L127-A339 HydrophobicContact CB-CB 3.82Å; L127-A339 HydrophobicContact CD1-CB 4.17Å; F151-A339 HydrophobicContact CD2-CB 4.26Å; L335-A339 PolarHBondContact O-N 3.45Å; S336-A339 WeakPolarHBondContact O-CB 3.32Å; S336-A339 PolarHBondContact O-N 3.46Å; F337-A339 VanDerWaalsContact C-N 3.32Å; F337-A339 PolarHBondContact O-N 3.24Å; A339-M342 PolarHBondContact O-N 2.86Å; A339-I343 WeakPolarHBondContact O-CG1 3.32Å; A339-I343 PolarHBondContact O-N 2.91Å
340	G	91.3	Very high	86.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.2	-42.8	178.3	0	0	0	0	0	112.7	F151 S336 F337 Y344	F151-G340 VanDerWaalsContact CD2-CA 3.48Å; F151-G340 WeakPolarHBondContact O-CA 3.36Å; S336-G340 PolarHBondContact O-N 3.25Å; F337-G340 PolarHBondContact O-N 2.63Å; G340-Y344 PolarHBondContact O-N 2.98Å; G340-Y344 VanDerWaalsContact O-N 3.08Å
341	A	86.5	Confident	86.6	Confident	3 Å²	3	23.6 Å²	23.6	3%	0.025	12%	0.116	C	C	.	.	H	α-helix	trans	-61.1	-48.4	173.8	0	0	0	0	0	111.2	L158 P247 F337 I343 Y344 V345	L158-A341 HydrophobicContact CD1-CB 3.73Å; L158-A341 WeakPolarHBondContact CD1-O 3.25Å; L158-A341 HydrophobicContact CG-CB 4.1Å; P247-A341 HydrophobicContact CB-CB 4.09Å; P247-A341 HydrophobicContact CG-CB 4.17Å; F337-A341 WeakPolarHBondContact O-CB 3.37Å; F337-A341 PolarHBondContact O-N 3.33Å; A341-I343 PolarHBondContact O-N 3.43Å; A341-Y344 PolarHBondContact O-N 3.5Å; A341-V345 PolarHBondContact O-N 3.21Å; A341-V345 VanDerWaalsContact O-N 3.17Å
342	M	86.4	Confident	86.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.1	-42.2	-179.7	-170.5	180	-65.1	0	0	112.6	M119 A122 S123 L127 A251 I277 A338 A339 V345 V346	M119-M342 HydrophobicContact CB-CG 4.06Å; M119-M342 HydrophobicContact CB-SD 4.19Å; M119-M342 HydrophobicContact CE-CG 3.74Å; M119-M342 HydrophobicContact CG-CG 4.45Å; M119-M342 VanDerWaalsContact O-SD 3.37Å; A122-M342 HydrophobicContact CB-SD 4.32Å; S123-M342 WeakPolarHBondContact OG-CB 3.44Å; S123-M342 VanDerWaalsContact OG-CG 3.31Å; S123-M342 WeakPolarHBondContact OG-CG 3.21Å; S123-M342 PolarHBondContact OG-SD 3.32Å; L127-M342 HydrophobicContact CD1-CE 4.03Å; A251-M342 HydrophobicContact CB-CE 3.92Å; I277-M342 HydrophobicContact CD1-CE 4.38Å; A338-M342 WeakPolarHBondContact O-CB 3.14Å; A338-M342 PolarHBondContact O-N 2.97Å; A339-M342 PolarHBondContact O-N 2.86Å; M342-V345 PolarHBondContact O-N 2.86Å; M342-V346 WeakPolarHBondContact O-CG2 3.49Å; M342-V346 PolarHBondContact O-N 3.36Å
343	I	90.4	Very high	86.2	Confident	39 Å²	39	28.7 Å²	28.7	20%	0.2	15%	0.145	C	C	.	.	H	α-helix	trans	-63.8	-41.2	176.1	-70.8	-63.7	0	0	0	111.7	T120 F151 A339 A341 V345 V346 F347	T120-I343 HydrophobicContact CG2-CD1 4.27Å; F151-I343 HydrophobicContact CE2-CB 4.43Å; F151-I343 HydrophobicContact CE2-CG1 4.18Å; F151-I343 HydrophobicContact CZ-CB 4.38Å; F151-I343 HydrophobicContact CZ-CG1 4.43Å; F151-I343 HydrophobicContact CZ-CG2 4.3Å; A339-I343 WeakPolarHBondContact O-CG1 3.32Å; A339-I343 PolarHBondContact O-N 2.91Å; A341-I343 PolarHBondContact O-N 3.43Å; I343-V345 PolarHBondContact O-N 3.48Å; I343-V346 PolarHBondContact O-N 3.36Å; I343-F347 HydrophobicContact CG2-CD2 3.89Å; I343-F347 HydrophobicContact CG2-CE2 4.06Å; I343-F347 WeakPolarHBondContact O-CD2 3.37Å; I343-F347 PolarHBondContact O-N 2.81Å
344	Y	87.7	Confident	85.7	Confident	48 Å²	48	26.4 Å²	26.4	19%	0.188	14%	0.135	C	C	.	.	H	α-helix	trans	-58.2	-50	177.5	-177.6	-79.6	0	0	0	111.1	A155 L158 R159 D162 G340 A341 V346 F347 D348	A155-Y344 HydrophobicContact CB-CD2 4.39Å; A155-Y344 WeakPolarHBondContact O-CD2 3.33Å; L158-Y344 HydrophobicContact CB-CD1 3.69Å; L158-Y344 HydrophobicContact CB-CE1 4.19Å; L158-Y344 HydrophobicContact CB-CG 4.14Å; L158-Y344 HydrophobicContact CD1-CD1 4.2Å; R159-Y344 HydrophobicContact CB-CD2 4.48Å; R159-Y344 HydrophobicContact CB-CE2 3.67Å; R159-Y344 HydrophobicContact CG-CE2 4.28Å; D162-Y344 WeakPolarHBondContact OD2-CE1 3.46Å; G340-Y344 PolarHBondContact O-N 2.98Å; G340-Y344 VanDerWaalsContact O-N 3.08Å; A341-Y344 PolarHBondContact O-N 3.5Å; Y344-V346 VanDerWaalsContact C-N 3.32Å; Y344-V346 PolarHBondContact O-N 3.47Å; Y344-F347 PolarHBondContact O-N 3.46Å; Y344-D348 HydrophobicContact CD1-CB 4.21Å; Y344-D348 HydrophobicContact CE1-CB 3.73Å; Y344-D348 WeakPolarHBondContact CE1-OD2 3.38Å; Y344-D348 WeakPolarHBondContact O-CB 3.33Å; Y344-D348 PolarHBondContact O-N 3.43Å; Y344-D348 PolarHBondContact OH-OD2 3.24Å
345	V	82	Confident	85.7	Confident	5 Å²	5	28.9 Å²	28.9	3%	0.03	14%	0.144	C	C	.	.	H	α-helix	trans	-55.7	-44.6	178	170.4	0	0	0	0	112.3	M119 L158 H244 A341 M342 I343 F347 D349 V350	M119-V345 HydrophobicContact CE-CB 4.35Å; M119-V345 HydrophobicContact CE-CG1 3.94Å; L158-V345 HydrophobicContact CD1-CG2 3.42Å; L158-V345 VanDerWaalsContact CD1-CG2 3.42Å; H244-V345 HydrophobicContact CB-CG1 4.05Å; H244-V345 VanDerWaalsContact CD2-CG1 3.47Å; H244-V345 WeakPolarHBondContact CD2-CG1 3.4Å; H244-V345 VanDerWaalsContact CG-CG1 3.48Å; A341-V345 PolarHBondContact O-N 3.21Å; A341-V345 VanDerWaalsContact O-N 3.17Å; M342-V345 PolarHBondContact O-N 2.86Å; I343-V345 PolarHBondContact O-N 3.48Å; V345-F347 VanDerWaalsContact C-N 3.33Å; V345-F347 PolarHBondContact O-N 2.88Å; V345-D349 PolarHBondContact O-N 2.73Å; V345-V350 HydrophobicContact CG1-CG2 3.96Å; V345-V350 PolarHBondContact O-N 3.42Å
346	V	86.8	Confident	85.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.	I	π-helix	trans	-59	-45.8	-178.5	170	0	0	0	0	111.5	A116 M119 M342 I343 Y344 V350 V351	A116-V346 HydrophobicContact CB-CG1 3.99Å; M119-V346 HydrophobicContact CB-CG2 3.34Å; M119-V346 HydrophobicContact CE-CG2 4.01Å; M119-V346 HydrophobicContact CG-CG2 4.06Å; M119-V346 HydrophobicContact SD-CG2 3.65Å; M342-V346 WeakPolarHBondContact O-CG2 3.49Å; M342-V346 PolarHBondContact O-N 3.36Å; I343-V346 PolarHBondContact O-N 3.36Å; Y344-V346 VanDerWaalsContact C-N 3.32Å; Y344-V346 PolarHBondContact O-N 3.47Å; V346-V350 PolarHBondContact O-N 3.48Å; V346-V351 HydrophobicContact CG1-CG2 3.89Å; V346-V351 WeakPolarHBondContact O-CB 3.43Å; V346-V351 WeakPolarHBondContact O-CG2 3.26Å; V346-V351 PolarHBondContact O-N 3.4Å
347	F	89.1	Confident	84	Confident	129 Å²	129	35.7 Å²	35.7	57%	0.566	18%	0.18	S	C	*	.	I	π-helix	trans	-84.8	-30.4	-174	-77.9	-75	0	0	0	113.8	I343 Y344 V345 P352	I343-F347 HydrophobicContact CG2-CD2 3.89Å; I343-F347 HydrophobicContact CG2-CE2 4.06Å; I343-F347 WeakPolarHBondContact O-CD2 3.37Å; I343-F347 PolarHBondContact O-N 2.81Å; Y344-F347 PolarHBondContact O-N 3.46Å; V345-F347 VanDerWaalsContact C-N 3.33Å; V345-F347 PolarHBondContact O-N 2.88Å; F347-P352 WeakPolarHBondContact O-CD 3.31Å; F347-P352 WeakPolarHBondContact O-CG 3.49Å
348	D	81.7	Confident	83.3	Confident	74 Å²	74	36.7 Å²	36.7	40%	0.396	20%	0.202	S	C	.	.	I	π-helix	trans	-80	-40.3	-179.8	-154	38.4	0	0	0	111.7	Y344 P352	Y344-D348 HydrophobicContact CD1-CB 4.21Å; Y344-D348 HydrophobicContact CE1-CB 3.73Å; Y344-D348 WeakPolarHBondContact CE1-OD2 3.38Å; Y344-D348 WeakPolarHBondContact O-CB 3.33Å; Y344-D348 PolarHBondContact O-N 3.43Å; Y344-D348 PolarHBondContact OH-OD2 3.24Å; D348-P352 WeakPolarHBondContact O-CG 3.36Å
349	D	76	Confident	82.9	Confident	51 Å²	51	39.2 Å²	39.2	27%	0.273	22%	0.215	S	C	.	.	I	π-helix	trans	-118.7	-55.9	-171.2	-70.7	-45.7	0	0	0	114	H244 V345 P352 E353	H244-D349 IonicContact CD2-OD2 3.66Å; H244-D349 VanDerWaalsContact CE1-CB 3.42Å; H244-D349 WeakPolarHBondContact CE1-CB 3.21Å; H244-D349 IonicContact CE1-OD2 3Å; H244-D349 PolarHBondContact CE1-OD2 3.25Å; H244-D349 IonicContact NE2-OD2 2.83Å; H244-D349 PolarHBondContact NE2-OD2 2.98Å; V345-D349 PolarHBondContact O-N 2.73Å; D349-P352 WeakPolarHBondContact O-CD 3.34Å; D349-E353 VanDerWaalsContact O-CB 3.25Å; D349-E353 WeakPolarHBondContact O-CB 3.42Å; D349-E353 PolarHBondContact O-N 2.73Å
350	V	80.1	Confident	82.7	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.055	23%	0.233	C	C	.	.	I	π-helix	trans	-67.2	-48	-165.6	-172.1	0	0	0	0	111.9	L112 A116 M119 V345 V346 A354	L112-V350 HydrophobicContact CB-CG1 4.43Å; L112-V350 WeakPolarHBondContact O-CG1 3.44Å; A116-V350 HydrophobicContact CB-CB 4.32Å; A116-V350 HydrophobicContact CB-CG1 3.75Å; M119-V350 HydrophobicContact SD-CG2 4.22Å; V345-V350 HydrophobicContact CG1-CG2 3.96Å; V345-V350 PolarHBondContact O-N 3.42Å; V346-V350 PolarHBondContact O-N 3.48Å; V350-A354 VanDerWaalsContact O-CB 3.28Å; V350-A354 WeakPolarHBondContact O-CB 3.21Å; V350-A354 PolarHBondContact O-N 3.37Å
351	V	85.4	Confident	82.6	Confident	25 Å²	25	48.7 Å²	48.7	15%	0.152	26%	0.261	C	S	.	.	H	α-helix	trans	-66.8	-49.2	179.1	171.3	0	0	0	0	111.2	A116 V346 E353 A354 Q355 L367	A116-V351 HydrophobicContact CB-CG2 3.78Å; V346-V351 HydrophobicContact CG1-CG2 3.89Å; V346-V351 WeakPolarHBondContact O-CB 3.43Å; V346-V351 WeakPolarHBondContact O-CG2 3.26Å; V346-V351 PolarHBondContact O-N 3.4Å; V351-E353 PolarHBondContact O-N 3.46Å; V351-A354 PolarHBondContact O-N 2.93Å; V351-Q355 WeakPolarHBondContact O-CG 3.4Å; V351-Q355 PolarHBondContact O-N 2.85Å; V351-Q355 VanDerWaalsContact O-N 3.16Å; V351-L367 HydrophobicContact CG2-CD1 3.9Å
352	P	83.6	Confident	82.7	Confident	60 Å²	60	51.9 Å²	51.9	39%	0.39	28%	0.278	S	S	.	.	H	α-helix	trans	-59.4	-42.2	175.4	-29.3	39.7	0	0	0	114.1	F347 D348 D349 Q355 S356	F347-P352 WeakPolarHBondContact O-CD 3.31Å; F347-P352 WeakPolarHBondContact O-CG 3.49Å; D348-P352 WeakPolarHBondContact O-CG 3.36Å; D349-P352 WeakPolarHBondContact O-CD 3.34Å; P352-Q355 CarbonylContact O-C 3.55Å; P352-Q355 PolarHBondContact O-N 2.76Å; P352-S356 PolarHBondContact O-N 3Å
353	E	77.8	Confident	82.8	Confident	49 Å²	49	52 Å²	52	23%	0.229	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-40.7	178.5	-179.9	61.5	-155.8	0	0	111.4	L112 D349 V351 Q355 S356 R357	L112-E353 HydrophobicContact CD1-CB 4.44Å; L112-E353 HydrophobicContact CD1-CG 3.78Å; D349-E353 VanDerWaalsContact O-CB 3.25Å; D349-E353 WeakPolarHBondContact O-CB 3.42Å; D349-E353 PolarHBondContact O-N 2.73Å; V351-E353 PolarHBondContact O-N 3.46Å; E353-Q355 PolarHBondContact O-N 3.15Å; E353-S356 WeakPolarHBondContact O-CB 3.49Å; E353-S356 PolarHBondContact O-N 2.93Å; E353-S356 VanDerWaalsContact O-N 3.16Å; E353-S356 PolarHBondContact O-OG 2.99Å; E353-R357 IonicContact OE1-CZ 2.78Å; E353-R357 IonicContact OE1-NE 3.1Å; E353-R357 IonicContact OE1-NH2 3.62Å; E353-R357 PolarHBondContact OE1-NH2 3.01Å
354	A	81.3	Confident	82.9	Confident	2 Å²	2	53.2 Å²	53.2	2%	0.017	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-28.4	175.6	0	0	0	0	0	112.8	L112 V350 V351 A363	L112-A354 HydrophobicContact CB-CB 3.81Å; V350-A354 VanDerWaalsContact O-CB 3.28Å; V350-A354 WeakPolarHBondContact O-CB 3.21Å; V350-A354 PolarHBondContact O-N 3.37Å; V351-A354 PolarHBondContact O-N 2.93Å; A354-A363 HydrophobicContact CB-CB 4Å
355	Q	85.7	Confident	83.2	Confident	71 Å²	71	59.2 Å²	59.2	33%	0.332	31%	0.307	S	S	.	.	H	α-helix	trans	-95.1	-8.2	178.9	-65.5	-179.9	-4.5	0	0	113.6	V351 P352 E353 R357 G358 N360 A363	V351-Q355 WeakPolarHBondContact O-CG 3.4Å; V351-Q355 PolarHBondContact O-N 2.85Å; V351-Q355 VanDerWaalsContact O-N 3.16Å; P352-Q355 CarbonylContact O-C 3.55Å; P352-Q355 PolarHBondContact O-N 2.76Å; E353-Q355 PolarHBondContact O-N 3.15Å; Q355-R357 PolarHBondContact O-N 2.76Å; Q355-R357 VanDerWaalsContact O-N 3.07Å; Q355-G358 PolarHBondContact O-N 3.46Å; Q355-N360 PolarHBondContact O-OD1 2.94Å; Q355-N360 VanDerWaalsContact O-OD1 3.05Å; Q355-A363 HydrophobicContact CG-CB 4.45Å
356	S	74.9	Confident	83.7	Confident	64 Å²	64	60.4 Å²	60.4	45%	0.448	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.8	-172	69.3	0	0	0	0	114.8	P352 E353	P352-S356 PolarHBondContact O-N 3Å; E353-S356 WeakPolarHBondContact O-CB 3.49Å; E353-S356 PolarHBondContact O-N 2.93Å; E353-S356 VanDerWaalsContact O-N 3.16Å; E353-S356 PolarHBondContact O-OG 2.99Å
357	R	69	Low	84	Confident	80 Å²	80	62.5 Å²	62.5	30%	0.302	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	9.6	-170.5	-52.5	-177.8	-166.9	155.8	-0.1	114.3	V105 I108 D109 E353 Q355	V105-R357 HydrophobicContact CG1-CB 4.13Å; V105-R357 VanDerWaalsContact CG1-CD 3.5Å; V105-R357 HydrophobicContact CG1-CG 4.44Å; I108-R357 VanDerWaalsContact CG2-NH1 3.31Å; D109-R357 WeakPolarHBondContact OD1-CD 3.16Å; D109-R357 IonicContact OD1-CZ 3.53Å; D109-R357 IonicContact OD1-NE 2.99Å; D109-R357 IonicContact OD1-NH1 3.8Å; D109-R357 PolarHBondContact OD1-NH1 3.32Å; D109-R357 VanDerWaalsContact OD1-NH1 3.1Å; E353-R357 IonicContact OE1-CZ 2.78Å; E353-R357 IonicContact OE1-NE 3.1Å; E353-R357 IonicContact OE1-NH2 3.62Å; E353-R357 PolarHBondContact OE1-NH2 3.01Å; Q355-R357 PolarHBondContact O-N 2.76Å; Q355-R357 VanDerWaalsContact O-N 3.07Å
358	G	74.6	Confident	84.4	Confident	61 Å²	61	60 Å²	60	63%	0.629	32%	0.318	S	S	*	.	S	Bend	trans	85.7	-2.7	175.7	0	0	0	0	0	115.6	Q355 N360	Q355-G358 PolarHBondContact O-N 3.46Å; G358-N360 PolarHBondContact O-N 3.41Å
359	N	80.6	Confident	84.9	Confident	54 Å²	54	58.4 Å²	58.4	29%	0.289	32%	0.315	S	S	.	.			trans	-87.4	38.2	177.8	-65	-42.9	0	0	0	113	D109 Q361 I362 A363	D109-N359 HydrophobicContact CB-CB 4.45Å; D109-N359 PolarHBondContact OD2-ND2 2.93Å; N359-Q361 VanDerWaalsContact C-N 3.28Å; N359-Q361 PolarHBondContact O-N 3.06Å; N359-Q361 VanDerWaalsContact O-N 3.15Å; N359-I362 PolarHBondContact O-N 2.72Å; N359-A363 PolarHBondContact O-N 3.07Å; N359-A363 VanDerWaalsContact O-N 3.14Å
360	N	86.3	Confident	85.6	Confident	69 Å²	69	56 Å²	56	37%	0.369	30%	0.302	S	S	.	.	H	α-helix	trans	-55	-41.8	-167.7	-59.3	4.4	0	0	0	112.8	Q355 G358 I362 A363 I364	Q355-N360 PolarHBondContact O-OD1 2.94Å; Q355-N360 VanDerWaalsContact O-OD1 3.05Å; G358-N360 PolarHBondContact O-N 3.41Å; N360-I362 VanDerWaalsContact C-N 3.34Å; N360-I362 PolarHBondContact O-N 2.85Å; N360-A363 PolarHBondContact O-N 2.82Å; N360-I364 WeakPolarHBondContact O-CB 3.45Å; N360-I364 WeakPolarHBondContact O-CD1 3.07Å; N360-I364 WeakPolarHBondContact O-CG1 3.2Å; N360-I364 PolarHBondContact O-N 3.39Å
361	Q	89.6	Confident	86.3	Confident	129 Å²	129	58.7 Å²	58.7	60%	0.603	31%	0.313	S	S	*	.	H	α-helix	trans	-61.6	-42.1	-179.4	-67	-61.8	-27.7	0	0	112.1	N359 I364 W365	N359-Q361 VanDerWaalsContact C-N 3.28Å; N359-Q361 PolarHBondContact O-N 3.06Å; N359-Q361 VanDerWaalsContact O-N 3.15Å; Q361-I364 PolarHBondContact O-N 3.19Å; Q361-W365 PolarHBondContact O-N 3.08Å
362	I	88.2	Confident	86.6	Confident	71 Å²	71	60 Å²	60	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-72.7	-41.5	-176.9	-60.1	175	0	0	0	110	L106 A110 N359 N360 I364 W365 C366	L106-I362 HydrophobicContact CD1-CB 4.26Å; L106-I362 HydrophobicContact CD1-CD1 3.36Å; L106-I362 HydrophobicContact CD1-CG1 4.36Å; L106-I362 HydrophobicContact CD1-CG2 3.85Å; A110-I362 HydrophobicContact CB-CG2 4.19Å; N359-I362 PolarHBondContact O-N 2.72Å; N360-I362 VanDerWaalsContact C-N 3.34Å; N360-I362 PolarHBondContact O-N 2.85Å; I362-I364 VanDerWaalsContact C-N 3.3Å; I362-I364 PolarHBondContact O-N 2.94Å; I362-W365 PolarHBondContact O-N 2.72Å; I362-C366 WeakPolarHBondContact O-CB 3.17Å; I362-C366 PolarHBondContact O-N 3.4Å; I362-C366 PolarHBondContact O-SG 3.45Å
363	A	88	Confident	86.9	Confident	3 Å²	3	60.7 Å²	60.7	3%	0.025	32%	0.323	C	S	.	.	H	α-helix	trans	-56.4	-45.2	173.1	0	0	0	0	0	111.3	A354 Q355 N359 N360 C366 L367	A354-A363 HydrophobicContact CB-CB 4Å; Q355-A363 HydrophobicContact CG-CB 4.45Å; N359-A363 PolarHBondContact O-N 3.07Å; N359-A363 VanDerWaalsContact O-N 3.14Å; N360-A363 PolarHBondContact O-N 2.82Å; A363-C366 PolarHBondContact O-N 3.08Å; A363-L367 WeakPolarHBondContact O-CB 3.25Å; A363-L367 PolarHBondContact O-N 3.16Å
364	I	92.9	Very high	87.3	Confident	64 Å²	64	58.5 Å²	58.5	33%	0.328	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-46.7	178.3	-68.6	163.8	0	0	0	112	N360 Q361 I362 C366 L367 I368	N360-I364 WeakPolarHBondContact O-CB 3.45Å; N360-I364 WeakPolarHBondContact O-CD1 3.07Å; N360-I364 WeakPolarHBondContact O-CG1 3.2Å; N360-I364 PolarHBondContact O-N 3.39Å; Q361-I364 PolarHBondContact O-N 3.19Å; I362-I364 VanDerWaalsContact C-N 3.3Å; I362-I364 PolarHBondContact O-N 2.94Å; I364-C366 VanDerWaalsContact C-N 3.32Å; I364-C366 PolarHBondContact O-N 3.47Å; I364-L367 WeakPolarHBondContact O-CB 3.36Å; I364-L367 PolarHBondContact O-N 3.37Å; I364-I368 HydrophobicContact CG2-CD1 3.98Å; I364-I368 WeakPolarHBondContact O-CG1 3.37Å; I364-I368 PolarHBondContact O-N 2.98Å
365	W	94.4	Very high	87.6	Confident	174 Å²	174	61.7 Å²	61.7	66%	0.659	33%	0.329	S	S	*	.	H	α-helix	trans	-63.8	-38	178.4	-80.1	113.7	0	0	0	112.6	Q361 I362 I368 A369	Q361-W365 PolarHBondContact O-N 3.08Å; I362-W365 PolarHBondContact O-N 2.72Å; W365-I368 HydrophobicContact CE3-CD1 4.35Å; W365-I368 PolarHBondContact O-N 3.33Å; W365-A369 WeakPolarHBondContact O-CB 3.35Å; W365-A369 PolarHBondContact O-N 3.01Å
366	C	92	Very high	87.5	Confident	29 Å²	29	60.5 Å²	60.5	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-68.3	-37.1	175.4	-64	0	0	0	0	111.6	A110 F114 I362 A363 I364 A369 G370	A110-C366 VanDerWaalsContact CB-SG 3.59Å; A110-C366 WeakPolarHBondContact O-CB 3.19Å; F114-C366 WeakPolarHBondContact CA-O 3.48Å; F114-C366 HydrophobicContact CB-CB 4.26Å; I362-C366 WeakPolarHBondContact O-CB 3.17Å; I362-C366 PolarHBondContact O-N 3.4Å; I362-C366 PolarHBondContact O-SG 3.45Å; A363-C366 PolarHBondContact O-N 3.08Å; I364-C366 VanDerWaalsContact C-N 3.32Å; I364-C366 PolarHBondContact O-N 3.47Å; C366-A369 WeakPolarHBondContact O-CB 2.98Å; C366-A369 PolarHBondContact O-N 2.74Å; C366-G370 PolarHBondContact O-N 2.92Å
367	L	93.9	Very high	87.6	Confident	44 Å²	44	59 Å²	59	23%	0.23	31%	0.314	C	S	.	.	H	α-helix	trans	-59.6	-48.9	171.8	-175	161.3	0	0	0	111.8	G113 A116 G117 V351 A363 I364 A369 G370 F371	G113-L367 WeakPolarHBondContact O-CA 3.39Å; G113-L367 VanDerWaalsContact O-CB 3.26Å; G113-L367 WeakPolarHBondContact O-CB 3.27Å; G113-L367 PolarHBondContact O-N 3.42Å; A116-L367 HydrophobicContact CB-CD1 3.92Å; A116-L367 HydrophobicContact CB-CG 4.27Å; G117-L367 VanDerWaalsContact CA-O 3.22Å; G117-L367 WeakPolarHBondContact CA-O 3.38Å; V351-L367 HydrophobicContact CG2-CD1 3.9Å; A363-L367 WeakPolarHBondContact O-CB 3.25Å; A363-L367 PolarHBondContact O-N 3.16Å; I364-L367 WeakPolarHBondContact O-CB 3.36Å; I364-L367 PolarHBondContact O-N 3.37Å; L367-A369 VanDerWaalsContact C-N 3.28Å; L367-A369 PolarHBondContact O-N 3.47Å; L367-G370 PolarHBondContact O-N 2.8Å; L367-F371 WeakPolarHBondContact O-CB 3.33Å; L367-F371 PolarHBondContact O-N 2.84Å
368	I	95.6	Very high	87.8	Confident	77 Å²	77	55.9 Å²	55.9	40%	0.395	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-40.4	176.4	-66.2	167.1	0	0	0	110.8	I364 W365 S372	I364-I368 HydrophobicContact CG2-CD1 3.98Å; I364-I368 WeakPolarHBondContact O-CG1 3.37Å; I364-I368 PolarHBondContact O-N 2.98Å; W365-I368 HydrophobicContact CE3-CD1 4.35Å; W365-I368 PolarHBondContact O-N 3.33Å; I368-S372 WeakPolarHBondContact O-CB 3.33Å; I368-S372 PolarHBondContact O-N 2.86Å; I368-S372 PolarHBondContact O-OG 3.4Å
369	A	93.8	Very high	87.7	Confident	41 Å²	41	56.9 Å²	56.9	34%	0.339	30%	0.297	S	S	.	.	H	α-helix	trans	-63.9	-45.9	177.4	0	0	0	0	0	112.1	W365 C366 L367 S372 I373	W365-A369 WeakPolarHBondContact O-CB 3.35Å; W365-A369 PolarHBondContact O-N 3.01Å; C366-A369 WeakPolarHBondContact O-CB 2.98Å; C366-A369 PolarHBondContact O-N 2.74Å; L367-A369 VanDerWaalsContact C-N 3.28Å; L367-A369 PolarHBondContact O-N 3.47Å; A369-S372 PolarHBondContact O-N 3.47Å; A369-I373 WeakPolarHBondContact O-CB 3.49Å; A369-I373 WeakPolarHBondContact O-CG1 3.28Å; A369-I373 PolarHBondContact O-N 2.81Å
370	G	90.9	Very high	86.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.1	-46.5	176.1	0	0	0	0	0	112.3	C366 L367 S372 I373 M374	C366-G370 PolarHBondContact O-N 2.92Å; L367-G370 PolarHBondContact O-N 2.8Å; G370-S372 PolarHBondContact O-N 3.18Å; G370-I373 PolarHBondContact O-N 3.25Å; G370-M374 WeakPolarHBondContact O-CB 3.5Å; G370-M374 PolarHBondContact O-N 2.65Å
371	F	93.3	Very high	85.3	Confident	66 Å²	66	59.1 Å²	59.1	29%	0.289	31%	0.308	S	S	.	.	H	α-helix	trans	-58.5	-47.4	175.7	-174.2	-84.4	0	0	0	112	G117 T120 A121 W125 L367 I373 M374 M375	G117-F371 VanDerWaalsContact O-CA 3.31Å; G117-F371 WeakPolarHBondContact O-CA 3.42Å; T120-F371 HydrophobicContact CG2-CD2 4.27Å; T120-F371 HydrophobicContact CG2-CE2 4.13Å; A121-F371 HydrophobicContact CB-CD2 3.8Å; A121-F371 HydrophobicContact CB-CE2 4.11Å; A121-F371 HydrophobicContact CB-CG 4.2Å; W125-F371 AromaticContact CH2-CE1 3.85Å; W125-F371 HydrophobicContact CH2-CE1 3.85Å; W125-F371 HydrophobicContact CH2-CE2 4.42Å; W125-F371 AromaticContact CH2-CZ 3.51Å; W125-F371 HydrophobicContact CH2-CZ 3.51Å; W125-F371 AromaticContact CZ3-CE1 3.92Å; W125-F371 HydrophobicContact CZ3-CE1 3.92Å; W125-F371 AromaticContact CZ3-CE2 3.89Å; W125-F371 HydrophobicContact CZ3-CE2 3.89Å; W125-F371 AromaticContact CZ3-CZ 3.4Å; W125-F371 HydrophobicContact CZ3-CZ 3.4Å; W125-F371 VanDerWaalsContact CZ3-CZ 3.4Å; L367-F371 WeakPolarHBondContact O-CB 3.33Å; L367-F371 PolarHBondContact O-N 2.84Å; F371-I373 PolarHBondContact O-N 3.31Å; F371-M374 PolarHBondContact O-N 3.08Å; F371-M375 WeakPolarHBondContact O-CB 3.36Å; F371-M375 PolarHBondContact O-N 3.24Å
372	S	92.6	Very high	83.5	Confident	52 Å²	52	58.5 Å²	58.5	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-65.1	-39.6	-178.3	-58.5	0	0	0	0	112.6	I368 A369 G370 S376	I368-S372 WeakPolarHBondContact O-CB 3.33Å; I368-S372 PolarHBondContact O-N 2.86Å; I368-S372 PolarHBondContact O-OG 3.4Å; A369-S372 PolarHBondContact O-N 3.47Å; G370-S372 PolarHBondContact O-N 3.18Å; S372-S376 WeakPolarHBondContact O-CB 3.49Å; S372-S376 PolarHBondContact O-N 2.97Å; S372-S376 PolarHBondContact O-OG 2.97Å
373	I	89.5	Confident	81.2	Confident	75 Å²	75	61.5 Å²	61.5	39%	0.385	32%	0.316	S	S	.	.	H	α-helix	trans	-66.7	-47.1	177.6	-74.2	163.2	0	0	0	110.2	F114 A369 G370 F371 S376 M377	F114-I373 HydrophobicContact CE2-CD1 3.88Å; F114-I373 HydrophobicContact CZ-CD1 4.41Å; A369-I373 WeakPolarHBondContact O-CB 3.49Å; A369-I373 WeakPolarHBondContact O-CG1 3.28Å; A369-I373 PolarHBondContact O-N 2.81Å; G370-I373 PolarHBondContact O-N 3.25Å; F371-I373 PolarHBondContact O-N 3.31Å; I373-S376 PolarHBondContact O-N 3.43Å; I373-M377 HydrophobicContact CG2-CG 4.49Å; I373-M377 HydrophobicContact CG2-SD 4.01Å; I373-M377 WeakPolarHBondContact O-CG 3.41Å; I373-M377 PolarHBondContact O-N 3.02Å
374	M	86.6	Confident	78.7	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-64.1	-44	179.7	-177.3	58.8	-164.8	0	0	111.8	V118 A121 A122 S126 G370 F371 S376 M377 D378	V118-M374 HydrophobicContact CG1-CB 4.34Å; V118-M374 HydrophobicContact CG1-CG 4.37Å; V118-M374 HydrophobicContact CG1-SD 4.43Å; A121-M374 HydrophobicContact CB-CB 3.64Å; A121-M374 HydrophobicContact CB-CG 3.6Å; A122-M374 HydrophobicContact CB-CE 3.84Å; A122-M374 HydrophobicContact CB-CG 4.36Å; S126-M374 WeakPolarHBondContact OG-CE 3.39Å; G370-M374 WeakPolarHBondContact O-CB 3.5Å; G370-M374 PolarHBondContact O-N 2.65Å; F371-M374 PolarHBondContact O-N 3.08Å; M374-S376 VanDerWaalsContact C-N 3.33Å; M374-S376 PolarHBondContact O-N 3.13Å; M374-M377 WeakPolarHBondContact O-CB 3.15Å; M374-M377 PolarHBondContact O-N 3.38Å; M374-D378 PolarHBondContact O-N 3.43Å
375	M	87	Confident	76	Confident	70 Å²	70	65 Å²	65	35%	0.345	33%	0.334	S	S	.	.	H	α-helix	trans	-57.1	-47	173.2	-175.8	-151.8	78.8	0	0	111.4	W125 F371 M377 D378 V379	W125-M375 HydrophobicContact CH2-CG 4.04Å; W125-M375 HydrophobicContact CZ2-CG 4Å; W125-M375 HydrophobicContact CZ3-CB 4.38Å; W125-M375 HydrophobicContact CZ3-CG 4.35Å; F371-M375 WeakPolarHBondContact O-CB 3.36Å; F371-M375 PolarHBondContact O-N 3.24Å; M375-M377 VanDerWaalsContact C-N 3.32Å; M375-M377 PolarHBondContact O-N 3.32Å; M375-D378 PolarHBondContact O-N 3.24Å; M375-V379 WeakPolarHBondContact O-CG2 3.13Å; M375-V379 PolarHBondContact O-N 3.01Å; M375-V379 VanDerWaalsContact O-N 3.07Å
376	S	84.6	Confident	73	Confident	46 Å²	46	62 Å²	62	32%	0.322	33%	0.33	S	S	.	.	H	α-helix	trans	-63.3	-39.7	179.3	-60	0	0	0	0	111.7	S372 I373 M374 V379 L380	S372-S376 WeakPolarHBondContact O-CB 3.49Å; S372-S376 PolarHBondContact O-N 2.97Å; S372-S376 PolarHBondContact O-OG 2.97Å; I373-S376 PolarHBondContact O-N 3.43Å; M374-S376 VanDerWaalsContact C-N 3.33Å; M374-S376 PolarHBondContact O-N 3.13Å; S376-V379 PolarHBondContact O-N 3.19Å; S376-L380 WeakPolarHBondContact O-CB 3.43Å; S376-L380 WeakPolarHBondContact O-CD1 3.41Å; S376-L380 WeakPolarHBondContact O-CG 3.43Å; S376-L380 PolarHBondContact O-N 3.36Å
377	M	77.1	Confident	70.4	Confident	32 Å²	32	65.4 Å²	65.4	16%	0.158	36%	0.355	C	S	.	.	H	α-helix	trans	-62.1	-46.3	176.4	-77.5	176.3	67.3	0	0	111.7	I275 L279 I373 M374 M375 V379 L381	I275-M377 HydrophobicContact CB-CE 3.79Å; I275-M377 HydrophobicContact CG2-CE 3.28Å; L279-M377 HydrophobicContact CD1-CE 4.09Å; L279-M377 HydrophobicContact CD1-SD 3.61Å; I373-M377 HydrophobicContact CG2-CG 4.49Å; I373-M377 HydrophobicContact CG2-SD 4.01Å; I373-M377 WeakPolarHBondContact O-CG 3.41Å; I373-M377 PolarHBondContact O-N 3.02Å; M374-M377 WeakPolarHBondContact O-CB 3.15Å; M374-M377 PolarHBondContact O-N 3.38Å; M375-M377 VanDerWaalsContact C-N 3.32Å; M375-M377 PolarHBondContact O-N 3.32Å; M377-V379 VanDerWaalsContact C-N 3.34Å; M377-V379 PolarHBondContact O-N 2.84Å; M377-L381 HydrophobicContact CB-CD1 4.25Å; M377-L381 HydrophobicContact CE-CD1 4.39Å; M377-L381 WeakPolarHBondContact O-CB 3.48Å; M377-L381 WeakPolarHBondContact O-CG 3.45Å; M377-L381 PolarHBondContact O-N 3.1Å
378	D	73	Confident	67.4	Low	14 Å²	14	68.1 Å²	68.1	8%	0.075	38%	0.376	C	S	.	.	H	α-helix	trans	-66.9	-34.9	-179.7	-112	7.6	0	0	0	112.5	W125 S126 N272 M374 M375 Y382	W125-D378 VanDerWaalsContact C-OD2 3.32Å; W125-D378 HydrophobicContact CB-CB 4.2Å; W125-D378 WeakPolarHBondContact CB-OD2 3.5Å; S126-D378 PolarHBondContact N-OD2 3.03Å; S126-D378 PolarHBondContact OG-OD2 2.97Å; N272-D378 WeakPolarHBondContact CB-OD1 3.2Å; N272-D378 PolarHBondContact ND2-OD1 3.37Å; N272-D378 VanDerWaalsContact ND2-OD1 3.07Å; M374-D378 PolarHBondContact O-N 3.43Å; M375-D378 PolarHBondContact O-N 3.24Å; D378-Y382 WeakPolarHBondContact O-CB 3.04Å
379	V	71.7	Confident	64.5	Low	82 Å²	82	73.6 Å²	73.6	50%	0.497	39%	0.392	S	S	.	.	H	α-helix	trans	-74.5	-49.7	175.1	176.8	0	0	0	0	112.3	M375 S376 M377 Y382	M375-V379 WeakPolarHBondContact O-CG2 3.13Å; M375-V379 PolarHBondContact O-N 3.01Å; M375-V379 VanDerWaalsContact O-N 3.07Å; S376-V379 PolarHBondContact O-N 3.19Å; M377-V379 VanDerWaalsContact C-N 3.34Å; M377-V379 PolarHBondContact O-N 2.84Å; V379-Y382 PolarHBondContact O-N 2.82Å
380	L	61.7	Low	61.6	Low	127 Å²	127	74 Å²	74	67%	0.665	39%	0.388	S	S	*	.	H	α-helix	trans	-70.6	-35.4	-173.7	-72	165.9	0	0	0	112.5	S376 Y382 M383	S376-L380 WeakPolarHBondContact O-CB 3.43Å; S376-L380 WeakPolarHBondContact O-CD1 3.41Å; S376-L380 WeakPolarHBondContact O-CG 3.43Å; S376-L380 PolarHBondContact O-N 3.36Å; L380-Y382 VanDerWaalsContact C-N 3.35Å; L380-M383 PolarHBondContact O-N 2.79Å
381	L	55.4	Low	59	Low	44 Å²	44	75.6 Å²	75.6	23%	0.23	40%	0.402	C	S	.	.	H	α-helix	trans	-83.7	-10.5	-178.9	-70	160.9	0	0	0	113.1	W45 N272 M377 P384	W45-L381 HydrophobicContact CH2-CD2 3.92Å; N272-L381 WeakPolarHBondContact ND2-CB 3.4Å; N272-L381 WeakPolarHBondContact OD1-CB 3.23Å; N272-L381 VanDerWaalsContact OD1-CD1 3.26Å; N272-L381 WeakPolarHBondContact OD1-CD1 3.34Å; M377-L381 HydrophobicContact CB-CD1 4.25Å; M377-L381 HydrophobicContact CE-CD1 4.39Å; M377-L381 WeakPolarHBondContact O-CB 3.48Å; M377-L381 WeakPolarHBondContact O-CG 3.45Å; M377-L381 PolarHBondContact O-N 3.1Å; L381-P384 WeakPolarHBondContact O-CD 3.15Å
382	Y	51.9	Low	56.3	Low	115 Å²	115	74.8 Å²	74.8	45%	0.451	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-2.1	170.5	-149.2	-98.4	0	0	0	113.3	T266 K269 D378 V379 L380 P384	T266-Y382 HydrophobicContact CG2-CE2 4.49Å; K269-Y382 HydrophobicContact CD-CE2 4.15Å; K269-Y382 VanDerWaalsContact CE-CE2 3.47Å; K269-Y382 HydrophobicContact CG-CD2 4.14Å; K269-Y382 HydrophobicContact CG-CE2 3.79Å; D378-Y382 WeakPolarHBondContact O-CB 3.04Å; V379-Y382 PolarHBondContact O-N 2.82Å; L380-Y382 VanDerWaalsContact C-N 3.35Å; Y382-P384 WeakPolarHBondContact O-CD 3.41Å
383	M	38.7	Very low	53.9	Low	135 Å²	135	73.8 Å²	73.8	67%	0.665	40%	0.395	S	S	*	.			trans	-92.5	34.6	175.7	-74.6	-81.3	173.1	0	0	117	L380	L380-M383 PolarHBondContact O-N 2.79Å
384	P	36.6	Very low	51.8	Low	50 Å²	50	75.7 Å²	75.7	33%	0.325	40%	0.401	S	S	.	.	S	Bend	trans	-96.2	18.7	-176.9	38.7	-32.5	0	0	0	115.1	E268 L381 Y382	E268-P384 HydrophobicContact CG-CG 4.34Å; L381-P384 WeakPolarHBondContact O-CD 3.15Å; Y382-P384 WeakPolarHBondContact O-CD 3.41Å
385	Q	35.5	Very low	49.9	Very low	89 Å²	89	80.4 Å²	80.4	42%	0.416	42%	0.419	S	S	.	.			trans	-134.1	5.8	-173.7	-73.2	155.7	27.6	0	0	115.8	S387 C388 R389	Q385-S387 PolarHBondContact O-N 2.8Å; Q385-S387 VanDerWaalsContact O-N 3.08Å; Q385-C388 PolarHBondContact O-N 3.16Å; Q385-R389 PolarHBondContact O-N 3.44Å
386	L	31.9	Very low	48.3	Very low	111 Å²	111	85.3 Å²	85.3	58%	0.581	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.3	178.4	-142	82.1	0	0	0	113.2	L390	L386-L390 HydrophobicContact CB-CD1 4.28Å; L386-L390 HydrophobicContact CD1-CD1 3.56Å; L386-L390 HydrophobicContact CD1-CD2 4.27Å; L386-L390 HydrophobicContact CD2-CD2 4.35Å; L386-L390 HydrophobicContact CG-CD1 3.57Å; L386-L390 HydrophobicContact CG-CD2 3.9Å; L386-L390 HydrophobicContact CG-CG 4.35Å; L386-L390 WeakPolarHBondContact O-CD1 3.39Å
387	S	36.6	Very low	47.1	Very low	101 Å²	101	89.1 Å²	89.1	71%	0.706	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-19.8	-176.7	-47.5	0	0	0	0	115.2	Q385	Q385-S387 PolarHBondContact O-N 2.8Å; Q385-S387 VanDerWaalsContact O-N 3.08Å
388	C	31.9	Very low	46.7	Very low	101 Å²	101	90.6 Å²	90.6	68%	0.682	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.9	-20.9	-177	-73	0	0	0	0	115	Q385	Q385-C388 PolarHBondContact O-N 3.16Å
389	R	34.1	Very low	47	Very low	192 Å²	192	93.5 Å²	93.5	73%	0.725	48%	0.481	S	S	*	.	S	Bend	trans	-88.3	-14.8	172.8	-83.2	-178.6	178.3	167.9	-3.4	113.9	Q385	Q385-R389 PolarHBondContact O-N 3.44Å
390	L	32.9	Very low	47.5	Very low	49 Å²	49	98 Å²	98	26%	0.257	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	2.1	175.2	-83.2	81	0	0	0	114.8	L386 C392 F619	L386-L390 HydrophobicContact CB-CD1 4.28Å; L386-L390 HydrophobicContact CD1-CD1 3.56Å; L386-L390 HydrophobicContact CD1-CD2 4.27Å; L386-L390 HydrophobicContact CD2-CD2 4.35Å; L386-L390 HydrophobicContact CG-CD1 3.57Å; L386-L390 HydrophobicContact CG-CD2 3.9Å; L386-L390 HydrophobicContact CG-CG 4.35Å; L386-L390 WeakPolarHBondContact O-CD1 3.39Å; L390-C392 PolarHBondContact O-N 3.37Å; L390-F619 HydrophobicContact CB-CE2 4.42Å; L390-F619 HydrophobicContact CD1-CE2 4.01Å; L390-F619 HydrophobicContact CD2-CD2 3.84Å; L390-F619 HydrophobicContact CD2-CE1 4.01Å; L390-F619 HydrophobicContact CD2-CE2 3.14Å; L390-F619 HydrophobicContact CD2-CZ 3.22Å; L390-F619 HydrophobicContact CG-CD2 3.74Å; L390-F619 HydrophobicContact CG-CE2 3.23Å; L390-F619 HydrophobicContact CG-CZ 3.89Å
391	A	36.3	Very low	48.6	Very low	35 Å²	35	95.1 Å²	95.1	29%	0.289	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-8.6	174.8	0	0	0	0	0	112.8
392	C	36.6	Very low	49.9	Very low	48 Å²	48	97.1 Å²	97.1	32%	0.324	49%	0.489	S	S	.	.			trans	-99.2	93.8	179.2	-64.1	0	0	0	0	108.3	L390	L390-C392 PolarHBondContact O-N 3.37Å
393	T	42.3	Very low	51.3	Low	31 Å²	31	93.6 Å²	93.6	19%	0.19	48%	0.478	C	S	.	.	S	Bend	trans	162	157.2	135.4	44.9	0	0	0	0	110.7	Y395 E617 T618 F619	T393-Y395 PolarHBondContact O-N 2.82Å; T393-E617 HydrophobicContact CG2-CB 4.26Å; T393-E617 WeakPolarHBondContact CG2-O 3.49Å; T393-T618 VanDerWaalsContact CG2-C 3.49Å; T393-T618 VanDerWaalsContact OG1-C 3.25Å; T393-F619 WeakPolarHBondContact OG1-CA 3.27Å; T393-F619 VanDerWaalsContact OG1-CB 3.25Å; T393-F619 WeakPolarHBondContact OG1-CB 3.24Å; T393-F619 PolarHBondContact OG1-N 2.86Å
394	F	45.6	Very low	53.5	Low	116 Å²	116	91.8 Å²	91.8	51%	0.509	47%	0.468	S	S	.	.			trans	-78.7	114.1	-158	-151.2	-102.7	0	0	0	110.9	K396	F394-K396 HydrophobicContact CD1-CB 4.14Å; F394-K396 HydrophobicContact CD1-CD 3.96Å; F394-K396 HydrophobicContact CD1-CG 3.65Å; F394-K396 HydrophobicContact CE1-CD 4.11Å; F394-K396 HydrophobicContact CE1-CG 3.77Å; F394-K396 PolarHBondContact O-N 2.85Å
395	Y	46.7	Very low	55.8	Low	100 Å²	100	97.5 Å²	97.5	39%	0.392	48%	0.483	S	S	.	.			trans	-73.4	60.1	169.2	-69.6	-82.4	0	0	0	112.1	T393 N397 F398 W442	T393-Y395 PolarHBondContact O-N 2.82Å; Y395-N397 PolarHBondContact O-N 3.38Å; Y395-N397 VanDerWaalsContact O-N 3.1Å; Y395-F398 VanDerWaalsContact CB-CD2 3.43Å; Y395-F398 HydrophobicContact CD1-CD1 4.28Å; Y395-F398 AromaticContact CD1-CD2 3.09Å; Y395-F398 HydrophobicContact CD1-CD2 3.09Å; Y395-F398 HydrophobicContact CD1-CE1 4.15Å; Y395-F398 AromaticContact CD1-CE2 2.96Å; Y395-F398 HydrophobicContact CD1-CE2 2.96Å; Y395-F398 AromaticContact CD1-CG 3.78Å; Y395-F398 HydrophobicContact CD1-CG 3.78Å; Y395-F398 AromaticContact CD1-CZ 3.51Å; Y395-F398 HydrophobicContact CD1-CZ 3.51Å; Y395-F398 AromaticContact CD2-CD2 3.91Å; Y395-F398 HydrophobicContact CD2-CD2 3.91Å; Y395-F398 AromaticContact CD2-CE2 3.79Å; Y395-F398 HydrophobicContact CD2-CE2 3.79Å; Y395-F398 AromaticContact CE1-CD2 3.66Å; Y395-F398 HydrophobicContact CE1-CD2 3.66Å; Y395-F398 HydrophobicContact CE1-CE1 4.1Å; Y395-F398 AromaticContact CE1-CE2 2.94Å; Y395-F398 HydrophobicContact CE1-CE2 2.94Å; Y395-F398 HydrophobicContact CE1-CG 4.47Å; Y395-F398 AromaticContact CE1-CZ 3.18Å; Y395-F398 HydrophobicContact CE1-CZ 3.18Å; Y395-F398 HydrophobicContact CE2-CD2 4.35Å; Y395-F398 AromaticContact CE2-CE2 3.76Å; Y395-F398 HydrophobicContact CE2-CE2 3.76Å; Y395-F398 AromaticContact CG-CD2 3.2Å; Y395-F398 HydrophobicContact CG-CD2 3.2Å; Y395-F398 AromaticContact CG-CE2 3.37Å; Y395-F398 HydrophobicContact CG-CE2 3.37Å; Y395-F398 HydrophobicContact CG-CG 4.11Å; Y395-F398 HydrophobicContact CG-CZ 4.34Å; Y395-F398 AromaticContact CZ-CE2 3.32Å; Y395-F398 AromaticContact CZ-CZ 3.79Å; Y395-F398 PolarHBondContact O-N 2.91Å; Y395-W442 AromaticContact CD2-CH2 3.82Å; Y395-W442 HydrophobicContact CD2-CH2 3.82Å; Y395-W442 AromaticContact CD2-CZ2 3.25Å; Y395-W442 HydrophobicContact CD2-CZ2 3.25Å; Y395-W442 AromaticContact CE2-CE2 3.76Å; Y395-W442 HydrophobicContact CE2-CH2 4.37Å; Y395-W442 AromaticContact CE2-CZ2 3.39Å; Y395-W442 HydrophobicContact CE2-CZ2 3.39Å; Y395-W442 AromaticContact CE2-NE1 3.75Å; Y395-W442 HydrophobicContact CG-CH2 4.5Å; Y395-W442 HydrophobicContact CG-CZ2 4.24Å
396	K	53.5	Low	57.9	Low	173 Å²	173	94.2 Å²	94.2	75%	0.752	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-19	161.5	-109.1	168.8	-176.1	-171.6	0	111.6	F394	F394-K396 HydrophobicContact CD1-CB 4.14Å; F394-K396 HydrophobicContact CD1-CD 3.96Å; F394-K396 HydrophobicContact CD1-CG 3.65Å; F394-K396 HydrophobicContact CE1-CD 4.11Å; F394-K396 HydrophobicContact CE1-CG 3.77Å; F394-K396 PolarHBondContact O-N 2.85Å
397	N	59	Low	60.4	Low	126 Å²	126	90.1 Å²	90.1	67%	0.674	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-9.6	-175.1	-60.1	-6.2	0	0	0	114.6	Y395	Y395-N397 PolarHBondContact O-N 3.38Å; Y395-N397 VanDerWaalsContact O-N 3.1Å
398	F	69.7	Low	62.5	Low	64 Å²	64	89.6 Å²	89.6	28%	0.281	43%	0.431	S	S	.	.	S	Bend	trans	-76.3	131.2	174.4	-83.3	-41.1	0	0	0	110.7	Y395 K400 Y402 I403	Y395-F398 VanDerWaalsContact CB-CD2 3.43Å; Y395-F398 HydrophobicContact CD1-CD1 4.28Å; Y395-F398 AromaticContact CD1-CD2 3.09Å; Y395-F398 HydrophobicContact CD1-CD2 3.09Å; Y395-F398 HydrophobicContact CD1-CE1 4.15Å; Y395-F398 AromaticContact CD1-CE2 2.96Å; Y395-F398 HydrophobicContact CD1-CE2 2.96Å; Y395-F398 AromaticContact CD1-CG 3.78Å; Y395-F398 HydrophobicContact CD1-CG 3.78Å; Y395-F398 AromaticContact CD1-CZ 3.51Å; Y395-F398 HydrophobicContact CD1-CZ 3.51Å; Y395-F398 AromaticContact CD2-CD2 3.91Å; Y395-F398 HydrophobicContact CD2-CD2 3.91Å; Y395-F398 AromaticContact CD2-CE2 3.79Å; Y395-F398 HydrophobicContact CD2-CE2 3.79Å; Y395-F398 AromaticContact CE1-CD2 3.66Å; Y395-F398 HydrophobicContact CE1-CD2 3.66Å; Y395-F398 HydrophobicContact CE1-CE1 4.1Å; Y395-F398 AromaticContact CE1-CE2 2.94Å; Y395-F398 HydrophobicContact CE1-CE2 2.94Å; Y395-F398 HydrophobicContact CE1-CG 4.47Å; Y395-F398 AromaticContact CE1-CZ 3.18Å; Y395-F398 HydrophobicContact CE1-CZ 3.18Å; Y395-F398 HydrophobicContact CE2-CD2 4.35Å; Y395-F398 AromaticContact CE2-CE2 3.76Å; Y395-F398 HydrophobicContact CE2-CE2 3.76Å; Y395-F398 AromaticContact CG-CD2 3.2Å; Y395-F398 HydrophobicContact CG-CD2 3.2Å; Y395-F398 AromaticContact CG-CE2 3.37Å; Y395-F398 HydrophobicContact CG-CE2 3.37Å; Y395-F398 HydrophobicContact CG-CG 4.11Å; Y395-F398 HydrophobicContact CG-CZ 4.34Å; Y395-F398 AromaticContact CZ-CE2 3.32Å; Y395-F398 AromaticContact CZ-CZ 3.79Å; Y395-F398 PolarHBondContact O-N 2.91Å; F398-K400 PolarHBondContact O-N 3.13Å; F398-Y402 HydrophobicContact CB-CD1 4.34Å; F398-Y402 HydrophobicContact CD1-CD1 4.05Å; F398-Y402 HydrophobicContact CD1-CE1 4.35Å; F398-Y402 HydrophobicContact CD2-CD1 4.26Å; F398-Y402 HydrophobicContact CD2-CE1 4.29Å; F398-Y402 HydrophobicContact CE1-CD1 4.46Å; F398-Y402 HydrophobicContact CE1-CE1 4.32Å; F398-Y402 HydrophobicContact CE2-CE1 4.21Å; F398-Y402 AromaticContact CG-CD1 4Å; F398-Y402 HydrophobicContact CG-CD1 4Å; F398-Y402 HydrophobicContact CG-CE1 4.39Å; F398-Y402 HydrophobicContact CZ-CE1 4.27Å; F398-I403 HydrophobicContact CB-CD1 4.24Å; F398-I403 HydrophobicContact CB-CG1 4.17Å
399	P	78.7	Confident	64.3	Low	75 Å²	75	86.2 Å²	86.2	49%	0.487	41%	0.408	S	S	.	.			trans	-54.8	135.6	173.1	-24.6	33.4	0	0	0	110.4	S401 Y402 I403	P399-S401 PolarHBondContact O-N 3.09Å; P399-S401 VanDerWaalsContact O-N 3.08Å; P399-Y402 WeakPolarHBondContact O-CB 3.33Å; P399-Y402 PolarHBondContact O-N 3.35Å; P399-I403 PolarHBondContact O-N 2.73Å
400	K	81.6	Confident	65.3	Low	175 Å²	175	84.1 Å²	84.1	76%	0.761	41%	0.409	S	S	*	.	H	α-helix	trans	-50.4	-37.1	174.8	-71.8	-179.5	174.6	177.8	0	111.6	F398 Y402 I403 E404	F398-K400 PolarHBondContact O-N 3.13Å; K400-Y402 VanDerWaalsContact C-N 3.33Å; K400-Y402 PolarHBondContact O-N 3.49Å; K400-I403 PolarHBondContact O-N 3.19Å; K400-E404 WeakPolarHBondContact O-CG 3.32Å; K400-E404 PolarHBondContact O-N 2.68Å
401	S	84.1	Confident	66.3	Low	67 Å²	67	84 Å²	84	47%	0.469	41%	0.412	S	S	.	.	H	α-helix	trans	-61.2	-34	176.3	62.5	0	0	0	0	114	P399 R405	P399-S401 PolarHBondContact O-N 3.09Å; P399-S401 VanDerWaalsContact O-N 3.08Å; S401-R405 VanDerWaalsContact O-CB 3.22Å; S401-R405 WeakPolarHBondContact O-CB 3.45Å; S401-R405 PolarHBondContact O-N 3.08Å
402	Y	83.5	Confident	67.2	Low	87 Å²	87	87.6 Å²	87.6	34%	0.341	42%	0.421	S	S	.	.	H	α-helix	trans	-71	-43.9	175.2	176.4	-98	0	0	0	111.2	F398 P399 K400 R405 T406	F398-Y402 HydrophobicContact CB-CD1 4.34Å; F398-Y402 HydrophobicContact CD1-CD1 4.05Å; F398-Y402 HydrophobicContact CD1-CE1 4.35Å; F398-Y402 HydrophobicContact CD2-CD1 4.26Å; F398-Y402 HydrophobicContact CD2-CE1 4.29Å; F398-Y402 HydrophobicContact CE1-CD1 4.46Å; F398-Y402 HydrophobicContact CE1-CE1 4.32Å; F398-Y402 HydrophobicContact CE2-CE1 4.21Å; F398-Y402 AromaticContact CG-CD1 4Å; F398-Y402 HydrophobicContact CG-CD1 4Å; F398-Y402 HydrophobicContact CG-CE1 4.39Å; F398-Y402 HydrophobicContact CZ-CE1 4.27Å; P399-Y402 WeakPolarHBondContact O-CB 3.33Å; P399-Y402 PolarHBondContact O-N 3.35Å; K400-Y402 VanDerWaalsContact C-N 3.33Å; K400-Y402 PolarHBondContact O-N 3.49Å; Y402-R405 PolarHBondContact O-N 3.17Å; Y402-T406 WeakPolarHBondContact O-CB 3.42Å; Y402-T406 PolarHBondContact O-N 2.82Å; Y402-T406 PolarHBondContact O-OG1 3.09Å
403	I	81.1	Confident	67.9	Low	40 Å²	40	91.9 Å²	91.9	21%	0.205	43%	0.434	C	S	.	.	H	α-helix	trans	-62.5	-46.6	178.7	-61.8	172.5	0	0	0	110.1	F398 P399 K400 R405 T406 K407 W442	F398-I403 HydrophobicContact CB-CD1 4.24Å; F398-I403 HydrophobicContact CB-CG1 4.17Å; P399-I403 PolarHBondContact O-N 2.73Å; K400-I403 PolarHBondContact O-N 3.19Å; I403-R405 PolarHBondContact O-N 2.86Å; I403-T406 PolarHBondContact O-N 3.34Å; I403-K407 HydrophobicContact CG2-CD 4.48Å; I403-K407 WeakPolarHBondContact O-CG 3.41Å; I403-K407 PolarHBondContact O-N 2.88Å; I403-W442 HydrophobicContact CG1-CZ3 4.37Å
404	E	84.9	Confident	68.3	Low	98 Å²	98	94.1 Å²	94.1	46%	0.458	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176.4	-73.3	175.1	-175.7	0	0	112.2	K400 T406 K407 K408 P431	K400-E404 WeakPolarHBondContact O-CG 3.32Å; K400-E404 PolarHBondContact O-N 2.68Å; E404-T406 VanDerWaalsContact C-N 3.28Å; E404-T406 PolarHBondContact O-N 3.36Å; E404-K407 PolarHBondContact O-N 3.28Å; E404-K408 WeakPolarHBondContact O-CG 3.27Å; E404-K408 PolarHBondContact O-N 3.49Å; E404-K408 VanDerWaalsContact O-N 3.15Å; E404-P431 HydrophobicContact CB-CG 4.48Å
405	R	84.2	Confident	68.7	Low	169 Å²	169	95.6 Å²	95.6	64%	0.638	45%	0.454	S	S	*	.	H	α-helix	trans	-61.8	-36.9	175.7	-170.6	-172.1	-45.1	-177.6	5.3	112.3	S401 Y402 I403 K408	S401-R405 VanDerWaalsContact O-CB 3.22Å; S401-R405 WeakPolarHBondContact O-CB 3.45Å; S401-R405 PolarHBondContact O-N 3.08Å; Y402-R405 PolarHBondContact O-N 3.17Å; I403-R405 PolarHBondContact O-N 2.86Å; R405-K408 WeakPolarHBondContact O-CB 3.16Å; R405-K408 PolarHBondContact O-N 3.41Å
406	T	80.7	Confident	69.1	Low	21 Å²	21	92.3 Å²	92.3	13%	0.129	45%	0.45	C	S	.	.	H	α-helix	trans	-71.8	-35.2	179.4	-56.4	0	0	0	0	112	Y402 I403 E404 K408 P441 W442	Y402-T406 WeakPolarHBondContact O-CB 3.42Å; Y402-T406 PolarHBondContact O-N 2.82Å; Y402-T406 PolarHBondContact O-OG1 3.09Å; I403-T406 PolarHBondContact O-N 3.34Å; E404-T406 VanDerWaalsContact C-N 3.28Å; E404-T406 PolarHBondContact O-N 3.36Å; T406-K408 VanDerWaalsContact C-N 3.29Å; T406-P441 VanDerWaalsContact CG2-C 3.45Å; T406-P441 HydrophobicContact CG2-CB 4Å; T406-P441 WeakPolarHBondContact CG2-O 3.46Å; T406-W442 VanDerWaalsContact CG2-CA 3.41Å; T406-W442 HydrophobicContact CG2-CB 3.74Å
407	K	84.5	Confident	69.3	Low	24 Å²	24	91.3 Å²	91.3	10%	0.104	45%	0.453	C	S	.	.	H	α-helix	trans	-65.7	-35.1	174.4	-70.4	171.3	179.1	174.6	0	111.7	I403 E404 T409 R429 P431 Y434 Y436 P441	I403-K407 HydrophobicContact CG2-CD 4.48Å; I403-K407 WeakPolarHBondContact O-CG 3.41Å; I403-K407 PolarHBondContact O-N 2.88Å; E404-K407 PolarHBondContact O-N 3.28Å; K407-T409 PolarHBondContact O-N 2.97Å; K407-R429 WeakPolarHBondContact O-CD 3.44Å; K407-R429 PolarHBondContact O-NH1 3.37Å; K407-P431 HydrophobicContact CB-CB 4.41Å; K407-P431 HydrophobicContact CD-CB 4.3Å; K407-Y434 HydrophobicContact CB-CD2 4.08Å; K407-Y434 HydrophobicContact CB-CG 4.17Å; K407-Y434 HydrophobicContact CD-CG 4.33Å; K407-Y434 HydrophobicContact CG-CD1 4.25Å; K407-Y434 HydrophobicContact CG-CD2 3.97Å; K407-Y434 HydrophobicContact CG-CG 3.81Å; K407-Y436 VanDerWaalsContact CE-OH 3.24Å; K407-Y436 WeakPolarHBondContact CE-OH 3.4Å; K407-Y436 PolarHBondContact NZ-OH 2.98Å; K407-P441 HydrophobicContact CG-CB 4.15Å; K407-P441 HydrophobicContact CG-CG 4.21Å
408	K	79.6	Confident	69.2	Low	90 Å²	90	94.8 Å²	94.8	39%	0.391	46%	0.457	S	S	.	.	S	Bend	trans	-67	124.9	171.5	-66.4	179.1	-179.7	-171.6	0	109.5	E404 R405 T406 R429 P431	E404-K408 WeakPolarHBondContact O-CG 3.27Å; E404-K408 PolarHBondContact O-N 3.49Å; E404-K408 VanDerWaalsContact O-N 3.15Å; R405-K408 WeakPolarHBondContact O-CB 3.16Å; R405-K408 PolarHBondContact O-N 3.41Å; T406-K408 VanDerWaalsContact C-N 3.29Å; K408-R429 WeakPolarHBondContact CA-O 3.21Å; K408-P431 HydrophobicContact CD-CG 4.31Å; K408-P431 HydrophobicContact CG-CG 3.86Å
409	T	69.8	Low	68.9	Low	31 Å²	31	101.9 Å²	101.9	19%	0.19	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-77.9	138.9	175	-35.7	0	0	0	0	109.8	K407 R429	K407-T409 PolarHBondContact O-N 2.97Å; T409-R429 WeakPolarHBondContact OG1-CB 3.13Å; T409-R429 PolarHBondContact OG1-NE 2.83Å; T409-R429 PolarHBondContact OG1-NH1 3.3Å; T409-R429 VanDerWaalsContact OG1-NH1 3.13Å; T409-R429 PolarHBondContact OG1-NH2 3.45Å; T409-R429 VanDerWaalsContact OG1-NH2 3.08Å
410	I	57.1	Low	68.4	Low	147 Å²	147	101.9 Å²	101.9	75%	0.754	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-61.7	129.4	167	-58.7	172.4	0	0	0	107.5	K412	I410-K412 PolarHBondContact O-N 3.11Å; I410-K412 VanDerWaalsContact O-N 3.09Å
411	P	53.1	Low	67.6	Low	47 Å²	47	95.9 Å²	95.9	31%	0.305	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-55	117.8	-174.4	22.1	-35.1	0	0	0	111.3	K413 V414 V425	P411-K413 PolarHBondContact O-N 3.03Å; P411-V414 HydrophobicContact CG-CG2 4.5Å; P411-V425 HydrophobicContact CB-CB 4.23Å; P411-V425 HydrophobicContact CB-CG1 3.65Å; P411-V425 HydrophobicContact CB-CG2 3.76Å; P411-V425 HydrophobicContact CG-CG2 4.22Å
412	K	54.5	Low	66.8	Low	110 Å²	110	98 Å²	98	48%	0.478	50%	0.497	S	S	.	.	S	Bend	trans	-77.1	121.2	170.8	-76.5	-178.1	-179	171.9	0	108.2	I410 D451	I410-K412 PolarHBondContact O-N 3.11Å; I410-K412 VanDerWaalsContact O-N 3.09Å; K412-D451 IonicContact NZ-OD1 3.14Å; K412-D451 IonicContact NZ-OD2 2.68Å; K412-D451 PolarHBondContact NZ-OD2 3.46Å
413	K	52.4	Low	66	Low	138 Å²	138	98.3 Å²	98.3	60%	0.6	51%	0.505	S	S	*	.			trans	71	99.8	-171.1	-76	-179.9	177.6	173	0	114.9	P411 F415	P411-K413 PolarHBondContact O-N 3.03Å; K413-F415 HydrophobicContact CD-CE2 4.11Å; K413-F415 HydrophobicContact CD-CZ 4.44Å
414	V	50.7	Low	65.1	Low	78 Å²	78	102.2 Å²	102.2	47%	0.473	53%	0.525	S	S	.	.			trans	-91.2	102.7	158.4	179.2	0	0	0	0	107.1	P411 G416 N423	P411-V414 HydrophobicContact CG-CG2 4.5Å; V414-G416 PolarHBondContact O-N 3.28Å; V414-G416 VanDerWaalsContact O-N 3.14Å; V414-N423 HydrophobicContact CG1-CB 3.86Å; V414-N423 WeakPolarHBondContact CG1-OD1 3.46Å
415	F	53.6	Low	64	Low	148 Å²	148	100.6 Å²	100.6	65%	0.649	52%	0.521	S	S	*	.	B	Isolated β-bridge	trans	-77.9	83.8	156.4	-72.7	-78.5	0	0	0	106.4	K413	K413-F415 HydrophobicContact CD-CE2 4.11Å; K413-F415 HydrophobicContact CD-CZ 4.44Å
416	G	55.9	Low	63.1	Low	31 Å²	31	98.6 Å²	98.6	32%	0.32	52%	0.519	S	S	.	.			trans	-113.8	154	-175.5	0	0	0	0	0	112.7	V414 N423	V414-G416 PolarHBondContact O-N 3.28Å; V414-G416 VanDerWaalsContact O-N 3.14Å; G416-N423 VanDerWaalsContact CA-OD1 3.29Å; G416-N423 WeakPolarHBondContact CA-OD1 3.1Å
417	N	56.7	Low	62.5	Low	151 Å²	151	101 Å²	101	81%	0.807	53%	0.526	S	S	*	.			trans	65.1	31.6	175.4	-77.1	5	0	0	0	117.8
418	R	57	Low	61.9	Low	199 Å²	199	104.7 Å²	104.7	75%	0.751	54%	0.544	S	S	*	.	S	Bend	trans	-97.9	118.7	154	-68.1	-171.9	-156.4	-164.4	5.3	109.1	G420 A421	R418-G420 PolarHBondContact O-N 2.79Å; R418-A421 WeakPolarHBondContact O-CB 3.44Å; R418-A421 PolarHBondContact O-N 2.66Å
419	F	63.7	Low	61.8	Low	213 Å²	213	100.7 Å²	100.7	93%	0.934	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	29.7	171	-60	-78.5	0	0	0	117.3	A421	F419-A421 PolarHBondContact O-N 3.44Å
420	G	68.7	Low	62.4	Low	75 Å²	75	105.1 Å²	105.1	77%	0.773	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	12	-180	0	0	0	0	0	114.1	R418	R418-G420 PolarHBondContact O-N 2.79Å
421	A	64.2	Low	63.5	Low	50 Å²	50	99.3 Å²	99.3	41%	0.413	52%	0.515	S	S	.	.			trans	-67.1	135.7	173.8	0	0	0	0	0	110.2	R418 F419	R418-A421 WeakPolarHBondContact O-CB 3.44Å; R418-A421 PolarHBondContact O-N 2.66Å; F419-A421 PolarHBondContact O-N 3.44Å
422	P	66.2	Low	64.8	Low	111 Å²	111	104.1 Å²	104.1	72%	0.721	53%	0.533	S	S	*	.			trans	-61.7	153.1	174.3	26.5	-33.5	0	0	0	110.4	I424	P422-I424 PolarHBondContact O-N 2.75Å; P422-I424 VanDerWaalsContact O-N 3.09Å
423	N	67	Low	66	Low	94 Å²	94	100.2 Å²	100.2	50%	0.503	52%	0.518	S	S	.	.			trans	-60	115.4	179.5	-67.1	-30.1	0	0	0	110.4	V414 G416 V425	V414-N423 HydrophobicContact CG1-CB 3.86Å; V414-N423 WeakPolarHBondContact CG1-OD1 3.46Å; G416-N423 VanDerWaalsContact CA-OD1 3.29Å; G416-N423 WeakPolarHBondContact CA-OD1 3.1Å; N423-V425 PolarHBondContact O-N 3.49Å
424	I	63	Low	67.5	Low	122 Å²	122	94.4 Å²	94.4	63%	0.626	49%	0.492	S	S	*	.	B	Isolated β-bridge	trans	-78.1	114.7	173.8	-57	173.1	0	0	0	108.1	P422	P422-I424 PolarHBondContact O-N 2.75Å; P422-I424 VanDerWaalsContact O-N 3.09Å
425	V	62.6	Low	69.1	Low	64 Å²	64	92.6 Å²	92.6	39%	0.388	48%	0.481	S	S	.	.			trans	-89.4	118.2	173.7	176.3	0	0	0	0	108.9	P411 N423 Y427 E428	P411-V425 HydrophobicContact CB-CB 4.23Å; P411-V425 HydrophobicContact CB-CG1 3.65Å; P411-V425 HydrophobicContact CB-CG2 3.76Å; P411-V425 HydrophobicContact CG-CG2 4.22Å; N423-V425 PolarHBondContact O-N 3.49Å; V425-Y427 VanDerWaalsContact C-N 3.34Å; V425-Y427 PolarHBondContact O-N 3.31Å; V425-E428 HydrophobicContact CG1-CB 4.14Å
426	E	64.1	Low	70.6	Confident	127 Å²	127	87.9 Å²	87.9	59%	0.593	46%	0.459	S	S	*	.	S	Bend	trans	-66.5	-36.4	-179.8	-170.6	-176.3	158.9	0	0	112.2
427	Y	68.6	Low	71.9	Confident	70 Å²	70	87.8 Å²	87.8	28%	0.275	45%	0.452	S	S	.	.			trans	-165	130.9	176.4	172.4	-100.2	0	0	0	109.8	V425 R429 D454	V425-Y427 VanDerWaalsContact C-N 3.34Å; V425-Y427 PolarHBondContact O-N 3.31Å; Y427-R429 HydrophobicContact CE1-CB 4.09Å; Y427-D454 HydrophobicContact CE1-CB 4.29Å
428	E	71.5	Confident	73.1	Confident	103 Å²	103	82.2 Å²	82.2	48%	0.481	42%	0.421	S	S	.	.			trans	-114.5	127.4	168.1	-172.6	-178	170.6	0	0	108.8	V425 K430	V425-E428 HydrophobicContact CG1-CB 4.14Å; E428-K430 PolarHBondContact O-N 2.57Å
429	R	78	Confident	74.3	Confident	5 Å²	5	73.5 Å²	73.5	2%	0.019	39%	0.389	C	S	.	.			trans	-73.3	119.3	173.8	-170.6	-168.8	-52	136.7	1.6	109.1	K407 K408 T409 Y427 D433 Q450 D451 D454	K407-R429 WeakPolarHBondContact O-CD 3.44Å; K407-R429 PolarHBondContact O-NH1 3.37Å; K408-R429 WeakPolarHBondContact CA-O 3.21Å; T409-R429 WeakPolarHBondContact OG1-CB 3.13Å; T409-R429 PolarHBondContact OG1-NE 2.83Å; T409-R429 PolarHBondContact OG1-NH1 3.3Å; T409-R429 VanDerWaalsContact OG1-NH1 3.13Å; T409-R429 PolarHBondContact OG1-NH2 3.45Å; T409-R429 VanDerWaalsContact OG1-NH2 3.08Å; Y427-R429 HydrophobicContact CE1-CB 4.09Å; R429-D433 HydrophobicContact CG-CB 4.06Å; R429-Q450 VanDerWaalsContact NE-CG 3.29Å; R429-Q450 VanDerWaalsContact NH1-CG 3.27Å; R429-D451 IonicContact NH2-OD1 2.69Å; R429-D451 PolarHBondContact NH2-OD1 3.34Å; R429-D454 IonicContact CZ-OD2 2.9Å; R429-D454 IonicContact NE-OD1 3.6Å; R429-D454 IonicContact NE-OD2 3.79Å; R429-D454 PolarHBondContact NE-OD2 2.93Å; R429-D454 IonicContact NH2-OD2 2.73Å; R429-D454 PolarHBondContact NH2-OD2 3.23Å
430	K	81.2	Confident	75.1	Confident	124 Å²	124	65.4 Å²	65.4	54%	0.539	35%	0.352	S	S	.	.			trans	-69.3	148.6	170	-64.8	-173.3	179.5	-174.9	0	110.3	E428 E432 D433	E428-K430 PolarHBondContact O-N 2.57Å; K430-E432 PolarHBondContact O-N 3.07Å; K430-E432 VanDerWaalsContact O-N 3.14Å; K430-D433 WeakPolarHBondContact O-CB 3.23Å; K430-D433 PolarHBondContact O-N 2.81Å
431	P	81.7	Confident	75.7	Confident	25 Å²	25	62.1 Å²	62.1	16%	0.162	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-53.7	-33.6	176	-25.9	34.4	0	0	0	113.5	E404 K407 K408 D433 Y434	E404-P431 HydrophobicContact CB-CG 4.48Å; K407-P431 HydrophobicContact CB-CB 4.41Å; K407-P431 HydrophobicContact CD-CB 4.3Å; K408-P431 HydrophobicContact CD-CG 4.31Å; K408-P431 HydrophobicContact CG-CG 3.86Å; P431-D433 VanDerWaalsContact C-N 3.27Å; P431-D433 PolarHBondContact O-N 3Å; P431-Y434 WeakPolarHBondContact O-CB 3.18Å; P431-Y434 PolarHBondContact O-N 3Å
432	E	79.4	Confident	76.4	Confident	148 Å²	148	62.5 Å²	62.5	69%	0.692	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-69.5	-20	177	-47	102.8	-122.7	0	0	113.9	K430	K430-E432 PolarHBondContact O-N 3.07Å; K430-E432 VanDerWaalsContact O-N 3.14Å
433	D	79.9	Confident	76.9	Confident	29 Å²	29	59 Å²	59	16%	0.155	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-87.9	-5.7	178.9	-83.4	-55.3	0	0	0	113.1	R429 K430 P431 V435 R457 K467	R429-D433 HydrophobicContact CG-CB 4.06Å; K430-D433 WeakPolarHBondContact O-CB 3.23Å; K430-D433 PolarHBondContact O-N 2.81Å; P431-D433 VanDerWaalsContact C-N 3.27Å; P431-D433 PolarHBondContact O-N 3Å; D433-V435 PolarHBondContact O-N 2.83Å; D433-R457 IonicContact OD1-CZ 2.68Å; D433-R457 IonicContact OD1-NH1 3.28Å; D433-R457 PolarHBondContact OD1-NH1 2.96Å; D433-R457 IonicContact OD1-NH2 3.57Å; D433-R457 PolarHBondContact OD1-NH2 2.78Å; D433-K467 WeakPolarHBondContact OD1-CE 3.37Å; D433-K467 IonicContact OD1-NZ 2.81Å; D433-K467 PolarHBondContact OD1-NZ 3.14Å
434	Y	84.6	Confident	77.4	Confident	15 Å²	15	60.5 Å²	60.5	6%	0.059	29%	0.286	C	S	.	.			trans	-67.9	126.8	179.6	-175.8	-89.2	0	0	0	111.2	K407 P431 Y436 P441 Q450	K407-Y434 HydrophobicContact CB-CD2 4.08Å; K407-Y434 HydrophobicContact CB-CG 4.17Å; K407-Y434 HydrophobicContact CD-CG 4.33Å; K407-Y434 HydrophobicContact CG-CD1 4.25Å; K407-Y434 HydrophobicContact CG-CD2 3.97Å; K407-Y434 HydrophobicContact CG-CG 3.81Å; P431-Y434 WeakPolarHBondContact O-CB 3.18Å; P431-Y434 PolarHBondContact O-N 3Å; Y434-Y436 HydrophobicContact CD1-CD1 4.28Å; Y434-Y436 HydrophobicContact CD1-CD2 4.08Å; Y434-Y436 HydrophobicContact CD1-CE1 4.43Å; Y434-Y436 HydrophobicContact CD1-CE2 4.23Å; Y434-Y436 HydrophobicContact CD1-CG 4.15Å; Y434-Y436 HydrophobicContact CE1-CD1 4.05Å; Y434-Y436 HydrophobicContact CE1-CE1 4.42Å; Y434-Y436 HydrophobicContact CE1-CG 4.18Å; Y434-P441 HydrophobicContact CD1-CG 4.47Å; Y434-P441 HydrophobicContact CE1-CB 4.3Å; Y434-P441 HydrophobicContact CE1-CG 3.74Å; Y434-P441 HydrophobicContact CE2-CB 3.92Å; Y434-P441 HydrophobicContact CE2-CG 4.27Å; Y434-P441 VanDerWaalsContact OH-CA 3.25Å; Y434-P441 WeakPolarHBondContact OH-CA 3.16Å; Y434-Q450 HydrophobicContact CD2-CG 4.21Å; Y434-Q450 HydrophobicContact CE2-CG 4.21Å
435	V	84.5	Confident	78	Confident	40 Å²	40	59.5 Å²	59.5	24%	0.242	28%	0.278	C	S	.	.			trans	-93.2	110.7	178.3	-178	0	0	0	0	108.6	D433 Q450	D433-V435 PolarHBondContact O-N 2.83Å; V435-Q450 PolarHBondContact O-OE1 3.05Å
436	Y	84.6	Confident	78.8	Confident	50 Å²	50	56.6 Å²	56.6	20%	0.196	26%	0.261	C	S	.	.			trans	-64.6	139	175.9	-75.1	-88.7	0	0	0	111.7	K407 Y434 E506 R507	K407-Y436 VanDerWaalsContact CE-OH 3.24Å; K407-Y436 WeakPolarHBondContact CE-OH 3.4Å; K407-Y436 PolarHBondContact NZ-OH 2.98Å; Y434-Y436 HydrophobicContact CD1-CD1 4.28Å; Y434-Y436 HydrophobicContact CD1-CD2 4.08Å; Y434-Y436 HydrophobicContact CD1-CE1 4.43Å; Y434-Y436 HydrophobicContact CD1-CE2 4.23Å; Y434-Y436 HydrophobicContact CD1-CG 4.15Å; Y434-Y436 HydrophobicContact CE1-CD1 4.05Å; Y434-Y436 HydrophobicContact CE1-CE1 4.42Å; Y434-Y436 HydrophobicContact CE1-CG 4.18Å; Y436-E506 HydrophobicContact CD1-CB 3.85Å; Y436-E506 HydrophobicContact CD1-CG 3.95Å; Y436-E506 HydrophobicContact CD2-CB 3.71Å; Y436-E506 HydrophobicContact CD2-CG 4.22Å; Y436-E506 HydrophobicContact CE1-CB 3.98Å; Y436-E506 HydrophobicContact CE1-CG 3.57Å; Y436-E506 WeakPolarHBondContact CE1-OE1 3.48Å; Y436-E506 HydrophobicContact CE2-CB 3.87Å; Y436-E506 HydrophobicContact CE2-CG 3.89Å; Y436-E506 HydrophobicContact CG-CB 3.66Å; Y436-E506 HydrophobicContact CG-CG 4.21Å; Y436-E506 VanDerWaalsContact CZ-CG 3.49Å; Y436-E506 PolarHBondContact OH-OE1 2.86Å; Y436-R507 WeakPolarHBondContact O-CD 3.46Å; Y436-R507 PolarHBondContact O-NE 3.23Å; Y436-R507 PolarHBondContact O-NH1 2.98Å
437	D	82.2	Confident	79.6	Confident	29 Å²	29	54.3 Å²	54.3	16%	0.155	25%	0.25	C	S	.	.			trans	-133.5	-177.5	178.4	-154.8	-18.1	0	0	0	108.7	L439 R449	D437-L439 PolarHBondContact O-N 3.43Å; D437-R449 IonicContact OD1-NH1 2.72Å; D437-R449 PolarHBondContact OD1-NH1 3.48Å; D437-R449 WeakPolarHBondContact OD2-CD 3.36Å; D437-R449 IonicContact OD2-CZ 2.76Å; D437-R449 IonicContact OD2-NE 2.85Å; D437-R449 IonicContact OD2-NH1 2.76Å; D437-R449 PolarHBondContact OD2-NH1 2.88Å
438	E	82	Confident	80.1	Confident	33 Å²	33	55.7 Å²	55.7	15%	0.154	26%	0.26	C	S	.	.	S	Bend	trans	-57.7	-26.8	169.1	72.9	-162.9	155.5	0	0	112	R449 Y502 F511 R565	E438-R449 IonicContact OE1-CZ 3.15Å; E438-R449 VanDerWaalsContact OE1-CZ 3.25Å; E438-R449 IonicContact OE1-NH1 3.23Å; E438-R449 PolarHBondContact OE1-NH1 2.97Å; E438-R449 IonicContact OE1-NH2 3Å; E438-R449 PolarHBondContact OE1-NH2 3.34Å; E438-Y502 WeakPolarHBondContact O-CE1 3.48Å; E438-Y502 PolarHBondContact O-OH 3.2Å; E438-F511 HydrophobicContact CB-CE1 4.4Å; E438-F511 HydrophobicContact CB-CE2 4.46Å; E438-F511 HydrophobicContact CB-CZ 3.72Å; E438-R565 IonicContact OE1-CZ 2.72Å; E438-R565 VanDerWaalsContact OE1-CZ 3.26Å; E438-R565 IonicContact OE1-NH1 2.65Å; E438-R565 IonicContact OE1-NH2 3.56Å; E438-R565 PolarHBondContact OE1-NH2 3.16Å; E438-R565 IonicContact OE2-CZ 2.8Å; E438-R565 VanDerWaalsContact OE2-CZ 3.3Å; E438-R565 IonicContact OE2-NE 2.84Å; E438-R565 PolarHBondContact OE2-NE 3.08Å; E438-R565 IonicContact OE2-NH2 3.11Å; E438-R565 PolarHBondContact OE2-NH2 3.36Å
439	L	82.8	Confident	80.5	Confident	17 Å²	17	53.6 Å²	53.6	9%	0.089	25%	0.248	C	C	.	.	S	Bend	trans	-88.1	149.4	179.2	-59.5	-177.7	0	0	0	111.9	D437 E445 A446 R449	D437-L439 PolarHBondContact O-N 3.43Å; L439-E445 HydrophobicContact CD1-CB 3.41Å; L439-E445 VanDerWaalsContact CD1-CB 3.41Å; L439-A446 HydrophobicContact CB-CB 3.72Å; L439-A446 HydrophobicContact CD1-CB 4.22Å; L439-R449 VanDerWaalsContact CG-NH2 3.31Å
440	R	80.2	Confident	80.8	Confident	43 Å²	43	53.5 Å²	53.5	16%	0.162	25%	0.248	C	C	.	.			trans	-82.4	147.5	177.4	-60.8	-64.8	-177.1	-131.8	4.2	111.8	W442 Q443 A446 Y502	R440-W442 HydrophobicContact CB-CD2 3.92Å; R440-W442 VanDerWaalsContact CB-CE2 3.48Å; R440-W442 HydrophobicContact CB-CE3 4.28Å; R440-W442 HydrophobicContact CB-CH2 3.89Å; R440-W442 HydrophobicContact CB-CZ2 3.45Å; R440-W442 VanDerWaalsContact CB-CZ2 3.45Å; R440-W442 HydrophobicContact CB-CZ3 4.28Å; R440-W442 HydrophobicContact CG-CH2 4.03Å; R440-W442 HydrophobicContact CG-CZ2 3.55Å; R440-W442 PolarHBondContact O-N 3.24Å; R440-W442 VanDerWaalsContact O-N 3.07Å; R440-Q443 HydrophobicContact CB-CG 4.21Å; R440-Q443 WeakPolarHBondContact O-CB 3.39Å; R440-Q443 PolarHBondContact O-N 3.03Å; R440-A446 WeakPolarHBondContact O-CB 3.19Å; R440-Y502 PolarHBondContact NE-OH 3.12Å; R440-Y502 PolarHBondContact NH1-OH 3.23Å; R440-Y502 PolarHBondContact NH2-OH 2.78Å
441	P	81.2	Confident	80.7	Confident	6 Å²	6	49.1 Å²	49.1	4%	0.039	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.9	-176.4	-24.4	30.8	0	0	0	116.1	T406 K407 Y434 Q443	T406-P441 VanDerWaalsContact CG2-C 3.45Å; T406-P441 HydrophobicContact CG2-CB 4Å; T406-P441 WeakPolarHBondContact CG2-O 3.46Å; K407-P441 HydrophobicContact CG-CB 4.15Å; K407-P441 HydrophobicContact CG-CG 4.21Å; Y434-P441 HydrophobicContact CD1-CG 4.47Å; Y434-P441 HydrophobicContact CE1-CB 4.3Å; Y434-P441 HydrophobicContact CE1-CG 3.74Å; Y434-P441 HydrophobicContact CE2-CB 3.92Å; Y434-P441 HydrophobicContact CE2-CG 4.27Å; Y434-P441 VanDerWaalsContact OH-CA 3.25Å; Y434-P441 WeakPolarHBondContact OH-CA 3.16Å; P441-Q443 VanDerWaalsContact C-N 3.34Å
442	W	79.7	Confident	80.7	Confident	58 Å²	58	51.7 Å²	51.7	22%	0.22	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-7.4	179.7	52	90.3	0	0	0	113.7	Y395 I403 T406 R440	Y395-W442 AromaticContact CD2-CH2 3.82Å; Y395-W442 HydrophobicContact CD2-CH2 3.82Å; Y395-W442 AromaticContact CD2-CZ2 3.25Å; Y395-W442 HydrophobicContact CD2-CZ2 3.25Å; Y395-W442 AromaticContact CE2-CE2 3.76Å; Y395-W442 HydrophobicContact CE2-CH2 4.37Å; Y395-W442 AromaticContact CE2-CZ2 3.39Å; Y395-W442 HydrophobicContact CE2-CZ2 3.39Å; Y395-W442 AromaticContact CE2-NE1 3.75Å; Y395-W442 HydrophobicContact CG-CH2 4.5Å; Y395-W442 HydrophobicContact CG-CZ2 4.24Å; I403-W442 HydrophobicContact CG1-CZ3 4.37Å; T406-W442 VanDerWaalsContact CG2-CA 3.41Å; T406-W442 HydrophobicContact CG2-CB 3.74Å; R440-W442 HydrophobicContact CB-CD2 3.92Å; R440-W442 VanDerWaalsContact CB-CE2 3.48Å; R440-W442 HydrophobicContact CB-CE3 4.28Å; R440-W442 HydrophobicContact CB-CH2 3.89Å; R440-W442 HydrophobicContact CB-CZ2 3.45Å; R440-W442 VanDerWaalsContact CB-CZ2 3.45Å; R440-W442 HydrophobicContact CB-CZ3 4.28Å; R440-W442 HydrophobicContact CG-CH2 4.03Å; R440-W442 HydrophobicContact CG-CZ2 3.55Å; R440-W442 PolarHBondContact O-N 3.24Å; R440-W442 VanDerWaalsContact O-N 3.07Å
443	Q	76.9	Confident	80.6	Confident	36 Å²	36	49.6 Å²	49.6	17%	0.168	23%	0.227	C	C	.	.	S	Bend	trans	-75.6	137.9	174.9	-66.3	-178.4	-70.4	0	0	110.3	R440 P441 E445 A446 Q447	R440-Q443 HydrophobicContact CB-CG 4.21Å; R440-Q443 WeakPolarHBondContact O-CB 3.39Å; R440-Q443 PolarHBondContact O-N 3.03Å; P441-Q443 VanDerWaalsContact C-N 3.34Å; Q443-E445 VanDerWaalsContact C-N 3.27Å; Q443-E445 PolarHBondContact O-N 3.31Å; Q443-A446 HydrophobicContact CB-CB 4.25Å; Q443-A446 WeakPolarHBondContact O-CB 3.25Å; Q443-A446 PolarHBondContact O-N 3.25Å; Q443-Q447 PolarHBondContact O-N 3.11Å; Q443-Q447 VanDerWaalsContact O-N 3.11Å
444	H	76.1	Confident	80.5	Confident	127 Å²	127	48.6 Å²	48.6	59%	0.588	22%	0.221	S	C	*	.	H	α-helix	trans	-58.5	-39.4	-179.4	-175.1	56.3	0	0	0	112.6	A446 Q447 M448	H444-A446 VanDerWaalsContact C-N 3.33Å; H444-A446 PolarHBondContact O-N 3.16Å; H444-Q447 WeakPolarHBondContact O-CB 3.36Å; H444-Q447 PolarHBondContact O-N 3.27Å; H444-M448 WeakPolarHBondContact CD2-CE 3.02Å; H444-M448 WeakPolarHBondContact NE2-CE 3.37Å; H444-M448 PolarHBondContact O-N 2.81Å
445	E	75.6	Confident	80.1	Confident	100 Å²	100	51.7 Å²	51.7	47%	0.467	24%	0.239	S	C	.	.	H	α-helix	trans	-65.5	-34.1	176	-67.5	176.3	-175	0	0	112.8	L439 Q443 M448 R449	L439-E445 HydrophobicContact CD1-CB 3.41Å; L439-E445 VanDerWaalsContact CD1-CB 3.41Å; Q443-E445 VanDerWaalsContact C-N 3.27Å; Q443-E445 PolarHBondContact O-N 3.31Å; E445-M448 HydrophobicContact CG-CE 4.49Å; E445-M448 PolarHBondContact O-N 2.92Å; E445-R449 WeakPolarHBondContact O-CG 3.39Å; E445-R449 PolarHBondContact O-N 3.34Å
446	A	80.5	Confident	79.6	Confident	3 Å²	3	51.9 Å²	51.9	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-42.2	175.7	0	0	0	0	0	110.5	L439 R440 Q443 H444 M448 R449 Q450	L439-A446 HydrophobicContact CB-CB 3.72Å; L439-A446 HydrophobicContact CD1-CB 4.22Å; R440-A446 WeakPolarHBondContact O-CB 3.19Å; Q443-A446 HydrophobicContact CB-CB 4.25Å; Q443-A446 WeakPolarHBondContact O-CB 3.25Å; Q443-A446 PolarHBondContact O-N 3.25Å; H444-A446 VanDerWaalsContact C-N 3.33Å; H444-A446 PolarHBondContact O-N 3.16Å; A446-M448 VanDerWaalsContact C-N 3.34Å; A446-M448 PolarHBondContact O-N 3.33Å; A446-R449 PolarHBondContact O-N 3.05Å; A446-Q450 VanDerWaalsContact O-CB 3.23Å; A446-Q450 WeakPolarHBondContact O-CB 3.49Å; A446-Q450 PolarHBondContact O-N 3.13Å
447	Q	80.5	Confident	78.9	Confident	79 Å²	79	53.3 Å²	53.3	37%	0.369	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-44	173.9	-66.9	178.2	-5.9	0	0	111.4	Q443 H444 Q450 D451	Q443-Q447 PolarHBondContact O-N 3.11Å; Q443-Q447 VanDerWaalsContact O-N 3.11Å; H444-Q447 WeakPolarHBondContact O-CB 3.36Å; H444-Q447 PolarHBondContact O-N 3.27Å; Q447-Q450 PolarHBondContact O-N 3.38Å; Q447-D451 WeakPolarHBondContact O-CB 3.38Å; Q447-D451 PolarHBondContact O-N 3.27Å
448	M	79.2	Confident	78.3	Confident	99 Å²	99	55.2 Å²	55.2	49%	0.488	25%	0.249	S	C	.	.	H	α-helix	trans	-62.5	-46.3	177.1	-74.3	-164.5	-85.5	0	0	112.7	H444 E445 A446 Q450 D451 E452	H444-M448 WeakPolarHBondContact CD2-CE 3.02Å; H444-M448 WeakPolarHBondContact NE2-CE 3.37Å; H444-M448 PolarHBondContact O-N 2.81Å; E445-M448 HydrophobicContact CG-CE 4.49Å; E445-M448 PolarHBondContact O-N 2.92Å; A446-M448 VanDerWaalsContact C-N 3.34Å; A446-M448 PolarHBondContact O-N 3.33Å; M448-Q450 VanDerWaalsContact C-N 3.32Å; M448-Q450 PolarHBondContact O-N 3.21Å; M448-D451 PolarHBondContact O-N 3.46Å; M448-E452 PolarHBondContact O-N 3.13Å
449	R	79.1	Confident	77.7	Confident	59 Å²	59	60.6 Å²	60.6	22%	0.223	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-42.7	175.6	-72	-173.6	-143.8	-174.2	1.7	111.5	D437 E438 L439 E445 A446 D451 E452 Y453	D437-R449 IonicContact OD1-NH1 2.72Å; D437-R449 PolarHBondContact OD1-NH1 3.48Å; D437-R449 WeakPolarHBondContact OD2-CD 3.36Å; D437-R449 IonicContact OD2-CZ 2.76Å; D437-R449 IonicContact OD2-NE 2.85Å; D437-R449 IonicContact OD2-NH1 2.76Å; D437-R449 PolarHBondContact OD2-NH1 2.88Å; E438-R449 IonicContact OE1-CZ 3.15Å; E438-R449 VanDerWaalsContact OE1-CZ 3.25Å; E438-R449 IonicContact OE1-NH1 3.23Å; E438-R449 PolarHBondContact OE1-NH1 2.97Å; E438-R449 IonicContact OE1-NH2 3Å; E438-R449 PolarHBondContact OE1-NH2 3.34Å; L439-R449 VanDerWaalsContact CG-NH2 3.31Å; E445-R449 WeakPolarHBondContact O-CG 3.39Å; E445-R449 PolarHBondContact O-N 3.34Å; A446-R449 PolarHBondContact O-N 3.05Å; R449-D451 VanDerWaalsContact C-N 3.34Å; R449-E452 WeakPolarHBondContact O-CB 3.24Å; R449-E452 PolarHBondContact O-N 3.45Å; R449-Y453 WeakPolarHBondContact O-CD2 3.5Å; R449-Y453 PolarHBondContact O-N 3.45Å
450	Q	84.3	Confident	76.8	Confident	3 Å²	3	64.5 Å²	64.5	1%	0.014	29%	0.294	C	S	.	.	H	α-helix	trans	-69.6	-35.4	-178.8	-168.5	65.4	46.6	0	0	111.6	R429 Y434 V435 A446 Q447 M448 E452 Y453 D454	R429-Q450 VanDerWaalsContact NE-CG 3.29Å; R429-Q450 VanDerWaalsContact NH1-CG 3.27Å; Y434-Q450 HydrophobicContact CD2-CG 4.21Å; Y434-Q450 HydrophobicContact CE2-CG 4.21Å; V435-Q450 PolarHBondContact O-OE1 3.05Å; A446-Q450 VanDerWaalsContact O-CB 3.23Å; A446-Q450 WeakPolarHBondContact O-CB 3.49Å; A446-Q450 PolarHBondContact O-N 3.13Å; Q447-Q450 PolarHBondContact O-N 3.38Å; M448-Q450 VanDerWaalsContact C-N 3.32Å; M448-Q450 PolarHBondContact O-N 3.21Å; Q450-E452 VanDerWaalsContact C-N 3.3Å; Q450-E452 PolarHBondContact O-N 3.3Å; Q450-Y453 PolarHBondContact O-N 3.29Å; Q450-D454 PolarHBondContact NE2-OD1 3.07Å; Q450-D454 WeakPolarHBondContact O-CB 3.39Å; Q450-D454 VanDerWaalsContact O-CG 3.25Å; Q450-D454 PolarHBondContact O-N 2.9Å
451	D	80.6	Confident	75.7	Confident	32 Å²	32	70.3 Å²	70.3	17%	0.171	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-36.5	171.1	-74.4	-15.2	0	0	0	111.9	K412 R429 Q447 M448 R449 D454 N455	K412-D451 IonicContact NZ-OD1 3.14Å; K412-D451 IonicContact NZ-OD2 2.68Å; K412-D451 PolarHBondContact NZ-OD2 3.46Å; R429-D451 IonicContact NH2-OD1 2.69Å; R429-D451 PolarHBondContact NH2-OD1 3.34Å; Q447-D451 WeakPolarHBondContact O-CB 3.38Å; Q447-D451 PolarHBondContact O-N 3.27Å; M448-D451 PolarHBondContact O-N 3.46Å; R449-D451 VanDerWaalsContact C-N 3.34Å; D451-D454 PolarHBondContact O-N 2.67Å; D451-N455 VanDerWaalsContact O-CB 3.28Å; D451-N455 WeakPolarHBondContact O-CB 3.29Å; D451-N455 PolarHBondContact O-N 2.62Å; D451-N455 PolarHBondContact O-ND2 3.39Å
452	E	79.9	Confident	74.2	Confident	80 Å²	80	79.5 Å²	79.5	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-64.2	-47.2	172.3	-171.6	175.7	-172.6	0	0	111.1	M448 R449 Q450 D454 N455 F456	M448-E452 PolarHBondContact O-N 3.13Å; R449-E452 WeakPolarHBondContact O-CB 3.24Å; R449-E452 PolarHBondContact O-N 3.45Å; Q450-E452 VanDerWaalsContact C-N 3.3Å; Q450-E452 PolarHBondContact O-N 3.3Å; E452-D454 VanDerWaalsContact C-N 3.34Å; E452-D454 PolarHBondContact O-N 3.29Å; E452-N455 PolarHBondContact O-N 3.08Å; E452-F456 WeakPolarHBondContact O-CB 3.39Å; E452-F456 PolarHBondContact O-N 3.48Å
453	Y	78.5	Confident	73	Confident	104 Å²	104	85.9 Å²	85.9	41%	0.408	39%	0.387	S	S	.	.	H	α-helix	trans	-57.8	-43.7	173.6	-81.7	-66.3	0	0	0	112.4	R449 Q450 F456 R457	R449-Y453 WeakPolarHBondContact O-CD2 3.5Å; R449-Y453 PolarHBondContact O-N 3.45Å; Q450-Y453 PolarHBondContact O-N 3.29Å; Y453-F456 WeakPolarHBondContact O-CB 3.49Å; Y453-F456 PolarHBondContact O-N 3.25Å; Y453-R457 WeakPolarHBondContact O-CG 3.43Å; Y453-R457 PolarHBondContact O-N 3.46Å
454	D	77.5	Confident	72	Confident	7 Å²	7	93.8 Å²	93.8	4%	0.037	42%	0.421	C	S	.	.	H	α-helix	trans	-68.5	-41.9	179.5	-72.9	-7.5	0	0	0	111.6	Y427 R429 Q450 D451 E452 F456 R457 K458	Y427-D454 HydrophobicContact CE1-CB 4.29Å; R429-D454 IonicContact CZ-OD2 2.9Å; R429-D454 IonicContact NE-OD1 3.6Å; R429-D454 IonicContact NE-OD2 3.79Å; R429-D454 PolarHBondContact NE-OD2 2.93Å; R429-D454 IonicContact NH2-OD2 2.73Å; R429-D454 PolarHBondContact NH2-OD2 3.23Å; Q450-D454 PolarHBondContact NE2-OD1 3.07Å; Q450-D454 WeakPolarHBondContact O-CB 3.39Å; Q450-D454 VanDerWaalsContact O-CG 3.25Å; Q450-D454 PolarHBondContact O-N 2.9Å; D451-D454 PolarHBondContact O-N 2.67Å; E452-D454 VanDerWaalsContact C-N 3.34Å; E452-D454 PolarHBondContact O-N 3.29Å; D454-F456 VanDerWaalsContact C-N 3.3Å; D454-F456 PolarHBondContact O-N 3.21Å; D454-R457 PolarHBondContact O-N 2.93Å; D454-K458 WeakPolarHBondContact O-CG 3.36Å; D454-K458 PolarHBondContact O-N 3.09Å
455	N	76.7	Confident	71.2	Confident	81 Å²	81	91.2 Å²	91.2	43%	0.433	41%	0.41	S	S	.	.	H	α-helix	trans	-61.8	-40.5	173.7	-75.1	-22	0	0	0	111.1	D451 E452 K458 L459	D451-N455 VanDerWaalsContact O-CB 3.28Å; D451-N455 WeakPolarHBondContact O-CB 3.29Å; D451-N455 PolarHBondContact O-N 2.62Å; D451-N455 PolarHBondContact O-ND2 3.39Å; E452-N455 PolarHBondContact O-N 3.08Å; N455-K458 PolarHBondContact O-N 3.15Å; N455-L459 WeakPolarHBondContact O-CB 3.38Å; N455-L459 WeakPolarHBondContact O-CG 3.49Å; N455-L459 PolarHBondContact O-N 3.1Å
456	F	73	Confident	70.6	Confident	44 Å²	44	91.5 Å²	91.5	19%	0.193	42%	0.421	C	S	.	.	H	α-helix	trans	-62.7	-44	173.6	-118.3	-82	0	0	0	112.2	E452 Y453 D454 K458 L459 K460 I465 V541	E452-F456 WeakPolarHBondContact O-CB 3.39Å; E452-F456 PolarHBondContact O-N 3.48Å; Y453-F456 WeakPolarHBondContact O-CB 3.49Å; Y453-F456 PolarHBondContact O-N 3.25Å; D454-F456 VanDerWaalsContact C-N 3.3Å; D454-F456 PolarHBondContact O-N 3.21Å; F456-K458 VanDerWaalsContact C-N 3.3Å; F456-K458 PolarHBondContact O-N 3.19Å; F456-L459 PolarHBondContact O-N 3.31Å; F456-K460 HydrophobicContact CD1-CD 4.46Å; F456-K460 WeakPolarHBondContact O-CB 3.47Å; F456-K460 PolarHBondContact O-N 3.02Å; F456-I465 HydrophobicContact CB-CD1 4.28Å; F456-V541 HydrophobicContact CD2-CG1 4.29Å; F456-V541 HydrophobicContact CE1-CB 4.43Å; F456-V541 HydrophobicContact CE1-CG2 3.68Å; F456-V541 HydrophobicContact CE2-CB 3.44Å; F456-V541 VanDerWaalsContact CE2-CB 3.44Å; F456-V541 HydrophobicContact CE2-CG1 3.42Å; F456-V541 VanDerWaalsContact CE2-CG1 3.42Å; F456-V541 HydrophobicContact CE2-CG2 3.55Å; F456-V541 HydrophobicContact CZ-CB 3.34Å; F456-V541 HydrophobicContact CZ-CG1 3.85Å; F456-V541 HydrophobicContact CZ-CG2 3.02Å
457	R	71.1	Confident	70	Confident	79 Å²	79	96.7 Å²	96.7	30%	0.298	44%	0.443	S	S	.	.	H	α-helix	trans	-61.2	-38.2	174.7	-76.9	176.9	81.3	177.5	-1.4	111.4	D433 Y453 D454 K460 Q461 I465	D433-R457 IonicContact OD1-CZ 2.68Å; D433-R457 IonicContact OD1-NH1 3.28Å; D433-R457 PolarHBondContact OD1-NH1 2.96Å; D433-R457 IonicContact OD1-NH2 3.57Å; D433-R457 PolarHBondContact OD1-NH2 2.78Å; Y453-R457 WeakPolarHBondContact O-CG 3.43Å; Y453-R457 PolarHBondContact O-N 3.46Å; D454-R457 PolarHBondContact O-N 2.93Å; R457-K460 CarbonylContact O-C 3.58Å; R457-Q461 PolarHBondContact O-N 3.12Å; R457-I465 HydrophobicContact CG-CD1 3.86Å; R457-I465 HydrophobicContact CG-CG1 4.48Å
458	K	69.4	Low	69.4	Low	69 Å²	69	97.8 Å²	97.8	30%	0.3	46%	0.455	S	S	.	.	H	α-helix	trans	-66.5	-48.8	175.5	-73.7	179.4	178.2	-167.8	0	112.1	D454 N455 F456 K460 Q461	D454-K458 WeakPolarHBondContact O-CG 3.36Å; D454-K458 PolarHBondContact O-N 3.09Å; N455-K458 PolarHBondContact O-N 3.15Å; F456-K458 VanDerWaalsContact C-N 3.3Å; F456-K458 PolarHBondContact O-N 3.19Å; K458-K460 VanDerWaalsContact C-N 3.32Å; K458-K460 PolarHBondContact O-N 2.89Å; K458-Q461 PolarHBondContact O-N 3.28Å
459	L	69	Low	69	Low	147 Å²	147	99.8 Å²	99.8	77%	0.77	47%	0.467	S	S	*	.	H	α-helix	trans	-65.5	-36.4	-179	-73.9	168.3	0	0	0	112.3	N455 F456 Q461	N455-L459 WeakPolarHBondContact O-CB 3.38Å; N455-L459 WeakPolarHBondContact O-CG 3.49Å; N455-L459 PolarHBondContact O-N 3.1Å; F456-L459 PolarHBondContact O-N 3.31Å; L459-Q461 VanDerWaalsContact C-N 3.32Å; L459-Q461 PolarHBondContact O-N 3.43Å
460	K	63.5	Low	69.1	Low	99 Å²	99	99.5 Å²	99.5	43%	0.43	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	39.9	176.3	-70.6	-160.7	177.5	-171.4	0	112.2	F456 R457 K458 F462 W463	F456-K460 HydrophobicContact CD1-CD 4.46Å; F456-K460 WeakPolarHBondContact O-CB 3.47Å; F456-K460 PolarHBondContact O-N 3.02Å; R457-K460 CarbonylContact O-C 3.58Å; K458-K460 VanDerWaalsContact C-N 3.32Å; K458-K460 PolarHBondContact O-N 2.89Å; K460-F462 PolarHBondContact O-N 3.25Å; K460-W463 HydrophobicContact CB-CB 4.2Å; K460-W463 HydrophobicContact CD-CB 4.27Å; K460-W463 CarbonylContact O-C 3.58Å; K460-W463 VanDerWaalsContact O-C 3.31Å; K460-W463 WeakPolarHBondContact O-CA 3.29Å; K460-W463 PolarHBondContact O-N 2.72Å
461	Q	57.9	Low	69.1	Low	165 Å²	165	107.6 Å²	107.6	77%	0.771	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-27.5	176.1	-112.3	177.9	-11	0	0	113.5	R457 K458 L459	R457-Q461 PolarHBondContact O-N 3.12Å; K458-Q461 PolarHBondContact O-N 3.28Å; L459-Q461 VanDerWaalsContact C-N 3.32Å; L459-Q461 PolarHBondContact O-N 3.43Å
462	F	48.7	Very low	69.4	Low	198 Å²	198	109.7 Å²	109.7	87%	0.868	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-20.4	174.7	-68.3	-77.2	0	0	0	115.4	K460	K460-F462 PolarHBondContact O-N 3.25Å
463	W	55	Low	69.9	Low	193 Å²	193	107.3 Å²	107.3	73%	0.731	52%	0.515	S	S	*	.	S	Bend	trans	-117.1	96.7	178.4	-60.2	90.5	0	0	0	109.7	K460 I465	K460-W463 HydrophobicContact CB-CB 4.2Å; K460-W463 HydrophobicContact CD-CB 4.27Å; K460-W463 CarbonylContact O-C 3.58Å; K460-W463 VanDerWaalsContact O-C 3.31Å; K460-W463 WeakPolarHBondContact O-CA 3.29Å; K460-W463 PolarHBondContact O-N 2.72Å; W463-I465 PolarHBondContact O-N 2.94Å
464	K	56.1	Low	70.4	Confident	202 Å²	202	105.4 Å²	105.4	88%	0.878	52%	0.515	S	S	*	.			trans	-57.7	109.1	173.6	-74.1	-177.8	-179.6	176.8	0	109.2	P466	K464-P466 WeakPolarHBondContact O-CD 3.22Å
465	I	58.9	Low	70.8	Confident	72 Å²	72	110.9 Å²	110.9	37%	0.369	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-61.3	120.7	169.4	-56.7	179.1	0	0	0	106.4	F456 R457 W463 K467	F456-I465 HydrophobicContact CB-CD1 4.28Å; R457-I465 HydrophobicContact CG-CD1 3.86Å; R457-I465 HydrophobicContact CG-CG1 4.48Å; W463-I465 PolarHBondContact O-N 2.94Å; I465-K467 PolarHBondContact O-N 3.44Å
466	P	64	Low	71.3	Confident	107 Å²	107	110.9 Å²	110.9	70%	0.695	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-60.1	124.4	179.9	22.2	-30.3	0	0	0	108.6	K464 V468	K464-P466 WeakPolarHBondContact O-CD 3.22Å; P466-V468 PolarHBondContact O-N 3.36Å
467	K	66.6	Low	72.1	Confident	112 Å²	112	114 Å²	114	49%	0.487	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-65.6	123.3	169.6	-71.3	-173.9	175	-170.6	0	107.1	D433 I465 N469	D433-K467 WeakPolarHBondContact OD1-CE 3.37Å; D433-K467 IonicContact OD1-NZ 2.81Å; D433-K467 PolarHBondContact OD1-NZ 3.14Å; I465-K467 PolarHBondContact O-N 3.44Å; K467-N469 WeakPolarHBondContact CB-OD1 3.45Å; K467-N469 PolarHBondContact O-N 3.2Å
468	V	68.7	Low	73.1	Confident	101 Å²	101	110.4 Å²	110.4	61%	0.612	55%	0.546	S	S	*	.			trans	-74.4	84.9	168.9	-171.4	0	0	0	0	106.5	P466 V470	P466-V468 PolarHBondContact O-N 3.36Å; V468-V470 HydrophobicContact CG1-CG2 3.84Å; V468-V470 PolarHBondContact O-N 3.48Å; V468-V470 VanDerWaalsContact O-N 3.12Å
469	N	69.7	Low	74.3	Confident	141 Å²	141	109.7 Å²	109.7	75%	0.754	54%	0.542	S	S	*	.			trans	-74.6	97.5	172.9	-76.6	1.8	0	0	0	107.4	K467	K467-N469 WeakPolarHBondContact CB-OD1 3.45Å; K467-N469 PolarHBondContact O-N 3.2Å
470	V	81.3	Confident	75.4	Confident	53 Å²	53	102.7 Å²	102.7	32%	0.321	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-96	119.6	165.5	-174.8	0	0	0	0	106.3	V468 P472 N508	V468-V470 HydrophobicContact CG1-CG2 3.84Å; V468-V470 PolarHBondContact O-N 3.48Å; V468-V470 VanDerWaalsContact O-N 3.12Å; V470-P472 WeakPolarHBondContact O-CD 3.5Å; V470-N508 VanDerWaalsContact CG1-ND2 3.31Å; V470-N508 WeakPolarHBondContact CG1-ND2 3.13Å
471	E	85.6	Confident	76.8	Confident	173 Å²	173	99.6 Å²	99.6	81%	0.808	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-70.1	119.1	169.2	-70.9	-177.7	179.7	0	0	108.2	N508	E471-N508 PolarHBondContact O-ND2 2.94Å
472	P	86.2	Confident	78.3	Confident	77 Å²	77	93.8 Å²	93.8	50%	0.5	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-67.1	137.7	178.3	28.3	-32.9	0	0	0	109	V470	V470-P472 WeakPolarHBondContact O-CD 3.5Å
473	I	90.1	Very high	80.4	Confident	29 Å²	29	85.3 Å²	85.3	15%	0.149	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-60.7	128.9	173.3	-63.5	162	0	0	0	107.9	Q477 W478 N508 V571 I572	I473-Q477 HydrophobicContact CG2-CB 3.72Å; I473-W478 HydrophobicContact CB-CE3 3.82Å; I473-W478 HydrophobicContact CB-CZ3 4.12Å; I473-W478 HydrophobicContact CD1-CE3 4.27Å; I473-W478 HydrophobicContact CD1-CZ3 4.02Å; I473-W478 HydrophobicContact CG2-CE3 4.25Å; I473-N508 HydrophobicContact CD1-CB 4.34Å; I473-N508 PolarHBondContact N-OD1 3.38Å; I473-V571 HydrophobicContact CD1-CG1 4.38Å; I473-I572 HydrophobicContact CD1-CD1 4.14Å; I473-I572 HydrophobicContact CD1-CG1 3.87Å; I473-I572 HydrophobicContact CG1-CD1 4.18Å; I473-I572 HydrophobicContact CG1-CG1 4.46Å
474	P	90.2	Very high	82.2	Confident	64 Å²	64	76.4 Å²	76.4	42%	0.416	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-52.2	145.6	175.9	-29.5	37.1	0	0	0	112.4	D476 Q477 W478	P474-D476 WeakPolarHBondContact CB-OD1 3.22Å; P474-D476 PolarHBondContact O-N 3.35Å; P474-D476 VanDerWaalsContact O-N 3.13Å; P474-Q477 HydrophobicContact CB-CG 4.41Å; P474-Q477 PolarHBondContact O-N 2.81Å; P474-W478 PolarHBondContact O-N 2.89Å; P474-W478 VanDerWaalsContact O-N 3.08Å
475	D	85.6	Confident	84.1	Confident	122 Å²	122	72.6 Å²	72.6	65%	0.652	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.9	-175.3	-80.4	-28.6	0	0	0	112.9	Q477 R505	D475-Q477 VanDerWaalsContact C-N 3.35Å; D475-R505 IonicContact OD1-CZ 3.59Å; D475-R505 IonicContact OD1-NH1 3.25Å; D475-R505 PolarHBondContact OD1-NH1 3.19Å
476	D	87	Confident	85.9	Confident	82 Å²	82	69.1 Å²	69.1	44%	0.439	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-24.5	174.9	66.3	-58.2	0	0	0	112.4	P474 R598	P474-D476 WeakPolarHBondContact CB-OD1 3.22Å; P474-D476 PolarHBondContact O-N 3.35Å; P474-D476 VanDerWaalsContact O-N 3.13Å; D476-R598 PolarHBondContact O-NH1 3.34Å; D476-R598 PolarHBondContact O-NH2 3.46Å
477	Q	90.3	Very high	87.4	Confident	109 Å²	109	65.5 Å²	65.5	51%	0.509	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.7	180	-62.4	-179	8.8	0	0	112.6	I473 P474 D475 W479	I473-Q477 HydrophobicContact CG2-CB 3.72Å; P474-Q477 HydrophobicContact CB-CG 4.41Å; P474-Q477 PolarHBondContact O-N 2.81Å; D475-Q477 VanDerWaalsContact C-N 3.35Å; Q477-W479 PolarHBondContact O-N 3.18Å
478	W	92.3	Very high	88.8	Confident	3 Å²	3	60.3 Å²	60.3	1%	0.011	31%	0.311	C	S	.	.			trans	-63.5	113.5	-177.3	-170.2	-86.5	0	0	0	112.3	I473 P474 I480 I503 R505 V571 W590	I473-W478 HydrophobicContact CB-CE3 3.82Å; I473-W478 HydrophobicContact CB-CZ3 4.12Å; I473-W478 HydrophobicContact CD1-CE3 4.27Å; I473-W478 HydrophobicContact CD1-CZ3 4.02Å; I473-W478 HydrophobicContact CG2-CE3 4.25Å; P474-W478 PolarHBondContact O-N 2.89Å; P474-W478 VanDerWaalsContact O-N 3.08Å; W478-I480 VanDerWaalsContact CD1-O 3.31Å; W478-I480 HydrophobicContact CH2-CG2 4.35Å; W478-I480 HydrophobicContact CZ2-CG2 3.44Å; W478-I480 VanDerWaalsContact CZ2-CG2 3.44Å; W478-I480 PolarHBondContact NE1-O 2.95Å; W478-I503 HydrophobicContact CH2-CG2 4.01Å; W478-I503 HydrophobicContact CZ2-CG2 3.34Å; W478-R505 VanDerWaalsContact CD1-NH2 3.28Å; W478-R505 HydrophobicContact CD2-CG 4.14Å; W478-R505 HydrophobicContact CE3-CG 4.17Å; W478-R505 HydrophobicContact CH2-CB 4.5Å; W478-R505 HydrophobicContact CH2-CG 4.1Å; W478-R505 HydrophobicContact CZ2-CG 4.04Å; W478-R505 HydrophobicContact CZ3-CB 4.33Å; W478-R505 HydrophobicContact CZ3-CG 4.15Å; W478-V571 HydrophobicContact CH2-CG2 4.05Å; W478-V571 HydrophobicContact CZ2-CG2 4.31Å; W478-W590 VanDerWaalsContact O-CZ2 3.28Å; W478-W590 WeakPolarHBondContact O-CZ2 3.4Å
479	W	92.6	Very high	90.1	Very high	55 Å²	55	58.1 Å²	58.1	21%	0.208	30%	0.296	C	S	.	.			trans	-108.9	-10.2	-169.4	57.4	-96.2	0	0	0	115.8	Q477 V571 V575 L577 I588 R600	Q477-W479 PolarHBondContact O-N 3.18Å; W479-V571 HydrophobicContact CH2-CG1 4.06Å; W479-V571 HydrophobicContact CZ2-CG1 3.46Å; W479-V571 VanDerWaalsContact CZ2-CG1 3.46Å; W479-V571 WeakPolarHBondContact CZ2-O 3.23Å; W479-V575 HydrophobicContact CH2-CG2 4.39Å; W479-L577 HydrophobicContact CE3-CD1 4.37Å; W479-L577 HydrophobicContact CE3-CG 3.96Å; W479-L577 HydrophobicContact CZ3-CD2 4.19Å; W479-L577 HydrophobicContact CZ3-CG 3.76Å; W479-I588 HydrophobicContact CB-CD1 4.27Å; W479-I588 HydrophobicContact CD2-CD1 3.97Å; W479-I588 HydrophobicContact CE3-CD1 3.4Å; W479-I588 HydrophobicContact CG-CD1 4.36Å; W479-I588 HydrophobicContact CZ3-CD1 4.06Å; W479-R600 VanDerWaalsContact O-CD 3.27Å; W479-R600 WeakPolarHBondContact O-CD 3.46Å; W479-R600 PolarHBondContact O-NH1 3.34Å
480	I	92.7	Very high	91.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.283	C	S	.	.			trans	-108.5	136.7	-175.2	-167.3	173.2	0	0	0	111.8	W478 V486 V500 I503 C510 V571 V575	W478-I480 VanDerWaalsContact CD1-O 3.31Å; W478-I480 HydrophobicContact CH2-CG2 4.35Å; W478-I480 HydrophobicContact CZ2-CG2 3.44Å; W478-I480 VanDerWaalsContact CZ2-CG2 3.44Å; W478-I480 PolarHBondContact NE1-O 2.95Å; I480-V486 HydrophobicContact CD1-CG1 3.83Å; I480-V486 HydrophobicContact CG1-CG1 4.41Å; I480-V500 HydrophobicContact CD1-CG2 3.77Å; I480-V500 HydrophobicContact CG1-CG2 4.02Å; I480-I503 HydrophobicContact CG2-CD1 4.27Å; I480-I503 WeakPolarHBondContact O-CD1 3.29Å; I480-C510 HydrophobicContact CD1-CB 4.03Å; I480-V571 HydrophobicContact CB-CG1 4.4Å; I480-V571 HydrophobicContact CD1-CG2 4.38Å; I480-V571 HydrophobicContact CG2-CB 4.44Å; I480-V571 HydrophobicContact CG2-CG1 3.7Å; I480-V571 HydrophobicContact CG2-CG2 3.78Å; I480-V575 HydrophobicContact CD1-CG2 4.3Å
481	F	92.7	Very high	91.7	Very high	34 Å²	34	55 Å²	55	15%	0.149	29%	0.292	C	S	.	.			trans	-132.2	159.7	-177.9	-63.7	-89.4	0	0	0	111.3	G483 D484 W590 I611	F481-G483 PolarHBondContact O-N 3.49Å; F481-D484 PolarHBondContact N-OD2 3.42Å; F481-D484 VanDerWaalsContact O-CB 3.29Å; F481-D484 WeakPolarHBondContact O-CB 3.4Å; F481-D484 PolarHBondContact O-N 3.22Å; F481-D484 VanDerWaalsContact O-N 3.11Å; F481-W590 HydrophobicContact CE2-CH2 4.21Å; F481-W590 HydrophobicContact CE2-CZ2 4.15Å; F481-W590 HydrophobicContact CZ-CH2 4.47Å; F481-W590 HydrophobicContact CZ-CZ2 4.4Å; F481-I611 HydrophobicContact CB-CG2 4.27Å; F481-I611 HydrophobicContact CD1-CG2 4.3Å; F481-I611 HydrophobicContact CD2-CG1 4.2Å; F481-I611 HydrophobicContact CD2-CG2 4.21Å; F481-I611 HydrophobicContact CE2-CD1 4.13Å; F481-I611 HydrophobicContact CE2-CG1 4.12Å; F481-I611 HydrophobicContact CG-CG2 4Å; F481-I611 HydrophobicContact CZ-CD1 4.18Å
482	R	90.1	Very high	92	Very high	43 Å²	43	52.1 Å²	52.1	16%	0.162	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	134.1	176.1	-175.4	177.1	-171.6	-132.2	-3.7	109.6	N501 R614 S615 E617	R482-N501 WeakPolarHBondContact CD-O 3.45Å; R482-N501 WeakPolarHBondContact CG-O 3.3Å; R482-N501 PolarHBondContact NE-O 3.37Å; R482-R614 HydrophobicContact CG-CG 4.36Å; R482-S615 PolarHBondContact O-N 3.3Å; R482-E617 IonicContact CZ-OE2 3.4Å; R482-E617 IonicContact NH1-OE2 3.01Å; R482-E617 PolarHBondContact NH1-OE2 3.48Å; R482-E617 IonicContact NH2-OE2 3.68Å
483	G	91.8	Very high	92.3	Very high	19 Å²	19	49.8 Å²	49.8	20%	0.196	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	90	-6.9	-174.9	0	0	0	0	0	114.7	F481 V500	F481-G483 PolarHBondContact O-N 3.49Å; G483-V500 PolarHBondContact N-O 3.49Å
484	D	94.3	Very high	92.4	Very high	6 Å²	6	55.7 Å²	55.7	3%	0.032	29%	0.285	C	S	.	.			trans	-67.3	145.5	175.9	-83.1	-32	0	0	0	111.1	F481 I499 V500 L577 R600 P612	F481-D484 PolarHBondContact N-OD2 3.42Å; F481-D484 VanDerWaalsContact O-CB 3.29Å; F481-D484 WeakPolarHBondContact O-CB 3.4Å; F481-D484 PolarHBondContact O-N 3.22Å; F481-D484 VanDerWaalsContact O-N 3.11Å; D484-I499 WeakPolarHBondContact O-CA 3.3Å; D484-V500 HydrophobicContact CB-CG2 4.26Å; D484-V500 WeakPolarHBondContact O-CG2 3.14Å; D484-V500 PolarHBondContact O-N 3.05Å; D484-L577 HydrophobicContact CB-CD2 3.57Å; D484-R600 IonicContact OD1-CZ 2.79Å; D484-R600 IonicContact OD1-NH1 2.66Å; D484-R600 PolarHBondContact OD1-NH1 3.4Å; D484-R600 IonicContact OD1-NH2 2.59Å; D484-R600 PolarHBondContact OD1-NH2 2.86Å; D484-R600 IonicContact OD2-CZ 3.6Å; D484-R600 IonicContact OD2-NH1 2.87Å; D484-R600 PolarHBondContact OD2-NH1 2.9Å; D484-R600 IonicContact OD2-NH2 2.7Å; D484-P612 HydrophobicContact CB-CG 4.4Å; D484-P612 WeakPolarHBondContact OD1-CD 3.39Å; D484-P612 WeakPolarHBondContact OD1-CG 3.24Å
485	R	95	Very high	92.6	Very high	122 Å²	122	54.7 Å²	54.7	46%	0.46	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.9	169.7	-174.1	179.2	-63.6	-83.4	-3.7	109.6	G498 V578	R485-G498 WeakPolarHBondContact CA-O 3.34Å; R485-V578 HydrophobicContact CG-CB 4.16Å; R485-V578 HydrophobicContact CG-CG2 4.13Å; R485-V578 PolarHBondContact O-N 2.69Å; R485-V578 VanDerWaalsContact O-N 3.15Å
486	V	96.3	Very high	93.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	152.4	179.7	-70.9	0	0	0	0	111.4	I480 Q497 G498 V500 V512 V575 A576 L577	I480-V486 HydrophobicContact CD1-CG1 3.83Å; I480-V486 HydrophobicContact CG1-CG1 4.41Å; V486-Q497 CarbonylContact O-C 3.58Å; V486-Q497 VanDerWaalsContact O-CA 3.23Å; V486-Q497 WeakPolarHBondContact O-CA 3.3Å; V486-G498 PolarHBondContact N-O 2.93Å; V486-G498 PolarHBondContact O-N 2.88Å; V486-V500 HydrophobicContact CB-CG2 4.32Å; V486-V500 HydrophobicContact CG1-CG2 3.65Å; V486-V500 HydrophobicContact CG2-CG2 3.69Å; V486-V512 HydrophobicContact CG2-CB 4.37Å; V486-V512 HydrophobicContact CG2-CG1 3.88Å; V486-V512 HydrophobicContact CG2-CG2 3.5Å; V486-V575 HydrophobicContact CB-CB 4.46Å; V486-A576 CarbonylContact C-O 3.54Å; V486-A576 VanDerWaalsContact CA-O 3.26Å; V486-A576 WeakPolarHBondContact CA-O 3.09Å; V486-L577 HydrophobicContact CG1-CD2 3.74Å
487	E	96.4	Very high	93.5	Very high	31 Å²	31	53.2 Å²	53.2	15%	0.145	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.8	167.3	-168.2	171.8	131.1	0	0	110.1	Q497 V575 A576 V578 P585	E487-Q497 HydrophobicContact CB-CG 4Å; E487-Q497 HydrophobicContact CG-CG 3.98Å; E487-Q497 PolarHBondContact OE2-NE2 2.91Å; E487-V575 WeakPolarHBondContact O-CA 3.4Å; E487-A576 PolarHBondContact N-O 2.72Å; E487-A576 PolarHBondContact O-N 3.07Å; E487-A576 VanDerWaalsContact O-N 3.12Å; E487-V578 HydrophobicContact CB-CG2 3.93Å; E487-P585 HydrophobicContact CB-CB 4.38Å; E487-P585 WeakPolarHBondContact OE2-CD 3.36Å
488	V	96.6	Very high	93.7	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120	176	179.9	0	0	0	0	109.3	V490 K494 G495 K496 L515 L569	V488-V490 WeakPolarHBondContact CG1-O 3.34Å; V488-K494 CarbonylContact O-C 3.54Å; V488-K494 WeakPolarHBondContact O-CA 3.1Å; V488-G495 PolarHBondContact O-N 3.39Å; V488-K496 PolarHBondContact N-O 3.23Å; V488-L515 HydrophobicContact CG2-CB 4.38Å; V488-L515 HydrophobicContact CG2-CD1 3.85Å; V488-L569 HydrophobicContact CG1-CD1 4.24Å; V488-L569 HydrophobicContact CG2-CD1 3.79Å
489	L	95.8	Very high	93.8	Very high	55 Å²	55	50.8 Å²	50.8	29%	0.288	26%	0.263	S	S	.	.			trans	-89.3	-28.3	-177.2	-60.2	-179.8	0	0	0	113.2	K494 E574 A576 P585	L489-K494 WeakPolarHBondContact O-CD 3.16Å; L489-K494 WeakPolarHBondContact O-CE 3.17Å; L489-K494 VanDerWaalsContact O-CG 3.3Å; L489-K494 WeakPolarHBondContact O-CG 3.47Å; L489-E574 PolarHBondContact N-O 3.23Å; L489-A576 HydrophobicContact CD1-CB 3.99Å; L489-A576 HydrophobicContact CD2-CB 4.23Å; L489-A576 HydrophobicContact CG-CB 4.29Å; L489-P585 HydrophobicContact CD2-CB 4.16Å; L489-P585 HydrophobicContact CD2-CG 4.41Å
490	V	93.8	Very high	93.8	Very high	81 Å²	81	48.1 Å²	48.1	49%	0.491	25%	0.253	S	S	.	.	S	Bend	trans	-137.2	147.3	-174.5	-174.7	0	0	0	0	109.6	V488 E574	V488-V490 WeakPolarHBondContact CG1-O 3.34Å; V490-E574 HydrophobicContact CB-CG 4.48Å
491	G	90.9	Very high	93.7	Very high	49 Å²	49	50.5 Å²	50.5	51%	0.505	27%	0.265	S	S	.	.	S	Bend	trans	106.8	-171	176.8	0	0	0	0	0	113.7	D493 K494	G491-D493 PolarHBondContact O-N 3.14Å; G491-K494 WeakPolarHBondContact O-CB 3.35Å; G491-K494 PolarHBondContact O-N 3.28Å
492	K	90.5	Very high	93.3	Very high	112 Å²	112	50.7 Å²	50.7	49%	0.487	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28	-172.5	-60	-171.1	-174.7	-168.6	0	113.7	D532 D533	K492-D532 WeakPolarHBondContact CE-OD1 3.2Å; K492-D532 IonicContact NZ-OD1 4Å; K492-D532 PolarHBondContact NZ-OD1 3.07Å; K492-D533 WeakPolarHBondContact CE-OD2 3.05Å; K492-D533 IonicContact NZ-OD1 2.85Å; K492-D533 PolarHBondContact NZ-OD1 3.41Å; K492-D533 IonicContact NZ-OD2 3.69Å; K492-D533 PolarHBondContact NZ-OD2 3.37Å
493	D	92.6	Very high	93.3	Very high	27 Å²	27	49.9 Å²	49.9	14%	0.144	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	25.1	-176.3	-70.5	-43.8	0	0	0	112.3	G491 G495 K496 L515 N516	G491-D493 PolarHBondContact O-N 3.14Å; D493-G495 PolarHBondContact O-N 3.04Å; D493-K496 HydrophobicContact CB-CB 4.48Å; D493-K496 HydrophobicContact CB-CD 3.97Å; D493-K496 HydrophobicContact CB-CG 4.48Å; D493-K496 VanDerWaalsContact O-CB 3.3Å; D493-K496 WeakPolarHBondContact O-CB 3.39Å; D493-K496 PolarHBondContact O-N 3.15Å; D493-K496 IonicContact OD1-NZ 3.6Å; D493-K496 PolarHBondContact OD1-NZ 3.4Å; D493-L515 HydrophobicContact CB-CD2 4.25Å; D493-N516 WeakPolarHBondContact OD2-CA 3.25Å; D493-N516 PolarHBondContact OD2-N 3.14Å
494	K	94.1	Very high	93.2	Very high	154 Å²	154	49 Å²	49	67%	0.67	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	132.6	178.2	178.4	175	-177.3	178.7	0	111.8	V488 L489 G491 K496	V488-K494 CarbonylContact O-C 3.54Å; V488-K494 WeakPolarHBondContact O-CA 3.1Å; L489-K494 WeakPolarHBondContact O-CD 3.16Å; L489-K494 WeakPolarHBondContact O-CE 3.17Å; L489-K494 VanDerWaalsContact O-CG 3.3Å; L489-K494 WeakPolarHBondContact O-CG 3.47Å; G491-K494 WeakPolarHBondContact O-CB 3.35Å; G491-K494 PolarHBondContact O-N 3.28Å; K494-K496 VanDerWaalsContact C-N 3.27Å; K494-K496 PolarHBondContact O-N 2.92Å
495	G	93.7	Very high	92.9	Very high	42 Å²	42	51.5 Å²	51.5	43%	0.433	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-4.1	-178.8	0	0	0	0	0	114.4	V488 D493	V488-G495 PolarHBondContact O-N 3.39Å; D493-G495 PolarHBondContact O-N 3.04Å
496	K	95.7	Very high	92.4	Very high	106 Å²	106	49.1 Å²	49.1	46%	0.461	26%	0.258	S	S	.	.			trans	-84.2	142.2	172.7	-61.4	-176.1	-172.6	165.9	0	110.3	V488 D493 K494 L515	V488-K496 PolarHBondContact N-O 3.23Å; D493-K496 HydrophobicContact CB-CB 4.48Å; D493-K496 HydrophobicContact CB-CD 3.97Å; D493-K496 HydrophobicContact CB-CG 4.48Å; D493-K496 VanDerWaalsContact O-CB 3.3Å; D493-K496 WeakPolarHBondContact O-CB 3.39Å; D493-K496 PolarHBondContact O-N 3.15Å; D493-K496 IonicContact OD1-NZ 3.6Å; D493-K496 PolarHBondContact OD1-NZ 3.4Å; K494-K496 VanDerWaalsContact C-N 3.27Å; K494-K496 PolarHBondContact O-N 2.92Å; K496-L515 HydrophobicContact CB-CD1 3.94Å; K496-L515 HydrophobicContact CB-CD2 3.87Å; K496-L515 HydrophobicContact CD-CD2 3.87Å
497	Q	95.1	Very high	92	Very high	67 Å²	67	50.8 Å²	50.8	31%	0.313	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	142.8	176.8	-61.4	-178.5	-1.4	0	0	110.5	V486 E487 V578 F583	V486-Q497 CarbonylContact O-C 3.58Å; V486-Q497 VanDerWaalsContact O-CA 3.23Å; V486-Q497 WeakPolarHBondContact O-CA 3.3Å; E487-Q497 HydrophobicContact CB-CG 4Å; E487-Q497 HydrophobicContact CG-CG 3.98Å; E487-Q497 PolarHBondContact OE2-NE2 2.91Å; Q497-V578 HydrophobicContact CG-CG2 3.95Å; Q497-F583 PolarHBondContact NE2-O 3.3Å
498	G	94.3	Very high	91.9	Very high	9 Å²	9	49.4 Å²	49.4	9%	0.093	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	175.6	178.2	0	0	0	0	0	111.8	R485 V486	R485-G498 WeakPolarHBondContact CA-O 3.34Å; V486-G498 PolarHBondContact N-O 2.93Å; V486-G498 PolarHBondContact O-N 2.88Å
499	I	94.8	Very high	91.7	Very high	52 Å²	52	52 Å²	52	27%	0.267	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135	-179.4	-61.9	173.4	0	0	0	108.9	D484 N501 V512 E513	D484-I499 WeakPolarHBondContact O-CA 3.3Å; I499-N501 PolarHBondContact O-N 2.79Å; I499-V512 WeakPolarHBondContact O-CA 3.31Å; I499-E513 PolarHBondContact O-N 3.45Å
500	V	93.4	Very high	91.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	114.5	174.5	-179.1	0	0	0	0	109.3	I480 G483 D484 V486 I503 C510	I480-V500 HydrophobicContact CD1-CG2 3.77Å; I480-V500 HydrophobicContact CG1-CG2 4.02Å; G483-V500 PolarHBondContact N-O 3.49Å; D484-V500 HydrophobicContact CB-CG2 4.26Å; D484-V500 WeakPolarHBondContact O-CG2 3.14Å; D484-V500 PolarHBondContact O-N 3.05Å; V486-V500 HydrophobicContact CB-CG2 4.32Å; V486-V500 HydrophobicContact CG1-CG2 3.65Å; V486-V500 HydrophobicContact CG2-CG2 3.69Å; V500-I503 HydrophobicContact CG1-CD1 3.89Å; V500-I503 HydrophobicContact CG1-CG1 3.64Å; V500-C510 HydrophobicContact CG1-CB 4.17Å
501	N	89.2	Confident	91.5	Very high	50 Å²	50	46.2 Å²	46.2	27%	0.267	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-40.6	-180	-173.5	19.3	0	0	0	112	R482 I499 F511	R482-N501 WeakPolarHBondContact CD-O 3.45Å; R482-N501 WeakPolarHBondContact CG-O 3.3Å; R482-N501 PolarHBondContact NE-O 3.37Å; I499-N501 PolarHBondContact O-N 2.79Å; N501-F511 PolarHBondContact N-O 3.3Å
502	Y	85.9	Confident	91.6	Very high	38 Å²	38	43.9 Å²	43.9	15%	0.149	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	148.1	-172.8	-179.7	-115.2	0	0	0	111.9	E438 R440 V504 C510 F511	E438-Y502 WeakPolarHBondContact O-CE1 3.48Å; E438-Y502 PolarHBondContact O-OH 3.2Å; R440-Y502 PolarHBondContact NE-OH 3.12Å; R440-Y502 PolarHBondContact NH1-OH 3.23Å; R440-Y502 PolarHBondContact NH2-OH 2.78Å; Y502-V504 HydrophobicContact CD1-CG2 4.15Å; Y502-V504 HydrophobicContact CE1-CG2 3.44Å; Y502-V504 VanDerWaalsContact CE1-CG2 3.44Å; Y502-C510 CarbonylContact O-C 3.55Å; Y502-C510 WeakPolarHBondContact O-CA 3.38Å; Y502-F511 AromaticContact CD1-CD2 3.47Å; Y502-F511 HydrophobicContact CD1-CD2 3.47Å; Y502-F511 VanDerWaalsContact CD1-CD2 3.47Å; Y502-F511 AromaticContact CD1-CE2 3.62Å; Y502-F511 HydrophobicContact CD1-CE2 3.62Å; Y502-F511 HydrophobicContact CD1-CG 4.21Å; Y502-F511 HydrophobicContact CD1-CZ 4.46Å; Y502-F511 HydrophobicContact CE1-CD2 4.35Å; Y502-F511 HydrophobicContact CE1-CE2 4.05Å; Y502-F511 HydrophobicContact CG-CD2 4.31Å; Y502-F511 PolarHBondContact O-N 3.49Å
503	I	89.5	Confident	91.7	Very high	25 Å²	25	43.6 Å²	43.6	13%	0.128	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	138.5	-176	-65	172.7	0	0	0	109.3	W478 I480 V500 R505 W509 C510	W478-I503 HydrophobicContact CH2-CG2 4.01Å; W478-I503 HydrophobicContact CZ2-CG2 3.34Å; I480-I503 HydrophobicContact CG2-CD1 4.27Å; I480-I503 WeakPolarHBondContact O-CD1 3.29Å; V500-I503 HydrophobicContact CG1-CD1 3.89Å; V500-I503 HydrophobicContact CG1-CG1 3.64Å; I503-R505 HydrophobicContact CG2-CG 4.19Å; I503-W509 WeakPolarHBondContact CA-O 3.39Å; I503-C510 HydrophobicContact CG1-CB 4.39Å
504	V	88.6	Confident	91.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	100.6	170.3	-174.8	0	0	0	0	107.8	Y502 E506 R507 N508 W509 F511	Y502-V504 HydrophobicContact CD1-CG2 4.15Å; Y502-V504 HydrophobicContact CE1-CG2 3.44Å; Y502-V504 VanDerWaalsContact CE1-CG2 3.44Å; V504-E506 VanDerWaalsContact C-N 3.32Å; V504-E506 PolarHBondContact O-N 3.28Å; V504-R507 HydrophobicContact CG1-CB 4.36Å; V504-R507 PolarHBondContact O-N 2.75Å; V504-N508 PolarHBondContact O-N 2.84Å; V504-N508 VanDerWaalsContact O-N 3.13Å; V504-W509 HydrophobicContact CB-CB 4.21Å; V504-W509 PolarHBondContact N-O 3.03Å; V504-W509 PolarHBondContact O-N 3.38Å; V504-F511 HydrophobicContact CG2-CE2 4.22Å
505	R	87.9	Confident	91.4	Very high	60 Å²	60	38.1 Å²	38.1	23%	0.226	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-65.3	-37.3	-175.3	-73.8	-168.8	168.5	-171	-1.9	111.9	D475 W478 I503 R507 N508	D475-R505 IonicContact OD1-CZ 3.59Å; D475-R505 IonicContact OD1-NH1 3.25Å; D475-R505 PolarHBondContact OD1-NH1 3.19Å; W478-R505 VanDerWaalsContact CD1-NH2 3.28Å; W478-R505 HydrophobicContact CD2-CG 4.14Å; W478-R505 HydrophobicContact CE3-CG 4.17Å; W478-R505 HydrophobicContact CH2-CB 4.5Å; W478-R505 HydrophobicContact CH2-CG 4.1Å; W478-R505 HydrophobicContact CZ2-CG 4.04Å; W478-R505 HydrophobicContact CZ3-CB 4.33Å; W478-R505 HydrophobicContact CZ3-CG 4.15Å; I503-R505 HydrophobicContact CG2-CG 4.19Å; R505-R507 PolarHBondContact O-N 3.48Å; R505-R507 VanDerWaalsContact O-N 3.08Å; R505-N508 PolarHBondContact O-N 2.8Å; R505-N508 VanDerWaalsContact O-N 3.07Å; R505-N508 PolarHBondContact O-OD1 2.81Å
506	E	86.2	Confident	91.3	Very high	71 Å²	71	37.5 Å²	37.5	33%	0.332	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-66.7	-15.1	-176.5	-57	98.2	145.3	0	0	113.6	Y436 V504	Y436-E506 HydrophobicContact CD1-CB 3.85Å; Y436-E506 HydrophobicContact CD1-CG 3.95Å; Y436-E506 HydrophobicContact CD2-CB 3.71Å; Y436-E506 HydrophobicContact CD2-CG 4.22Å; Y436-E506 HydrophobicContact CE1-CB 3.98Å; Y436-E506 HydrophobicContact CE1-CG 3.57Å; Y436-E506 WeakPolarHBondContact CE1-OE1 3.48Å; Y436-E506 HydrophobicContact CE2-CB 3.87Å; Y436-E506 HydrophobicContact CE2-CG 3.89Å; Y436-E506 HydrophobicContact CG-CB 3.66Å; Y436-E506 HydrophobicContact CG-CG 4.21Å; Y436-E506 VanDerWaalsContact CZ-CG 3.49Å; Y436-E506 PolarHBondContact OH-OE1 2.86Å; V504-E506 VanDerWaalsContact C-N 3.32Å; V504-E506 PolarHBondContact O-N 3.28Å
507	R	88.1	Confident	90.9	Very high	35 Å²	35	34 Å²	34	13%	0.132	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-121.2	7.6	173.8	-70.7	-158.5	138.7	178.3	-10.7	114	Y436 V504 R505 W509	Y436-R507 WeakPolarHBondContact O-CD 3.46Å; Y436-R507 PolarHBondContact O-NE 3.23Å; Y436-R507 PolarHBondContact O-NH1 2.98Å; V504-R507 HydrophobicContact CG1-CB 4.36Å; V504-R507 PolarHBondContact O-N 2.75Å; R505-R507 PolarHBondContact O-N 3.48Å; R505-R507 VanDerWaalsContact O-N 3.08Å; R507-W509 HydrophobicContact CB-CD2 3.64Å; R507-W509 HydrophobicContact CB-CE3 3.97Å; R507-W509 HydrophobicContact CB-CG 3.9Å; R507-W509 HydrophobicContact CB-CZ2 4.47Å; R507-W509 VanDerWaalsContact CD-CH2 3.49Å; R507-W509 HydrophobicContact CG-CE3 4.49Å; R507-W509 VanDerWaalsContact O-CD1 3.26Å; R507-W509 PolarHBondContact O-N 2.84Å
508	N	92.6	Very high	90.4	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	38.6	-172.8	-54.4	-36.3	0	0	0	112.4	V470 E471 I473 V504 R505 V571 I572	V470-N508 VanDerWaalsContact CG1-ND2 3.31Å; V470-N508 WeakPolarHBondContact CG1-ND2 3.13Å; E471-N508 PolarHBondContact O-ND2 2.94Å; I473-N508 HydrophobicContact CD1-CB 4.34Å; I473-N508 PolarHBondContact N-OD1 3.38Å; V504-N508 PolarHBondContact O-N 2.84Å; V504-N508 VanDerWaalsContact O-N 3.13Å; R505-N508 PolarHBondContact O-N 2.8Å; R505-N508 VanDerWaalsContact O-N 3.07Å; R505-N508 PolarHBondContact O-OD1 2.81Å; N508-V571 WeakPolarHBondContact O-CB 3.42Å; N508-V571 WeakPolarHBondContact O-CG2 3.46Å; N508-V571 PolarHBondContact O-N 2.79Å; N508-I572 HydrophobicContact CB-CD1 4.43Å
509	W	92.6	Very high	89.6	Confident	56 Å²	56	37.1 Å²	37.1	21%	0.212	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	143.8	-179	-70.5	-18.9	0	0	0	112.1	I503 V504 R507 P568 L569	I503-W509 WeakPolarHBondContact CA-O 3.39Å; V504-W509 HydrophobicContact CB-CB 4.21Å; V504-W509 PolarHBondContact N-O 3.03Å; V504-W509 PolarHBondContact O-N 3.38Å; R507-W509 HydrophobicContact CB-CD2 3.64Å; R507-W509 HydrophobicContact CB-CE3 3.97Å; R507-W509 HydrophobicContact CB-CG 3.9Å; R507-W509 HydrophobicContact CB-CZ2 4.47Å; R507-W509 VanDerWaalsContact CD-CH2 3.49Å; R507-W509 HydrophobicContact CG-CE3 4.49Å; R507-W509 VanDerWaalsContact O-CD1 3.26Å; R507-W509 PolarHBondContact O-N 2.84Å; W509-P568 HydrophobicContact CB-CB 3.78Å; W509-P568 HydrophobicContact CD2-CB 3.53Å; W509-P568 HydrophobicContact CD2-CG 3.9Å; W509-P568 HydrophobicContact CE3-CB 3.84Å; W509-P568 HydrophobicContact CE3-CG 3.98Å; W509-P568 HydrophobicContact CG-CB 3.54Å; W509-P568 HydrophobicContact CG-CG 4.39Å; W509-P568 HydrophobicContact CH2-CG 4.31Å; W509-P568 HydrophobicContact CZ2-CG 4.28Å; W509-P568 HydrophobicContact CZ3-CG 4.18Å; W509-L569 CarbonylContact C-O 3.54Å; W509-L569 WeakPolarHBondContact CA-O 3.39Å
510	C	92.7	Very high	88.2	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.5	165.7	65.9	0	0	0	0	110.7	I480 V500 Y502 I503 L569 V571	I480-C510 HydrophobicContact CD1-CB 4.03Å; V500-C510 HydrophobicContact CG1-CB 4.17Å; Y502-C510 CarbonylContact O-C 3.55Å; Y502-C510 WeakPolarHBondContact O-CA 3.38Å; I503-C510 HydrophobicContact CG1-CB 4.39Å; C510-L569 PolarHBondContact N-O 3.03Å; C510-L569 PolarHBondContact O-N 2.85Å; C510-V571 HydrophobicContact CB-CG2 3.98Å
511	F	93.5	Very high	86.5	Confident	14 Å²	14	37.5 Å²	37.5	6%	0.061	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.6	175.3	-66.7	-107.4	0	0	0	108	E438 N501 Y502 V504 E566 P568	E438-F511 HydrophobicContact CB-CE1 4.4Å; E438-F511 HydrophobicContact CB-CE2 4.46Å; E438-F511 HydrophobicContact CB-CZ 3.72Å; N501-F511 PolarHBondContact N-O 3.3Å; Y502-F511 AromaticContact CD1-CD2 3.47Å; Y502-F511 HydrophobicContact CD1-CD2 3.47Å; Y502-F511 VanDerWaalsContact CD1-CD2 3.47Å; Y502-F511 AromaticContact CD1-CE2 3.62Å; Y502-F511 HydrophobicContact CD1-CE2 3.62Å; Y502-F511 HydrophobicContact CD1-CG 4.21Å; Y502-F511 HydrophobicContact CD1-CZ 4.46Å; Y502-F511 HydrophobicContact CE1-CD2 4.35Å; Y502-F511 HydrophobicContact CE1-CE2 4.05Å; Y502-F511 HydrophobicContact CG-CD2 4.31Å; Y502-F511 PolarHBondContact O-N 3.49Å; V504-F511 HydrophobicContact CG2-CE2 4.22Å; F511-E566 HydrophobicContact CD1-CB 4.13Å; F511-P568 HydrophobicContact CE1-CB 4.07Å; F511-P568 HydrophobicContact CE1-CG 4.36Å; F511-P568 HydrophobicContact CE2-CB 3.87Å; F511-P568 HydrophobicContact CZ-CB 3.62Å; F511-P568 HydrophobicContact CZ-CG 4.06Å
512	V	93.6	Very high	84.6	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.9	-176.1	-173.3	0	0	0	0	108.2	V486 I499 G514 L515 E566 L569	V486-V512 HydrophobicContact CG2-CB 4.37Å; V486-V512 HydrophobicContact CG2-CG1 3.88Å; V486-V512 HydrophobicContact CG2-CG2 3.5Å; I499-V512 WeakPolarHBondContact O-CA 3.31Å; V512-G514 PolarHBondContact O-N 3.04Å; V512-L515 HydrophobicContact CB-CB 4.19Å; V512-L515 HydrophobicContact CG1-CB 4.14Å; V512-L515 HydrophobicContact CG1-CD1 3.8Å; V512-L515 HydrophobicContact CG1-CG 4.18Å; V512-L515 PolarHBondContact O-N 3.39Å; V512-L515 VanDerWaalsContact O-N 3.09Å; V512-E566 WeakPolarHBondContact O-CG 3.26Å; V512-L569 HydrophobicContact CG2-CD1 4.05Å
513	E	91.8	Very high	82.6	Confident	105 Å²	105	41.7 Å²	41.7	49%	0.491	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	120.1	-172.3	-170.2	174.1	174.9	0	0	111.7	I499 L515	I499-E513 PolarHBondContact O-N 3.45Å; E513-L515 PolarHBondContact O-N 3.19Å; E513-L515 VanDerWaalsContact O-N 3.15Å
514	G	89.4	Confident	80.4	Confident	49 Å²	49	43.2 Å²	43.2	51%	0.505	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	-0.8	178.5	0	0	0	0	0	117	V512 E566	V512-G514 PolarHBondContact O-N 3.04Å; G514-E566 PolarHBondContact N-OE1 2.92Å; G514-E566 VanDerWaalsContact N-OE1 3.1Å
515	L	92	Very high	78.1	Confident	18 Å²	18	47.9 Å²	47.9	9%	0.094	23%	0.231	C	C	.	.	S	Bend	trans	-108.4	155.7	179.6	-60.8	-174.2	0	0	0	111.9	V488 D493 K496 V512 E513 A517	V488-L515 HydrophobicContact CG2-CB 4.38Å; V488-L515 HydrophobicContact CG2-CD1 3.85Å; D493-L515 HydrophobicContact CB-CD2 4.25Å; K496-L515 HydrophobicContact CB-CD1 3.94Å; K496-L515 HydrophobicContact CB-CD2 3.87Å; K496-L515 HydrophobicContact CD-CD2 3.87Å; V512-L515 HydrophobicContact CB-CB 4.19Å; V512-L515 HydrophobicContact CG1-CB 4.14Å; V512-L515 HydrophobicContact CG1-CD1 3.8Å; V512-L515 HydrophobicContact CG1-CG 4.18Å; V512-L515 PolarHBondContact O-N 3.39Å; V512-L515 VanDerWaalsContact O-N 3.09Å; E513-L515 PolarHBondContact O-N 3.19Å; E513-L515 VanDerWaalsContact O-N 3.15Å; L515-A517 PolarHBondContact O-N 3.05Å; L515-A517 VanDerWaalsContact O-N 3.14Å
516	N	91.5	Very high	75.8	Confident	29 Å²	29	51.5 Å²	51.5	16%	0.155	26%	0.255	C	S	.	.	S	Bend	trans	50.5	35.6	-173	-164.7	30.3	0	0	0	112.2	D493 R567 P568 L569	D493-N516 WeakPolarHBondContact OD2-CA 3.25Å; D493-N516 PolarHBondContact OD2-N 3.14Å; N516-R567 WeakPolarHBondContact O-CB 3.48Å; N516-R567 PolarHBondContact O-N 3.34Å; N516-P568 PolarHBondContact ND2-O 3.1Å; N516-L569 HydrophobicContact CB-CD1 4.1Å; N516-L569 HydrophobicContact CB-CD2 4.05Å; N516-L569 HydrophobicContact CB-CG 4.05Å; N516-L569 WeakPolarHBondContact ND2-CD2 3.33Å
517	A	87.2	Confident	73.4	Confident	33 Å²	33	53.7 Å²	53.7	27%	0.273	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132.8	-173.1	0	0	0	0	0	111.6	L515 K564 R565	L515-A517 PolarHBondContact O-N 3.05Å; L515-A517 VanDerWaalsContact O-N 3.14Å; A517-K564 HydrophobicContact CB-CB 4.25Å; A517-R565 CarbonylContact C-O 3.31Å; A517-R565 VanDerWaalsContact CA-O 3.27Å; A517-R565 WeakPolarHBondContact CA-O 3.39Å
518	V	83.8	Confident	71.1	Confident	8 Å²	8	54.7 Å²	54.7	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	146.8	170.5	-72.3	0	0	0	0	112	L520 K564 R565 R567	V518-L520 HydrophobicContact CG2-CD2 4.5Å; V518-L520 HydrophobicContact CG2-CG 4.32Å; V518-L520 PolarHBondContact O-N 2.94Å; V518-K564 CarbonylContact O-C 3.55Å; V518-K564 WeakPolarHBondContact O-CA 3.47Å; V518-R565 WeakPolarHBondContact CG2-O 3.37Å; V518-R565 PolarHBondContact N-O 3.32Å; V518-R565 PolarHBondContact O-N 3.16Å; V518-R567 HydrophobicContact CG1-CG 4.14Å; V518-R567 VanDerWaalsContact CG1-NE 3.26Å; V518-R567 HydrophobicContact CG2-CG 4.02Å
519	R	77.4	Confident	68.6	Low	133 Å²	133	58.1 Å²	58.1	50%	0.502	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	108.5	174	-62.8	175.4	-178.9	-150.5	7.9	107.7	M562 K564	R519-M562 HydrophobicContact CB-CG 3.9Å; R519-M562 HydrophobicContact CB-SD 3.97Å; R519-M562 VanDerWaalsContact CD-SD 3.57Å; R519-M562 HydrophobicContact CG-CG 4.3Å; R519-M562 HydrophobicContact CG-SD 4.03Å; R519-K564 HydrophobicContact CG-CG 4.49Å
520	L	65.1	Low	66.1	Low	7 Å²	7	58.6 Å²	58.6	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.6	171.6	-68.4	168.2	0	0	0	108	V518 F522 P528 I530 M562 I563 R565	V518-L520 HydrophobicContact CG2-CD2 4.5Å; V518-L520 HydrophobicContact CG2-CG 4.32Å; V518-L520 PolarHBondContact O-N 2.94Å; L520-F522 PolarHBondContact O-N 2.7Å; L520-P528 HydrophobicContact CB-CB 4.23Å; L520-P528 HydrophobicContact CD1-CB 4.17Å; L520-P528 HydrophobicContact CD2-CB 3.63Å; L520-P528 HydrophobicContact CD2-CG 4.34Å; L520-P528 HydrophobicContact CG-CB 4.21Å; L520-I530 HydrophobicContact CD2-CG1 3.89Å; L520-M562 WeakPolarHBondContact O-CA 3.46Å; L520-I563 PolarHBondContact N-O 3.37Å; L520-I563 PolarHBondContact O-N 2.87Å; L520-R565 HydrophobicContact CD1-CB 3.56Å; L520-R565 HydrophobicContact CD1-CG 4.07Å; L520-R565 HydrophobicContact CG-CB 4.38Å
521	F	57.3	Low	63.8	Low	53 Å²	53	61.5 Å²	61.5	23%	0.232	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	108.2	164.4	-81.7	-91.6	0	0	0	107.5	F523 I531 M562	F521-F523 VanDerWaalsContact C-N 3.29Å; F521-F523 HydrophobicContact CB-CD2 3.97Å; F521-F523 HydrophobicContact CB-CE2 3.72Å; F521-F523 HydrophobicContact CG-CE2 4.42Å; F521-F523 PolarHBondContact O-N 3.22Å; F521-I531 HydrophobicContact CD2-CD1 3.32Å; F521-I531 HydrophobicContact CD2-CG1 4.05Å; F521-I531 HydrophobicContact CE2-CD1 3.54Å; F521-I531 HydrophobicContact CE2-CG1 4.47Å; F521-I531 HydrophobicContact CG-CD1 4.29Å; F521-M562 HydrophobicContact CE1-CB 4.2Å; F521-M562 HydrophobicContact CE2-CG 4.25Å; F521-M562 HydrophobicContact CE2-SD 4.07Å; F521-M562 HydrophobicContact CZ-CB 4.29Å; F521-M562 HydrophobicContact CZ-CG 4.24Å; F521-M562 HydrophobicContact CZ-SD 3.91Å
522	F	50.4	Low	61.4	Low	114 Å²	114	62.6 Å²	62.6	50%	0.5	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	92.5	168.2	-110.8	-92.6	0	0	0	107.6	L520 T561 I563	L520-F522 PolarHBondContact O-N 2.7Å; F522-T561 PolarHBondContact N-O 3.31Å; F522-I563 HydrophobicContact CD2-CD1 3.92Å; F522-I563 HydrophobicContact CE2-CD1 4.46Å; F522-I563 HydrophobicContact CG-CD1 4.38Å
523	F	43	Very low	59.1	Low	62 Å²	62	68.9 Å²	68.9	27%	0.272	35%	0.351	S	S	.	.			trans	-77.2	126.9	159	-75.2	-83.6	0	0	0	106.8	F521 E525 I553	F521-F523 VanDerWaalsContact C-N 3.29Å; F521-F523 HydrophobicContact CB-CD2 3.97Å; F521-F523 HydrophobicContact CB-CE2 3.72Å; F521-F523 HydrophobicContact CG-CE2 4.42Å; F521-F523 PolarHBondContact O-N 3.22Å; F523-E525 PolarHBondContact O-N 3.41Å; F523-I553 HydrophobicContact CD1-CG2 4.27Å; F523-I553 HydrophobicContact CE1-CG2 4.19Å
524	L	43.3	Very low	56.4	Low	56 Å²	56	67.2 Å²	67.2	29%	0.293	36%	0.362	S	S	.	.	S	Bend	trans	-62.5	3.1	-178	-81.3	149.3	0	0	0	114.2	F47 L50 F558	F47-L524 HydrophobicContact CD1-CD1 4.26Å; F47-L524 HydrophobicContact CD2-CB 3.71Å; F47-L524 HydrophobicContact CD2-CD1 4.12Å; F47-L524 HydrophobicContact CD2-CD2 4.01Å; F47-L524 HydrophobicContact CD2-CG 4.17Å; F47-L524 HydrophobicContact CE1-CD1 3.83Å; F47-L524 HydrophobicContact CE2-CB 3.16Å; F47-L524 HydrophobicContact CE2-CD1 3.72Å; F47-L524 HydrophobicContact CE2-CD2 4.25Å; F47-L524 HydrophobicContact CE2-CG 3.89Å; F47-L524 HydrophobicContact CG-CD1 4.4Å; F47-L524 HydrophobicContact CG-CD2 4.46Å; F47-L524 HydrophobicContact CZ-CB 3.77Å; F47-L524 HydrophobicContact CZ-CD1 3.54Å; F47-L524 HydrophobicContact CZ-CG 4.21Å; L50-L524 HydrophobicContact CB-CD2 4.06Å; L50-L524 HydrophobicContact CD1-CD2 3.48Å; L50-L524 VanDerWaalsContact CD1-CD2 3.48Å; L50-L524 HydrophobicContact CG-CD2 4.34Å; L524-F558 HydrophobicContact CD1-CE1 4.43Å
525	E	39.9	Very low	53.7	Low	98 Å²	98	72.8 Å²	72.8	46%	0.458	37%	0.373	S	S	.	.	S	Bend	trans	-133.5	106.6	171.5	-69.7	-177.6	158.7	0	0	109.7	F523	F523-E525 PolarHBondContact O-N 3.41Å
526	N	39.5	Very low	50.9	Low	136 Å²	136	75.4 Å²	75.4	73%	0.727	39%	0.389	S	S	*	.	S	Bend	trans	63.4	120.9	160.9	-60.6	-27	0	0	0	118.4
527	M	37	Very low	48	Very low	118 Å²	118	81.2 Å²	81.2	58%	0.581	42%	0.417	S	S	*	.	S	Bend	trans	60.9	116.5	166.8	-66.6	-80.4	-99.8	0	0	115	R529	M527-R529 PolarHBondContact O-N 3.22Å; M527-R529 VanDerWaalsContact O-N 3.15Å
528	P	39.4	Very low	45.2	Very low	56 Å²	56	85.1 Å²	85.1	36%	0.364	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-64.1	122.4	176.6	30.4	-35.1	0	0	0	108.9	L520 I530	L520-P528 HydrophobicContact CB-CB 4.23Å; L520-P528 HydrophobicContact CD1-CB 4.17Å; L520-P528 HydrophobicContact CD2-CB 3.63Å; L520-P528 HydrophobicContact CD2-CG 4.34Å; L520-P528 HydrophobicContact CG-CB 4.21Å; P528-I530 PolarHBondContact O-N 3.03Å
529	R	39.4	Very low	42.7	Very low	75 Å²	75	90.2 Å²	90.2	28%	0.283	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.6	171.4	-75.6	-171.1	-126.6	-143	-0.3	108.9	M527 I531	M527-R529 PolarHBondContact O-N 3.22Å; M527-R529 VanDerWaalsContact O-N 3.15Å; R529-I531 PolarHBondContact O-N 2.91Å
530	I	40.7	Very low	40.4	Very low	65 Å²	65	91.2 Å²	91.2	33%	0.333	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	116.7	167.2	-63.9	177.1	0	0	0	107.4	L520 P528	L520-I530 HydrophobicContact CD2-CG1 3.89Å; P528-I530 PolarHBondContact O-N 3.03Å
531	I	44.4	Very low	38.8	Very low	61 Å²	61	95 Å²	95	31%	0.313	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	105.5	167.9	-52.4	-170.7	0	0	0	107.2	F521 R529	F521-I531 HydrophobicContact CD2-CD1 3.32Å; F521-I531 HydrophobicContact CD2-CG1 4.05Å; F521-I531 HydrophobicContact CE2-CD1 3.54Å; F521-I531 HydrophobicContact CE2-CG1 4.47Å; F521-I531 HydrophobicContact CG-CD1 4.29Å; R529-I531 PolarHBondContact O-N 2.91Å
532	D	42.6	Very low	37.6	Very low	38 Å²	38	96.4 Å²	96.4	20%	0.203	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.9	169.5	-103.4	-33.7	0	0	0	108.6	K492 G534 K535 R567	K492-D532 WeakPolarHBondContact CE-OD1 3.2Å; K492-D532 IonicContact NZ-OD1 4Å; K492-D532 PolarHBondContact NZ-OD1 3.07Å; D532-G534 VanDerWaalsContact C-N 3.3Å; D532-G534 PolarHBondContact O-N 3.45Å; D532-K535 PolarHBondContact O-N 2.94Å; D532-R567 IonicContact OD2-CZ 3.27Å; D532-R567 VanDerWaalsContact OD2-CZ 3.23Å; D532-R567 IonicContact OD2-NH1 3.05Å; D532-R567 PolarHBondContact OD2-NH1 3.13Å; D532-R567 IonicContact OD2-NH2 2.67Å; D532-R567 PolarHBondContact OD2-NH2 3.08Å
533	D	46	Very low	36.8	Very low	132 Å²	132	94.8 Å²	94.8	71%	0.706	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.9	45.6	166.9	-53.9	-22	0	0	0	115.6	K492 K535	K492-D533 WeakPolarHBondContact CE-OD2 3.05Å; K492-D533 IonicContact NZ-OD1 2.85Å; K492-D533 PolarHBondContact NZ-OD1 3.41Å; K492-D533 IonicContact NZ-OD2 3.69Å; K492-D533 PolarHBondContact NZ-OD2 3.37Å; D533-K535 VanDerWaalsContact C-N 3.26Å; D533-K535 PolarHBondContact O-N 3.39Å
534	G	35.4	Very low	36.4	Very low	71 Å²	71	99.3 Å²	99.3	73%	0.732	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-0.1	176.6	0	0	0	0	0	115.4	D532	D532-G534 VanDerWaalsContact C-N 3.3Å; D532-G534 PolarHBondContact O-N 3.45Å
535	K	31.6	Very low	36	Very low	166 Å²	166	104.3 Å²	104.3	72%	0.722	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.1	120.7	172.7	-73.5	-179.4	178.9	177.3	0	110.3	D532 D533 M537	D532-K535 PolarHBondContact O-N 2.94Å; D533-K535 VanDerWaalsContact C-N 3.26Å; D533-K535 PolarHBondContact O-N 3.39Å; K535-M537 PolarHBondContact O-N 3.39Å
536	V	34	Very low	35.9	Very low	72 Å²	72	101.8 Å²	101.8	44%	0.436	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	104.3	172	-176.1	0	0	0	0	107.6	F538	V536-F538 HydrophobicContact CB-CD2 4.46Å; V536-F538 HydrophobicContact CB-CE2 4.19Å; V536-F538 HydrophobicContact CG1-CD2 3.86Å; V536-F538 HydrophobicContact CG1-CE2 3.59Å; V536-F538 HydrophobicContact CG1-CZ 4.14Å; V536-F538 PolarHBondContact O-N 3.18Å
537	M	30.4	Very low	35.7	Very low	152 Å²	152	101.2 Å²	101.2	75%	0.749	54%	0.536	S	S	*	.			trans	-76.4	107.3	169.5	-79.8	-92.6	-69.6	0	0	108.4	K535	K535-M537 PolarHBondContact O-N 3.39Å
538	F	29.8	Very low	35.7	Very low	115 Å²	115	103.4 Å²	103.4	50%	0.504	55%	0.545	S	S	.	.			trans	-79.6	121.7	170.3	-81.7	-90.9	0	0	0	109.1	V536 E540	V536-F538 HydrophobicContact CB-CD2 4.46Å; V536-F538 HydrophobicContact CB-CE2 4.19Å; V536-F538 HydrophobicContact CG1-CD2 3.86Å; V536-F538 HydrophobicContact CG1-CE2 3.59Å; V536-F538 HydrophobicContact CG1-CZ 4.14Å; V536-F538 PolarHBondContact O-N 3.18Å; F538-E540 PolarHBondContact O-N 2.9Å
539	C	29.4	Very low	35.8	Very low	115 Å²	115	103.6 Å²	103.6	78%	0.777	55%	0.545	S	S	*	.			trans	-74.8	100.8	158	-148.1	0	0	0	0	106.3	V541	C539-V541 PolarHBondContact O-N 2.86Å
540	E	29.2	Very low	35.8	Very low	154 Å²	154	102.2 Å²	102.2	72%	0.72	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	98.6	175.4	-76.9	-177.3	145.8	0	0	109.4	F538 L543	F538-E540 PolarHBondContact O-N 2.9Å; E540-L543 HydrophobicContact CG-CD1 4.1Å
541	V	32.6	Very low	35.7	Very low	85 Å²	85	100.6 Å²	100.6	52%	0.515	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-161.5	-4.5	144.6	138	0	0	0	0	114.8	F456 C539	F456-V541 HydrophobicContact CD2-CG1 4.29Å; F456-V541 HydrophobicContact CE1-CB 4.43Å; F456-V541 HydrophobicContact CE1-CG2 3.68Å; F456-V541 HydrophobicContact CE2-CB 3.44Å; F456-V541 VanDerWaalsContact CE2-CB 3.44Å; F456-V541 HydrophobicContact CE2-CG1 3.42Å; F456-V541 VanDerWaalsContact CE2-CG1 3.42Å; F456-V541 HydrophobicContact CE2-CG2 3.55Å; F456-V541 HydrophobicContact CZ-CB 3.34Å; F456-V541 HydrophobicContact CZ-CG1 3.85Å; F456-V541 HydrophobicContact CZ-CG2 3.02Å; C539-V541 PolarHBondContact O-N 2.86Å
542	V	32.8	Very low	35.4	Very low	84 Å²	84	99.9 Å²	99.9	51%	0.509	55%	0.547	S	S	.	.			trans	-122.9	69	175.4	-165.5	0	0	0	0	110.8	V546	V542-V546 HydrophobicContact CB-CG2 4.36Å; V542-V546 HydrophobicContact CG1-CG2 3.8Å; V542-V546 WeakPolarHBondContact O-CG2 3.39Å
543	L	32.3	Very low	35.5	Very low	79 Å²	79	100.3 Å²	100.3	41%	0.414	55%	0.549	S	S	.	.			trans	-103.5	1.1	-167.5	-126.1	131.8	0	0	0	116	E540 F547	E540-L543 HydrophobicContact CG-CD1 4.1Å; L543-F547 HydrophobicContact CD2-CD2 4.44Å; L543-F547 HydrophobicContact CD2-CE2 3.63Å; L543-F547 HydrophobicContact CD2-CZ 4.42Å; L543-F547 HydrophobicContact CG-CE2 4.19Å; L543-F547 VanDerWaalsContact O-CD2 3.26Å; L543-F547 WeakPolarHBondContact O-CD2 3.38Å
544	L	35.1	Very low	35.1	Very low	158 Å²	158	103.3 Å²	103.3	83%	0.827	56%	0.556	S	S	*	*	S	Bend	trans	-114.7	-38.8	178.2	-80.6	160	0	0	0	114.9	V546	L544-V546 PolarHBondContact O-N 2.83Å
545	Q	34.5	Very low	35.4	Very low	161 Å²	161	110.4 Å²	110.4	75%	0.752	56%	0.56	S	S	*	*	H	α-helix	trans	-74.7	-27.8	177.9	-139.7	104.6	-2.8	0	0	113.1	T549	Q545-T549 PolarHBondContact O-OG1 3.22Å
546	V	38.2	Very low	36.1	Very low	44 Å²	44	112.7 Å²	112.7	27%	0.267	57%	0.565	S	S	.	*	H	α-helix	trans	-74.6	-29.9	-173.5	173.4	0	0	0	0	111.6	V542 L544 E548 T549 V550	V542-V546 HydrophobicContact CB-CG2 4.36Å; V542-V546 HydrophobicContact CG1-CG2 3.8Å; V542-V546 WeakPolarHBondContact O-CG2 3.39Å; L544-V546 PolarHBondContact O-N 2.83Å; V546-E548 PolarHBondContact O-N 3.36Å; V546-T549 PolarHBondContact O-OG1 2.91Å; V546-V550 HydrophobicContact CG1-CG2 3.61Å; V546-V550 VanDerWaalsContact O-CB 3.22Å; V546-V550 WeakPolarHBondContact O-CB 3.35Å; V546-V550 WeakPolarHBondContact O-CG2 3.36Å; V546-V550 PolarHBondContact O-N 2.76Å
547	F	34.1	Very low	36.8	Very low	124 Å²	124	112.8 Å²	112.8	54%	0.544	58%	0.58	S	S	.	*	H	α-helix	trans	-67.5	-33.4	-177.2	-90.2	-91.1	0	0	0	113.5	L543 G551	L543-F547 HydrophobicContact CD2-CD2 4.44Å; L543-F547 HydrophobicContact CD2-CE2 3.63Å; L543-F547 HydrophobicContact CD2-CZ 4.42Å; L543-F547 HydrophobicContact CG-CE2 4.19Å; L543-F547 VanDerWaalsContact O-CD2 3.26Å; L543-F547 WeakPolarHBondContact O-CD2 3.38Å; F547-G551 PolarHBondContact O-N 3.41Å
548	E	38.3	Very low	37.8	Very low	164 Å²	164	110.1 Å²	110.1	77%	0.766	56%	0.564	S	S	*	*	H	α-helix	trans	-73.5	-43.9	179	-68.5	-170.9	155.4	0	0	112.4	V546 G551 A552	V546-E548 PolarHBondContact O-N 3.36Å; E548-G551 PolarHBondContact O-N 3.33Å; E548-A552 PolarHBondContact O-N 3.32Å; E548-A552 VanDerWaalsContact O-N 3.16Å
549	T	41.1	Very low	39	Very low	61 Å²	61	113.8 Å²	113.8	37%	0.374	58%	0.58	S	S	.	*	H	α-helix	trans	-65.5	-38	173.8	26	0	0	0	0	112.3	Q545 V546 A552 I553	Q545-T549 PolarHBondContact O-OG1 3.22Å; V546-T549 PolarHBondContact O-OG1 2.91Å; T549-A552 PolarHBondContact O-N 2.9Å; T549-I553 VanDerWaalsContact O-CG1 3.31Å; T549-I553 WeakPolarHBondContact O-CG1 3.39Å; T549-I553 PolarHBondContact O-N 2.87Å
550	V	40.2	Very low	40.4	Very low	46 Å²	46	108.8 Å²	108.8	28%	0.279	55%	0.548	S	S	.	.	H	α-helix	trans	-73.7	-33.1	179.9	176.6	0	0	0	0	111.6	V546 A552 I553 K554	V546-V550 HydrophobicContact CG1-CG2 3.61Å; V546-V550 VanDerWaalsContact O-CB 3.22Å; V546-V550 WeakPolarHBondContact O-CB 3.35Å; V546-V550 WeakPolarHBondContact O-CG2 3.36Å; V546-V550 PolarHBondContact O-N 2.76Å; V550-A552 VanDerWaalsContact C-N 3.28Å; V550-A552 PolarHBondContact O-N 3.12Å; V550-I553 PolarHBondContact O-N 3.24Å; V550-K554 PolarHBondContact O-N 2.84Å; V550-K554 VanDerWaalsContact O-N 3.14Å
551	G	37	Very low	41.8	Very low	31 Å²	31	105.3 Å²	105.3	32%	0.32	54%	0.537	S	S	.	.	H	α-helix	trans	-66.5	-26.6	170.5	0	0	0	0	0	113.8	F547 E548 R555	F547-G551 PolarHBondContact O-N 3.41Å; E548-G551 PolarHBondContact O-N 3.33Å; G551-R555 PolarHBondContact O-NE 2.99Å
552	A	39.9	Very low	43.6	Very low	46 Å²	46	105.5 Å²	105.5	38%	0.38	53%	0.534	S	S	.	.	H	α-helix	trans	-81	-35	174.1	0	0	0	0	0	112.8	E548 T549 V550 R555	E548-A552 PolarHBondContact O-N 3.32Å; E548-A552 VanDerWaalsContact O-N 3.16Å; T549-A552 PolarHBondContact O-N 2.9Å; V550-A552 VanDerWaalsContact C-N 3.28Å; V550-A552 PolarHBondContact O-N 3.12Å; A552-R555 PolarHBondContact O-N 2.91Å
553	I	43	Very low	45.5	Very low	47 Å²	47	105.6 Å²	105.6	24%	0.241	53%	0.531	C	S	.	.	H	α-helix	trans	-72.6	-37.1	179.5	-67.5	165	0	0	0	111.6	F523 T549 V550 R555 R556	F523-I553 HydrophobicContact CD1-CG2 4.27Å; F523-I553 HydrophobicContact CE1-CG2 4.19Å; T549-I553 VanDerWaalsContact O-CG1 3.31Å; T549-I553 WeakPolarHBondContact O-CG1 3.39Å; T549-I553 PolarHBondContact O-N 2.87Å; V550-I553 PolarHBondContact O-N 3.24Å; I553-R555 PolarHBondContact O-N 2.9Å; I553-R555 VanDerWaalsContact O-N 3.17Å; I553-R556 PolarHBondContact O-N 2.84Å
554	K	39	Very low	47.8	Very low	195 Å²	195	108.7 Å²	108.7	85%	0.848	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.8	174.7	-134.2	-177.5	-174.5	-176.2	0	112.7	V550	V550-K554 PolarHBondContact O-N 2.84Å; V550-K554 VanDerWaalsContact O-N 3.14Å
555	R	40.1	Very low	50	Low	219 Å²	219	105.2 Å²	105.2	83%	0.826	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-9.2	176.2	-74.3	-172.9	-110.4	-178.1	-6.9	114.4	G551 A552 I553	G551-R555 PolarHBondContact O-NE 2.99Å; A552-R555 PolarHBondContact O-N 2.91Å; I553-R555 PolarHBondContact O-N 2.9Å; I553-R555 VanDerWaalsContact O-N 3.17Å
556	R	48.1	Very low	52.6	Low	215 Å²	215	100.3 Å²	100.3	81%	0.811	49%	0.494	S	S	*	.	S	Bend	trans	-110.2	12.5	-173	-74.7	-173.5	176.4	174.8	0.5	115.6	I553 F558	I553-R556 PolarHBondContact O-N 2.84Å; R556-F558 PolarHBondContact O-N 3.01Å
557	G	48.7	Very low	55.1	Low	73 Å²	73	101.7 Å²	101.7	75%	0.753	49%	0.494	S	S	*	.			trans	68.6	-6.4	167.2	0	0	0	0	0	117.4
558	F	50.5	Low	57.8	Low	97 Å²	97	97.6 Å²	97.6	43%	0.425	48%	0.48	S	S	.	.			trans	-87.6	119.4	-178.5	-162	-101.1	0	0	0	111.7	L524 R556	L524-F558 HydrophobicContact CD1-CE1 4.43Å; R556-F558 PolarHBondContact O-N 3.01Å
559	K	55.5	Low	60.5	Low	191 Å²	191	89.9 Å²	89.9	83%	0.83	44%	0.444	S	S	*	.			trans	-96.2	112.6	170.5	-62.1	176.8	-177.5	176	0	106.5
560	G	57.7	Low	63	Low	11 Å²	11	88.4 Å²	88.4	11%	0.113	44%	0.436	C	S	.	.			trans	-57	167.1	-175.1	0	0	0	0	0	114.8
561	T	59.2	Low	65.5	Low	80 Å²	80	86.4 Å²	86.4	49%	0.491	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	131.4	178.2	-48.8	0	0	0	0	110.5	F522 I563	F522-T561 PolarHBondContact N-O 3.31Å; T561-I563 HydrophobicContact CG2-CG1 4.43Å
562	M	69.8	Low	68.1	Low	90 Å²	90	89.8 Å²	89.8	44%	0.443	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.3	177.2	-178	177.4	48.9	0	0	108.9	R519 L520 F521	R519-M562 HydrophobicContact CB-CG 3.9Å; R519-M562 HydrophobicContact CB-SD 3.97Å; R519-M562 VanDerWaalsContact CD-SD 3.57Å; R519-M562 HydrophobicContact CG-CG 4.3Å; R519-M562 HydrophobicContact CG-SD 4.03Å; L520-M562 WeakPolarHBondContact O-CA 3.46Å; F521-M562 HydrophobicContact CE1-CB 4.2Å; F521-M562 HydrophobicContact CE2-CG 4.25Å; F521-M562 HydrophobicContact CE2-SD 4.07Å; F521-M562 HydrophobicContact CZ-CB 4.29Å; F521-M562 HydrophobicContact CZ-CG 4.24Å; F521-M562 HydrophobicContact CZ-SD 3.91Å
563	I	73.4	Confident	70.5	Confident	85 Å²	85	90.1 Å²	90.1	44%	0.436	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	138.4	176.2	-61.4	171.8	0	0	0	107.9	L520 F522 T561	L520-I563 PolarHBondContact N-O 3.37Å; L520-I563 PolarHBondContact O-N 2.87Å; F522-I563 HydrophobicContact CD2-CD1 3.92Å; F522-I563 HydrophobicContact CE2-CD1 4.46Å; F522-I563 HydrophobicContact CG-CD1 4.38Å; T561-I563 HydrophobicContact CG2-CG1 4.43Å
564	K	80.5	Confident	73	Confident	145 Å²	145	91.1 Å²	91.1	63%	0.63	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	131.3	169.3	-69.2	-176.3	-177.1	177.9	0	108.7	A517 V518 R519	A517-K564 HydrophobicContact CB-CB 4.25Å; V518-K564 CarbonylContact O-C 3.55Å; V518-K564 WeakPolarHBondContact O-CA 3.47Å; R519-K564 HydrophobicContact CG-CG 4.49Å
565	R	81.8	Confident	75.7	Confident	85 Å²	85	82 Å²	82	32%	0.321	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	125	176.4	-176.3	-170.6	-172	158.4	18.9	109.5	E438 A517 V518 L520	E438-R565 IonicContact OE1-CZ 2.72Å; E438-R565 VanDerWaalsContact OE1-CZ 3.26Å; E438-R565 IonicContact OE1-NH1 2.65Å; E438-R565 IonicContact OE1-NH2 3.56Å; E438-R565 PolarHBondContact OE1-NH2 3.16Å; E438-R565 IonicContact OE2-CZ 2.8Å; E438-R565 VanDerWaalsContact OE2-CZ 3.3Å; E438-R565 IonicContact OE2-NE 2.84Å; E438-R565 PolarHBondContact OE2-NE 3.08Å; E438-R565 IonicContact OE2-NH2 3.11Å; E438-R565 PolarHBondContact OE2-NH2 3.36Å; A517-R565 CarbonylContact C-O 3.31Å; A517-R565 VanDerWaalsContact CA-O 3.27Å; A517-R565 WeakPolarHBondContact CA-O 3.39Å; V518-R565 WeakPolarHBondContact CG2-O 3.37Å; V518-R565 PolarHBondContact N-O 3.32Å; V518-R565 PolarHBondContact O-N 3.16Å; L520-R565 HydrophobicContact CD1-CB 3.56Å; L520-R565 HydrophobicContact CD1-CG 4.07Å; L520-R565 HydrophobicContact CG-CB 4.38Å
566	E	88.5	Confident	78.3	Confident	58 Å²	58	72.2 Å²	72.2	27%	0.271	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	133.8	175.3	-60.9	81.8	179.5	0	0	110.5	F511 V512 G514	F511-E566 HydrophobicContact CD1-CB 4.13Å; V512-E566 WeakPolarHBondContact O-CG 3.26Å; G514-E566 PolarHBondContact N-OE1 2.92Å; G514-E566 VanDerWaalsContact N-OE1 3.1Å
567	R	89.9	Confident	80.6	Confident	73 Å²	73	62.1 Å²	62.1	28%	0.275	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-91.7	151.5	166.3	-76.8	-173.1	172.7	159.4	0.6	110.5	N516 V518 D532	N516-R567 WeakPolarHBondContact O-CB 3.48Å; N516-R567 PolarHBondContact O-N 3.34Å; V518-R567 HydrophobicContact CG1-CG 4.14Å; V518-R567 VanDerWaalsContact CG1-NE 3.26Å; V518-R567 HydrophobicContact CG2-CG 4.02Å; D532-R567 IonicContact OD2-CZ 3.27Å; D532-R567 VanDerWaalsContact OD2-CZ 3.23Å; D532-R567 IonicContact OD2-NH1 3.05Å; D532-R567 PolarHBondContact OD2-NH1 3.13Å; D532-R567 IonicContact OD2-NH2 2.67Å; D532-R567 PolarHBondContact OD2-NH2 3.08Å
568	P	92.3	Very high	82.8	Confident	37 Å²	37	59.1 Å²	59.1	24%	0.24	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-60.6	142.1	172.1	25.8	-32.7	0	0	0	110.4	W509 F511 N516	W509-P568 HydrophobicContact CB-CB 3.78Å; W509-P568 HydrophobicContact CD2-CB 3.53Å; W509-P568 HydrophobicContact CD2-CG 3.9Å; W509-P568 HydrophobicContact CE3-CB 3.84Å; W509-P568 HydrophobicContact CE3-CG 3.98Å; W509-P568 HydrophobicContact CG-CB 3.54Å; W509-P568 HydrophobicContact CG-CG 4.39Å; W509-P568 HydrophobicContact CH2-CG 4.31Å; W509-P568 HydrophobicContact CZ2-CG 4.28Å; W509-P568 HydrophobicContact CZ3-CG 4.18Å; F511-P568 HydrophobicContact CE1-CB 4.07Å; F511-P568 HydrophobicContact CE1-CG 4.36Å; F511-P568 HydrophobicContact CE2-CB 3.87Å; F511-P568 HydrophobicContact CZ-CB 3.62Å; F511-P568 HydrophobicContact CZ-CG 4.06Å; N516-P568 PolarHBondContact ND2-O 3.1Å
569	L	93.8	Very high	84.8	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.016	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	142.3	164.3	-71	165.8	0	0	0	108.4	V488 W509 C510 V512 N516 V571 E574 V575	V488-L569 HydrophobicContact CG1-CD1 4.24Å; V488-L569 HydrophobicContact CG2-CD1 3.79Å; W509-L569 CarbonylContact C-O 3.54Å; W509-L569 WeakPolarHBondContact CA-O 3.39Å; C510-L569 PolarHBondContact N-O 3.03Å; C510-L569 PolarHBondContact O-N 2.85Å; V512-L569 HydrophobicContact CG2-CD1 4.05Å; N516-L569 HydrophobicContact CB-CD1 4.1Å; N516-L569 HydrophobicContact CB-CD2 4.05Å; N516-L569 HydrophobicContact CB-CG 4.05Å; N516-L569 WeakPolarHBondContact ND2-CD2 3.33Å; L569-V571 PolarHBondContact O-N 3.04Å; L569-E574 WeakPolarHBondContact CA-OE2 3.41Å; L569-E574 HydrophobicContact CB-CB 4.47Å; L569-E574 HydrophobicContact CD2-CB 4.26Å; L569-V575 HydrophobicContact CB-CG1 3.99Å; L569-V575 HydrophobicContact CD1-CG1 3.78Å; L569-V575 HydrophobicContact CG-CG1 4.48Å
570	S	93.1	Very high	86.5	Confident	30 Å²	30	48.5 Å²	48.5	21%	0.21	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	125.1	172.6	175.8	0	0	0	0	110.3	I572 E574	S570-I572 PolarHBondContact O-N 2.81Å; S570-I572 PolarHBondContact OG-N 2.73Å; S570-I572 PolarHBondContact OG-O 2.55Å; S570-E574 PolarHBondContact N-OE2 2.87Å; S570-E574 WeakPolarHBondContact O-CB 3.42Å; S570-E574 PolarHBondContact O-N 3.35Å
571	V	92.7	Very high	88.1	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.018	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.7	171.7	177.3	0	0	0	0	110.6	I473 W478 W479 I480 N508 C510 L569 G573	I473-V571 HydrophobicContact CD1-CG1 4.38Å; W478-V571 HydrophobicContact CH2-CG2 4.05Å; W478-V571 HydrophobicContact CZ2-CG2 4.31Å; W479-V571 HydrophobicContact CH2-CG1 4.06Å; W479-V571 HydrophobicContact CZ2-CG1 3.46Å; W479-V571 VanDerWaalsContact CZ2-CG1 3.46Å; W479-V571 WeakPolarHBondContact CZ2-O 3.23Å; I480-V571 HydrophobicContact CB-CG1 4.4Å; I480-V571 HydrophobicContact CD1-CG2 4.38Å; I480-V571 HydrophobicContact CG2-CB 4.44Å; I480-V571 HydrophobicContact CG2-CG1 3.7Å; I480-V571 HydrophobicContact CG2-CG2 3.78Å; N508-V571 WeakPolarHBondContact O-CB 3.42Å; N508-V571 WeakPolarHBondContact O-CG2 3.46Å; N508-V571 PolarHBondContact O-N 2.79Å; C510-V571 HydrophobicContact CB-CG2 3.98Å; L569-V571 PolarHBondContact O-N 3.04Å; V571-G573 PolarHBondContact O-N 2.65Å
572	I	92.1	Very high	89.7	Confident	103 Å²	103	52 Å²	52	53%	0.528	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	104.7	175	-52.5	174.6	0	0	0	108.3	I473 N508 S570 E574	I473-I572 HydrophobicContact CD1-CD1 4.14Å; I473-I572 HydrophobicContact CD1-CG1 3.87Å; I473-I572 HydrophobicContact CG1-CD1 4.18Å; I473-I572 HydrophobicContact CG1-CG1 4.46Å; N508-I572 HydrophobicContact CB-CD1 4.43Å; S570-I572 PolarHBondContact O-N 2.81Å; S570-I572 PolarHBondContact OG-N 2.73Å; S570-I572 PolarHBondContact OG-O 2.55Å; I572-E574 PolarHBondContact O-N 3.46Å
573	G	91.3	Very high	90.7	Very high	52 Å²	52	53.8 Å²	53.8	54%	0.536	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	-22	166.4	0	0	0	0	0	116.9	V571	V571-G573 PolarHBondContact O-N 2.65Å
574	E	94.9	Very high	91.7	Very high	68 Å²	68	57.5 Å²	57.5	32%	0.318	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-17.4	-178.3	-57.9	-175	156.6	0	0	113.9	L489 V490 L569 S570 I572	L489-E574 PolarHBondContact N-O 3.23Å; V490-E574 HydrophobicContact CB-CG 4.48Å; L569-E574 WeakPolarHBondContact CA-OE2 3.41Å; L569-E574 HydrophobicContact CB-CB 4.47Å; L569-E574 HydrophobicContact CD2-CB 4.26Å; S570-E574 PolarHBondContact N-OE2 2.87Å; S570-E574 WeakPolarHBondContact O-CB 3.42Å; S570-E574 PolarHBondContact O-N 3.35Å; I572-E574 PolarHBondContact O-N 3.46Å
575	V	95.3	Very high	92.4	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152.1	178.1	-67.2	0	0	0	0	111.7	W479 I480 V486 E487 L569	W479-V575 HydrophobicContact CH2-CG2 4.39Å; I480-V575 HydrophobicContact CD1-CG2 4.3Å; V486-V575 HydrophobicContact CB-CB 4.46Å; E487-V575 WeakPolarHBondContact O-CA 3.4Å; L569-V575 HydrophobicContact CB-CG1 3.99Å; L569-V575 HydrophobicContact CD1-CG1 3.78Å; L569-V575 HydrophobicContact CG-CG1 4.48Å
576	A	95.7	Very high	93	Very high	13 Å²	13	49 Å²	49	11%	0.107	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	151.3	168.8	0	0	0	0	0	110.3	V486 E487 L489 P585	V486-A576 CarbonylContact C-O 3.54Å; V486-A576 VanDerWaalsContact CA-O 3.26Å; V486-A576 WeakPolarHBondContact CA-O 3.09Å; E487-A576 PolarHBondContact N-O 2.72Å; E487-A576 PolarHBondContact O-N 3.07Å; E487-A576 VanDerWaalsContact O-N 3.12Å; L489-A576 HydrophobicContact CD1-CB 3.99Å; L489-A576 HydrophobicContact CD2-CB 4.23Å; L489-A576 HydrophobicContact CG-CB 4.29Å; A576-P585 HydrophobicContact CB-CB 3.82Å
577	L	95.8	Very high	93.2	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	148.4	169.5	-72.5	-170.3	0	0	0	110.3	W479 D484 V486 P585 T586 I588 I609	W479-L577 HydrophobicContact CE3-CD1 4.37Å; W479-L577 HydrophobicContact CE3-CG 3.96Å; W479-L577 HydrophobicContact CZ3-CD2 4.19Å; W479-L577 HydrophobicContact CZ3-CG 3.76Å; D484-L577 HydrophobicContact CB-CD2 3.57Å; V486-L577 HydrophobicContact CG1-CD2 3.74Å; L577-P585 CarbonylContact O-C 3.59Å; L577-P585 WeakPolarHBondContact O-CA 3.09Å; L577-T586 PolarHBondContact O-N 2.89Å; L577-I588 HydrophobicContact CB-CD1 3.79Å; L577-I588 HydrophobicContact CB-CG1 4.39Å; L577-I588 HydrophobicContact CD1-CD1 3.11Å; L577-I588 HydrophobicContact CD1-CG1 4.12Å; L577-I588 HydrophobicContact CG-CD1 3.4Å; L577-I588 VanDerWaalsContact CG-CD1 3.4Å; L577-I588 HydrophobicContact CG-CG1 4.46Å; L577-I609 HydrophobicContact CB-CD1 4.29Å; L577-I609 HydrophobicContact CD1-CD1 4.12Å; L577-I609 HydrophobicContact CD1-CG2 3.94Å
578	V	94.6	Very high	93.3	Very high	10 Å²	10	52.7 Å²	52.7	6%	0.061	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	128	173.3	178.8	0	0	0	0	108.7	R485 E487 Q497 F583	R485-V578 HydrophobicContact CG-CB 4.16Å; R485-V578 HydrophobicContact CG-CG2 4.13Å; R485-V578 PolarHBondContact O-N 2.69Å; R485-V578 VanDerWaalsContact O-N 3.15Å; E487-V578 HydrophobicContact CB-CG2 3.93Å; Q497-V578 HydrophobicContact CG-CG2 3.95Å; V578-F583 VanDerWaalsContact CG1-C 3.47Å; V578-F583 VanDerWaalsContact CG1-CA 3.48Å; V578-F583 HydrophobicContact CG1-CB 4.18Å; V578-F583 HydrophobicContact CG1-CD1 4.33Å
579	D	93.6	Very high	93.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-68.9	129.6	175	-164.8	-40.7	0	0	0	110.3	I581 D582 F583 R584 T586 R604 T605 S607	D579-I581 PolarHBondContact O-N 2.88Å; D579-I581 PolarHBondContact OD1-N 3.04Å; D579-I581 VanDerWaalsContact OD1-N 3.11Å; D579-D582 WeakPolarHBondContact CB-OD1 3.46Å; D579-F583 VanDerWaalsContact O-CA 3.25Å; D579-F583 WeakPolarHBondContact O-CA 3.29Å; D579-F583 PolarHBondContact O-N 2.98Å; D579-R584 PolarHBondContact N-O 3.36Å; D579-T586 HydrophobicContact CB-CG2 3.92Å; D579-R604 IonicContact OD2-NH2 3.65Å; D579-T605 PolarHBondContact OD1-OG1 2.7Å; D579-T605 WeakPolarHBondContact OD2-CB 3.44Å; D579-T605 WeakPolarHBondContact OD2-CG2 3.32Å; D579-T605 PolarHBondContact OD2-OG1 3.11Å; D579-S607 WeakPolarHBondContact OD1-CB 3.26Å; D579-S607 PolarHBondContact OD1-OG 3.22Å; D579-S607 PolarHBondContact OD2-OG 3.33Å
580	P	91.4	Very high	93.3	Very high	66 Å²	66	57.8 Å²	57.8	43%	0.429	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.8	-178.2	26.2	-35.9	0	0	0	114.1
581	I	91.3	Very high	93.3	Very high	117 Å²	117	62.2 Å²	62.2	60%	0.6	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-46.4	-175.9	-62	-177.6	0	0	0	111.6	D579	D579-I581 PolarHBondContact O-N 2.88Å; D579-I581 PolarHBondContact OD1-N 3.04Å; D579-I581 VanDerWaalsContact OD1-N 3.11Å
582	D	91.3	Very high	93.3	Very high	47 Å²	47	70.7 Å²	70.7	25%	0.251	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	4.3	-172.1	76.8	-28.6	0	0	0	114.2	D579 R584 R604	D579-D582 WeakPolarHBondContact CB-OD1 3.46Å; D582-R584 PolarHBondContact O-N 3.13Å; D582-R584 VanDerWaalsContact O-N 3.16Å; D582-R584 PolarHBondContact OD1-N 3.13Å; D582-R584 WeakPolarHBondContact OD2-CD 3.27Å; D582-R604 IonicContact OD1-CZ 2.75Å; D582-R604 IonicContact OD1-NH1 3.74Å; D582-R604 IonicContact OD1-NH2 3.26Å; D582-R604 PolarHBondContact OD1-NH2 2.52Å; D582-R604 IonicContact OD2-CZ 3.44Å; D582-R604 IonicContact OD2-NH1 3.3Å; D582-R604 PolarHBondContact OD2-NH1 3.27Å; D582-R604 IonicContact OD2-NH2 3.87Å; D582-R604 PolarHBondContact OD2-NH2 2.87Å
583	F	92.4	Very high	93.2	Very high	127 Å²	127	67.8 Å²	67.8	56%	0.557	32%	0.323	S	S	*	.			trans	56.3	28.7	177.4	-59.4	-81.5	0	0	0	114.4	Q497 V578 D579	Q497-F583 PolarHBondContact NE2-O 3.3Å; V578-F583 VanDerWaalsContact CG1-C 3.47Å; V578-F583 VanDerWaalsContact CG1-CA 3.48Å; V578-F583 HydrophobicContact CG1-CB 4.18Å; V578-F583 HydrophobicContact CG1-CD1 4.33Å; D579-F583 VanDerWaalsContact O-CA 3.25Å; D579-F583 WeakPolarHBondContact O-CA 3.29Å; D579-F583 PolarHBondContact O-N 2.98Å
584	R	93.5	Very high	93.2	Very high	164 Å²	164	75.2 Å²	75.2	62%	0.619	34%	0.344	S	S	*	.			trans	-105.6	153.6	175.5	-67.9	-175.7	-175.9	-173.5	1	111.6	D579 D582 T586	D579-R584 PolarHBondContact N-O 3.36Å; D582-R584 PolarHBondContact O-N 3.13Å; D582-R584 VanDerWaalsContact O-N 3.16Å; D582-R584 PolarHBondContact OD1-N 3.13Å; D582-R584 WeakPolarHBondContact OD2-CD 3.27Å; R584-T586 PolarHBondContact O-N 2.81Å
585	P	94.9	Very high	93.1	Very high	46 Å²	46	80.1 Å²	80.1	30%	0.299	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	134.4	176.2	26.1	-32.3	0	0	0	109.9	E487 L489 A576 L577	E487-P585 HydrophobicContact CB-CB 4.38Å; E487-P585 WeakPolarHBondContact OE2-CD 3.36Å; L489-P585 HydrophobicContact CD2-CB 4.16Å; L489-P585 HydrophobicContact CD2-CG 4.41Å; A576-P585 HydrophobicContact CB-CB 3.82Å; L577-P585 CarbonylContact O-C 3.59Å; L577-P585 WeakPolarHBondContact O-CA 3.09Å
586	T	94.1	Very high	92.8	Very high	6 Å²	6	82.2 Å²	82.2	4%	0.037	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.5	-177.4	-162.9	0	0	0	0	110.8	L577 D579 R584 I609	L577-T586 PolarHBondContact O-N 2.89Å; D579-T586 HydrophobicContact CB-CG2 3.92Å; R584-T586 PolarHBondContact O-N 2.81Å; T586-I609 HydrophobicContact CG2-CD1 4Å
587	K	93.3	Very high	92.5	Very high	174 Å²	174	86.7 Å²	86.7	76%	0.757	41%	0.406	S	S	*	.			trans	-78.6	145.6	168.2	-71	-174.8	178.9	-178.6	0	108.5	V603	K587-V603 HydrophobicContact CB-CG2 4.22Å; K587-V603 WeakPolarHBondContact O-CG2 3.02Å; K587-V603 PolarHBondContact O-N 3.4Å
588	I	93	Very high	92.3	Very high	34 Å²	34	91 Å²	91	17%	0.174	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	139.2	-175.5	-56	157.2	0	0	0	109.1	W479 L577 R600 Q601	W479-I588 HydrophobicContact CB-CD1 4.27Å; W479-I588 HydrophobicContact CD2-CD1 3.97Å; W479-I588 HydrophobicContact CE3-CD1 3.4Å; W479-I588 HydrophobicContact CG-CD1 4.36Å; W479-I588 HydrophobicContact CZ3-CD1 4.06Å; L577-I588 HydrophobicContact CB-CD1 3.79Å; L577-I588 HydrophobicContact CB-CG1 4.39Å; L577-I588 HydrophobicContact CD1-CD1 3.11Å; L577-I588 HydrophobicContact CD1-CG1 4.12Å; L577-I588 HydrophobicContact CG-CD1 3.4Å; L577-I588 VanDerWaalsContact CG-CD1 3.4Å; L577-I588 HydrophobicContact CG-CG1 4.46Å; I588-R600 HydrophobicContact CG2-CB 3.67Å; I588-R600 HydrophobicContact CG2-CG 4.2Å; I588-Q601 WeakPolarHBondContact CA-O 3.37Å
589	E	92.5	Very high	92.2	Very high	89 Å²	89	92 Å²	92	42%	0.416	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142	163.9	-74.1	174.7	179.2	0	0	109.5	R591 Q601 V603	E589-R591 IonicContact OE2-CZ 3.7Å; E589-R591 IonicContact OE2-NE 3.53Å; E589-R591 IonicContact OE2-NH2 2.95Å; E589-R591 PolarHBondContact OE2-NH2 2.94Å; E589-Q601 PolarHBondContact N-O 3.11Å; E589-Q601 PolarHBondContact O-N 2.88Å; E589-V603 HydrophobicContact CB-CG2 4.33Å; E589-V603 HydrophobicContact CG-CG2 3.67Å
590	W	93.6	Very high	92.2	Very high	57 Å²	57	92 Å²	92	22%	0.216	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123	167.9	-76.8	108.6	0	0	0	109.2	W478 F481 R598 R600 I611	W478-W590 VanDerWaalsContact O-CZ2 3.28Å; W478-W590 WeakPolarHBondContact O-CZ2 3.4Å; F481-W590 HydrophobicContact CE2-CH2 4.21Å; F481-W590 HydrophobicContact CE2-CZ2 4.15Å; F481-W590 HydrophobicContact CZ-CH2 4.47Å; F481-W590 HydrophobicContact CZ-CZ2 4.4Å; W590-R598 HydrophobicContact CB-CG 4.47Å; W590-R598 HydrophobicContact CD2-CG 4.39Å; W590-R598 HydrophobicContact CE3-CB 4.4Å; W590-R598 HydrophobicContact CE3-CG 3.71Å; W590-R598 HydrophobicContact CZ3-CG 4.27Å; W590-R600 HydrophobicContact CD2-CG 4.16Å; W590-R600 HydrophobicContact CE3-CG 3.8Å; W590-R600 HydrophobicContact CH2-CG 3.42Å; W590-R600 VanDerWaalsContact CH2-CG 3.42Å; W590-R600 HydrophobicContact CZ2-CG 3.74Å; W590-R600 HydrophobicContact CZ3-CG 3.44Å; W590-R600 VanDerWaalsContact CZ3-CG 3.44Å; W590-I611 HydrophobicContact CH2-CD1 4.37Å
591	R	92.6	Very high	92.3	Very high	124 Å²	124	90.8 Å²	90.8	47%	0.468	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	159.8	173.9	-59.8	-149.4	-173.2	172.1	-6.2	111	E589 V599 Q601	E589-R591 IonicContact OE2-CZ 3.7Å; E589-R591 IonicContact OE2-NE 3.53Å; E589-R591 IonicContact OE2-NH2 2.95Å; E589-R591 PolarHBondContact OE2-NH2 2.94Å; R591-V599 PolarHBondContact N-O 3.07Å; R591-V599 WeakPolarHBondContact O-CG2 3.25Å; R591-V599 PolarHBondContact O-N 3.15Å; R591-Q601 HydrophobicContact CG-CB 4.44Å
592	W	92.2	Very high	92.4	Very high	181 Å²	181	85.2 Å²	85.2	69%	0.686	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	130	173.4	-62	95.8	0	0	0	108.5	G596 R598	W592-G596 VanDerWaalsContact CE3-O 3.27Å; W592-G596 VanDerWaalsContact CZ3-O 3.25Å; W592-G596 WeakPolarHBondContact CZ3-O 3.43Å; W592-R598 HydrophobicContact CD2-CB 4.45Å; W592-R598 HydrophobicContact CD2-CG 4.32Å; W592-R598 HydrophobicContact CE3-CB 4Å; W592-R598 HydrophobicContact CE3-CG 4.36Å; W592-R598 HydrophobicContact CH2-CB 4.04Å; W592-R598 HydrophobicContact CH2-CG 4.24Å; W592-R598 HydrophobicContact CZ2-CB 4.46Å; W592-R598 HydrophobicContact CZ2-CG 4.17Å; W592-R598 HydrophobicContact CZ3-CB 3.79Å; W592-R598 HydrophobicContact CZ3-CG 4.33Å
593	N	90	Very high	92.4	Very high	41 Å²	41	86.6 Å²	86.6	22%	0.219	40%	0.398	C	S	.	.			trans	-80.3	172.5	170.7	69.6	9.6	0	0	0	110.3	K595 G596 E597 V599	N593-K595 PolarHBondContact O-N 3.34Å; N593-K595 VanDerWaalsContact O-N 3.13Å; N593-K595 WeakPolarHBondContact OD1-CA 3.03Å; N593-K595 WeakPolarHBondContact OD1-CB 3.46Å; N593-K595 PolarHBondContact OD1-N 3.16Å; N593-G596 PolarHBondContact O-N 2.93Å; N593-G596 PolarHBondContact OD1-N 2.93Å; N593-G596 VanDerWaalsContact OD1-N 3.09Å; N593-E597 PolarHBondContact N-O 3.13Å; N593-E597 PolarHBondContact ND2-OE2 3.19Å; N593-E597 WeakPolarHBondContact OD1-CA 3.37Å; N593-E597 PolarHBondContact OD1-N 2.85Å; N593-E597 PolarHBondContact OD1-O 3.08Å; N593-V599 HydrophobicContact CB-CG1 4.45Å; N593-V599 HydrophobicContact CB-CG2 4.23Å
594	E	91.6	Very high	92.4	Very high	209 Å²	209	86.2 Å²	86.2	98%	0.977	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.1	177.2	-62.8	176.8	173.3	0	0	113.3	G596	E594-G596 VanDerWaalsContact C-N 3.31Å
595	K	91.6	Very high	92.2	Very high	170 Å²	170	80.8 Å²	80.8	74%	0.739	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-3.7	175.5	-58.6	-176.6	177.6	-177.7	0	113.4	N593 E597	N593-K595 PolarHBondContact O-N 3.34Å; N593-K595 VanDerWaalsContact O-N 3.13Å; N593-K595 WeakPolarHBondContact OD1-CA 3.03Å; N593-K595 WeakPolarHBondContact OD1-CB 3.46Å; N593-K595 PolarHBondContact OD1-N 3.16Å; K595-E597 VanDerWaalsContact C-N 3.28Å; K595-E597 HydrophobicContact CB-CG 4.21Å
596	G	90.3	Very high	92.1	Very high	50 Å²	50	80.1 Å²	80.1	52%	0.515	38%	0.38	S	S	.	.	S	Bend	trans	75.7	13.9	-174.9	0	0	0	0	0	114	W592 N593 E594	W592-G596 VanDerWaalsContact CE3-O 3.27Å; W592-G596 VanDerWaalsContact CZ3-O 3.25Å; W592-G596 WeakPolarHBondContact CZ3-O 3.43Å; N593-G596 PolarHBondContact O-N 2.93Å; N593-G596 PolarHBondContact OD1-N 2.93Å; N593-G596 VanDerWaalsContact OD1-N 3.09Å; E594-G596 VanDerWaalsContact C-N 3.31Å
597	E	89.9	Confident	91.9	Very high	107 Å²	107	80.4 Å²	80.4	50%	0.5	38%	0.382	S	S	.	.			trans	-89.6	141.8	173.4	-53.7	166.6	152.4	0	0	109.9	N593 K595 V599	N593-E597 PolarHBondContact N-O 3.13Å; N593-E597 PolarHBondContact ND2-OE2 3.19Å; N593-E597 WeakPolarHBondContact OD1-CA 3.37Å; N593-E597 PolarHBondContact OD1-N 2.85Å; N593-E597 PolarHBondContact OD1-O 3.08Å; K595-E597 VanDerWaalsContact C-N 3.28Å; K595-E597 HydrophobicContact CB-CG 4.21Å; E597-V599 PolarHBondContact O-N 2.93Å
598	R	90.4	Very high	91.9	Very high	92 Å²	92	76.8 Å²	76.8	35%	0.347	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.2	177.4	-154.6	-175.2	177.3	-167.6	-7.3	109.9	D476 W590 W592	D476-R598 PolarHBondContact O-NH1 3.34Å; D476-R598 PolarHBondContact O-NH2 3.46Å; W590-R598 HydrophobicContact CB-CG 4.47Å; W590-R598 HydrophobicContact CD2-CG 4.39Å; W590-R598 HydrophobicContact CE3-CB 4.4Å; W590-R598 HydrophobicContact CE3-CG 3.71Å; W590-R598 HydrophobicContact CZ3-CG 4.27Å; W592-R598 HydrophobicContact CD2-CB 4.45Å; W592-R598 HydrophobicContact CD2-CG 4.32Å; W592-R598 HydrophobicContact CE3-CB 4Å; W592-R598 HydrophobicContact CE3-CG 4.36Å; W592-R598 HydrophobicContact CH2-CB 4.04Å; W592-R598 HydrophobicContact CH2-CG 4.24Å; W592-R598 HydrophobicContact CZ2-CB 4.46Å; W592-R598 HydrophobicContact CZ2-CG 4.17Å; W592-R598 HydrophobicContact CZ3-CB 3.79Å; W592-R598 HydrophobicContact CZ3-CG 4.33Å
599	V	92.5	Very high	91.9	Very high	30 Å²	30	76 Å²	76	18%	0.182	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.2	-175.5	-65.3	0	0	0	0	111.4	R591 N593 E597 L608	R591-V599 PolarHBondContact N-O 3.07Å; R591-V599 WeakPolarHBondContact O-CG2 3.25Å; R591-V599 PolarHBondContact O-N 3.15Å; N593-V599 HydrophobicContact CB-CG1 4.45Å; N593-V599 HydrophobicContact CB-CG2 4.23Å; E597-V599 PolarHBondContact O-N 2.93Å; V599-L608 HydrophobicContact CB-CD2 4.16Å; V599-L608 HydrophobicContact CG2-CD2 3.66Å
600	R	93.9	Very high	91.9	Very high	2 Å²	2	76.7 Å²	76.7	1%	0.008	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	121.8	173.2	-60.6	-176.7	-61.9	175.4	-0.3	108.3	W479 D484 I588 W590 L608 I609 P610	W479-R600 VanDerWaalsContact O-CD 3.27Å; W479-R600 WeakPolarHBondContact O-CD 3.46Å; W479-R600 PolarHBondContact O-NH1 3.34Å; D484-R600 IonicContact OD1-CZ 2.79Å; D484-R600 IonicContact OD1-NH1 2.66Å; D484-R600 PolarHBondContact OD1-NH1 3.4Å; D484-R600 IonicContact OD1-NH2 2.59Å; D484-R600 PolarHBondContact OD1-NH2 2.86Å; D484-R600 IonicContact OD2-CZ 3.6Å; D484-R600 IonicContact OD2-NH1 2.87Å; D484-R600 PolarHBondContact OD2-NH1 2.9Å; D484-R600 IonicContact OD2-NH2 2.7Å; I588-R600 HydrophobicContact CG2-CB 3.67Å; I588-R600 HydrophobicContact CG2-CG 4.2Å; W590-R600 HydrophobicContact CD2-CG 4.16Å; W590-R600 HydrophobicContact CE3-CG 3.8Å; W590-R600 HydrophobicContact CH2-CG 3.42Å; W590-R600 VanDerWaalsContact CH2-CG 3.42Å; W590-R600 HydrophobicContact CZ2-CG 3.74Å; W590-R600 HydrophobicContact CZ3-CG 3.44Å; W590-R600 VanDerWaalsContact CZ3-CG 3.44Å; R600-L608 WeakPolarHBondContact O-CA 3.28Å; R600-I609 HydrophobicContact CB-CB 4.37Å; R600-I609 PolarHBondContact NE-O 2.71Å; R600-I609 VanDerWaalsContact NE-O 3.11Å; R600-I609 PolarHBondContact O-N 2.68Å; R600-P610 PolarHBondContact NH2-O 3.13Å
601	Q	93.2	Very high	91.8	Very high	40 Å²	40	77.8 Å²	77.8	19%	0.187	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.3	177.1	-168	174.6	36.8	0	0	110.5	I588 E589 R591 V603 G606 S607 L608	I588-Q601 WeakPolarHBondContact CA-O 3.37Å; E589-Q601 PolarHBondContact N-O 3.11Å; E589-Q601 PolarHBondContact O-N 2.88Å; R591-Q601 HydrophobicContact CG-CB 4.44Å; Q601-V603 PolarHBondContact O-N 2.88Å; Q601-G606 WeakPolarHBondContact CG-O 3.35Å; Q601-G606 PolarHBondContact NE2-O 3.4Å; Q601-S607 CarbonylContact C-O 3.56Å; Q601-S607 WeakPolarHBondContact CA-O 3.35Å; Q601-L608 HydrophobicContact CB-CD2 4.17Å; Q601-L608 HydrophobicContact CG-CD2 4.2Å
602	G	93.2	Very high	91.7	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	124.4	171.3	0	0	0	0	0	110.5	R604 G606 S607	G602-R604 PolarHBondContact O-N 2.75Å; G602-G606 WeakPolarHBondContact O-CA 3.27Å; G602-G606 PolarHBondContact O-N 3.26Å; G602-S607 PolarHBondContact N-O 2.67Å
603	V	92.3	Very high	91.5	Very high	76 Å²	76	68.9 Å²	68.9	46%	0.461	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-33.2	-175.8	174.8	0	0	0	0	112.1	K587 E589 Q601	K587-V603 HydrophobicContact CB-CG2 4.22Å; K587-V603 WeakPolarHBondContact O-CG2 3.02Å; K587-V603 PolarHBondContact O-N 3.4Å; E589-V603 HydrophobicContact CB-CG2 4.33Å; E589-V603 HydrophobicContact CG-CG2 3.67Å; Q601-V603 PolarHBondContact O-N 2.88Å
604	R	90.9	Very high	91.3	Very high	118 Å²	118	71.2 Å²	71.2	45%	0.445	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-45.6	-171.3	-174.5	173.7	52.3	69.3	6.4	114.2	D579 D582 G602	D579-R604 IonicContact OD2-NH2 3.65Å; D582-R604 IonicContact OD1-CZ 2.75Å; D582-R604 IonicContact OD1-NH1 3.74Å; D582-R604 IonicContact OD1-NH2 3.26Å; D582-R604 PolarHBondContact OD1-NH2 2.52Å; D582-R604 IonicContact OD2-CZ 3.44Å; D582-R604 IonicContact OD2-NH1 3.3Å; D582-R604 PolarHBondContact OD2-NH1 3.27Å; D582-R604 IonicContact OD2-NH2 3.87Å; D582-R604 PolarHBondContact OD2-NH2 2.87Å; G602-R604 PolarHBondContact O-N 2.75Å
605	T	91.2	Very high	91	Very high	51 Å²	51	63 Å²	63	31%	0.313	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-15.2	-178.4	60.1	0	0	0	0	112.5	D579 S607	D579-T605 PolarHBondContact OD1-OG1 2.7Å; D579-T605 WeakPolarHBondContact OD2-CB 3.44Å; D579-T605 WeakPolarHBondContact OD2-CG2 3.32Å; D579-T605 PolarHBondContact OD2-OG1 3.11Å; T605-S607 PolarHBondContact O-N 3.28Å; T605-S607 VanDerWaalsContact OG1-CB 3.24Å; T605-S607 WeakPolarHBondContact OG1-CB 3.18Å; T605-S607 PolarHBondContact OG1-N 2.59Å; T605-S607 PolarHBondContact OG1-OG 3.11Å
606	G	90.8	Very high	90.5	Very high	32 Å²	32	59.9 Å²	59.9	33%	0.33	33%	0.33	S	S	.	.			trans	71.4	9.7	-167.2	0	0	0	0	0	113.6	Q601 G602	Q601-G606 WeakPolarHBondContact CG-O 3.35Å; Q601-G606 PolarHBondContact NE2-O 3.4Å; G602-G606 WeakPolarHBondContact O-CA 3.27Å; G602-G606 PolarHBondContact O-N 3.26Å
607	S	91.7	Very high	89.9	Confident	12 Å²	12	59.9 Å²	59.9	8%	0.084	32%	0.317	C	S	.	.			trans	-67.2	140.7	-178.9	70.1	0	0	0	0	111.6	D579 Q601 G602 T605	D579-S607 WeakPolarHBondContact OD1-CB 3.26Å; D579-S607 PolarHBondContact OD1-OG 3.22Å; D579-S607 PolarHBondContact OD2-OG 3.33Å; Q601-S607 CarbonylContact C-O 3.56Å; Q601-S607 WeakPolarHBondContact CA-O 3.35Å; G602-S607 PolarHBondContact N-O 2.67Å; T605-S607 PolarHBondContact O-N 3.28Å; T605-S607 VanDerWaalsContact OG1-CB 3.24Å; T605-S607 WeakPolarHBondContact OG1-CB 3.18Å; T605-S607 PolarHBondContact OG1-N 2.59Å; T605-S607 PolarHBondContact OG1-OG 3.11Å
608	L	92.3	Very high	89	Confident	97 Å²	97	56.6 Å²	56.6	51%	0.508	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.3	173.8	-63.4	178.1	0	0	0	109.4	V599 R600 Q601 P610	V599-L608 HydrophobicContact CB-CD2 4.16Å; V599-L608 HydrophobicContact CG2-CD2 3.66Å; R600-L608 WeakPolarHBondContact O-CA 3.28Å; Q601-L608 HydrophobicContact CB-CD2 4.17Å; Q601-L608 HydrophobicContact CG-CD2 4.2Å; L608-P610 WeakPolarHBondContact O-CD 3.39Å
609	I	93	Very high	87.8	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.087	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	98.5	178.9	-53.3	178.8	0	0	0	108.6	L577 T586 R600	L577-I609 HydrophobicContact CB-CD1 4.29Å; L577-I609 HydrophobicContact CD1-CD1 4.12Å; L577-I609 HydrophobicContact CD1-CG2 3.94Å; T586-I609 HydrophobicContact CG2-CD1 4Å; R600-I609 HydrophobicContact CB-CB 4.37Å; R600-I609 PolarHBondContact NE-O 2.71Å; R600-I609 VanDerWaalsContact NE-O 3.11Å; R600-I609 PolarHBondContact O-N 2.68Å
610	P	92	Very high	86.5	Confident	104 Å²	104	62.6 Å²	62.6	68%	0.675	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-64.4	152.8	-177.7	28.3	-35	0	0	0	111.1	R600 L608	R600-P610 PolarHBondContact NH2-O 3.13Å; L608-P610 WeakPolarHBondContact O-CD 3.39Å
611	I	91.7	Very high	85.4	Confident	81 Å²	81	65.7 Å²	65.7	42%	0.415	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-71.4	127	173.3	-62.4	173.8	0	0	0	108.2	F481 W590 S615	F481-I611 HydrophobicContact CB-CG2 4.27Å; F481-I611 HydrophobicContact CD1-CG2 4.3Å; F481-I611 HydrophobicContact CD2-CG1 4.2Å; F481-I611 HydrophobicContact CD2-CG2 4.21Å; F481-I611 HydrophobicContact CE2-CD1 4.13Å; F481-I611 HydrophobicContact CE2-CG1 4.12Å; F481-I611 HydrophobicContact CG-CG2 4Å; F481-I611 HydrophobicContact CZ-CD1 4.18Å; W590-I611 HydrophobicContact CH2-CD1 4.37Å; I611-S615 WeakPolarHBondContact CG2-OG 3.35Å
612	P	91.6	Very high	84.6	Confident	29 Å²	29	67.9 Å²	67.9	19%	0.188	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-65.2	142.3	-178.3	-20.2	30.7	0	0	0	112.3	D484 R614 S615	D484-P612 HydrophobicContact CB-CG 4.4Å; D484-P612 WeakPolarHBondContact OD1-CD 3.39Å; D484-P612 WeakPolarHBondContact OD1-CG 3.24Å; P612-R614 PolarHBondContact O-N 3.09Å; P612-R614 VanDerWaalsContact O-N 3.13Å; P612-S615 VanDerWaalsContact O-CB 3.27Å; P612-S615 WeakPolarHBondContact O-CB 3.09Å; P612-S615 PolarHBondContact O-N 2.66Å; P612-S615 PolarHBondContact O-OG 2.9Å
613	T	87.3	Confident	84	Confident	88 Å²	88	69.2 Å²	69.2	54%	0.54	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-56.4	-30.7	175.3	-43.9	0	0	0	0	112.4	S615 L616 T623	T613-S615 PolarHBondContact O-N 2.73Å; T613-L616 WeakPolarHBondContact O-CB 3.33Å; T613-L616 PolarHBondContact O-N 2.93Å; T613-T623 HydrophobicContact CG2-CG2 3.66Å
614	R	86	Confident	83.4	Confident	91 Å²	91	69.4 Å²	69.4	34%	0.343	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-58.7	-19.4	176.1	-150.5	179.1	-156	173.5	5.8	114.2	R482 P612 L616 E617	R482-R614 HydrophobicContact CG-CG 4.36Å; P612-R614 PolarHBondContact O-N 3.09Å; P612-R614 VanDerWaalsContact O-N 3.13Å; R614-L616 VanDerWaalsContact C-N 3.31Å; R614-E617 VanDerWaalsContact CG-CD 3.49Å; R614-E617 HydrophobicContact CG-CG 4.43Å; R614-E617 WeakPolarHBondContact CG-OE1 3.38Å; R614-E617 WeakPolarHBondContact CG-OE2 3.49Å
615	S	85.1	Confident	83.1	Confident	36 Å²	36	72.6 Å²	72.6	25%	0.252	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-76.3	-19.4	174.5	73.8	0	0	0	0	113.5	R482 I611 P612 T613	R482-S615 PolarHBondContact O-N 3.3Å; I611-S615 WeakPolarHBondContact CG2-OG 3.35Å; P612-S615 VanDerWaalsContact O-CB 3.27Å; P612-S615 WeakPolarHBondContact O-CB 3.09Å; P612-S615 PolarHBondContact O-N 2.66Å; P612-S615 PolarHBondContact O-OG 2.9Å; T613-S615 PolarHBondContact O-N 2.73Å
616	L	80.7	Confident	82.8	Confident	105 Å²	105	74.4 Å²	74.4	55%	0.55	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-14.4	178.3	-57.7	175.1	0	0	0	112.8	T613 R614 T618	T613-L616 WeakPolarHBondContact O-CB 3.33Å; T613-L616 PolarHBondContact O-N 2.93Å; R614-L616 VanDerWaalsContact C-N 3.31Å; L616-T618 PolarHBondContact O-N 2.95Å
617	E	77.9	Confident	82.5	Confident	50 Å²	50	77 Å²	77	23%	0.234	40%	0.403	C	S	.	.			trans	-54.2	130.2	176.6	-70.9	177.4	179.9	0	0	110.7	T393 R482 R614 V622	T393-E617 HydrophobicContact CG2-CB 4.26Å; T393-E617 WeakPolarHBondContact CG2-O 3.49Å; R482-E617 IonicContact CZ-OE2 3.4Å; R482-E617 IonicContact NH1-OE2 3.01Å; R482-E617 PolarHBondContact NH1-OE2 3.48Å; R482-E617 IonicContact NH2-OE2 3.68Å; R614-E617 VanDerWaalsContact CG-CD 3.49Å; R614-E617 HydrophobicContact CG-CG 4.43Å; R614-E617 WeakPolarHBondContact CG-OE1 3.38Å; R614-E617 WeakPolarHBondContact CG-OE2 3.49Å; E617-V622 WeakPolarHBondContact CA-O 3.35Å; E617-V622 HydrophobicContact CG-CG1 4.02Å
618	T	70.6	Confident	82.2	Confident	37 Å²	37	84.5 Å²	84.5	23%	0.227	44%	0.436	C	S	.	.			trans	-114.4	176.7	172	69.3	0	0	0	0	109.8	T393 L616 E620 Y621	T393-T618 VanDerWaalsContact CG2-C 3.49Å; T393-T618 VanDerWaalsContact OG1-C 3.25Å; L616-T618 PolarHBondContact O-N 2.95Å; T618-E620 PolarHBondContact OG1-N 2.84Å; T618-Y621 CarbonylContact C-O 3.57Å; T618-Y621 HydrophobicContact CG2-CD2 4.45Å; T618-Y621 HydrophobicContact CG2-CE1 4.27Å; T618-Y621 HydrophobicContact CG2-CE2 3.77Å; T618-Y621 PolarHBondContact N-O 2.84Å; T618-Y621 VanDerWaalsContact O-O 3.09Å; T618-Y621 VanDerWaalsContact OG1-CD1 3.32Å; T618-Y621 WeakPolarHBondContact OG1-CD1 3.45Å; T618-Y621 WeakPolarHBondContact OG1-CD2 3.18Å; T618-Y621 WeakPolarHBondContact OG1-CE1 3.47Å; T618-Y621 PolarHBondContact OG1-N 2.95Å; T618-Y621 VanDerWaalsContact OG1-N 3.07Å; T618-Y621 PolarHBondContact OG1-O 2.88Å
619	F	65	Low	81.9	Confident	129 Å²	129	85.5 Å²	85.5	57%	0.566	44%	0.438	S	S	*	.	S	Bend	trans	-70.9	-29.9	176.9	169.9	-110.1	0	0	0	110.1	L390 T393	L390-F619 HydrophobicContact CB-CE2 4.42Å; L390-F619 HydrophobicContact CD1-CE2 4.01Å; L390-F619 HydrophobicContact CD2-CD2 3.84Å; L390-F619 HydrophobicContact CD2-CE1 4.01Å; L390-F619 HydrophobicContact CD2-CE2 3.14Å; L390-F619 HydrophobicContact CD2-CZ 3.22Å; L390-F619 HydrophobicContact CG-CD2 3.74Å; L390-F619 HydrophobicContact CG-CE2 3.23Å; L390-F619 HydrophobicContact CG-CZ 3.89Å; T393-F619 WeakPolarHBondContact OG1-CA 3.27Å; T393-F619 VanDerWaalsContact OG1-CB 3.25Å; T393-F619 WeakPolarHBondContact OG1-CB 3.24Å; T393-F619 PolarHBondContact OG1-N 2.86Å
620	E	65.6	Low	81.5	Confident	120 Å²	120	88.4 Å²	88.4	56%	0.561	46%	0.46	S	S	*	.	S	Bend	trans	-82.4	-33.9	-176.1	-66.9	166.2	-176.6	0	0	111.7	T618 Y627	T618-E620 PolarHBondContact OG1-N 2.84Å; E620-Y627 HydrophobicContact CB-CE2 4.34Å
621	Y	70.9	Confident	81.4	Confident	66 Å²	66	92.9 Å²	92.9	26%	0.259	47%	0.472	S	S	.	.			trans	-153.5	154.7	-176.7	54.5	-98.4	0	0	0	113.2	T618 T623 P624 Y627	T618-Y621 CarbonylContact C-O 3.57Å; T618-Y621 HydrophobicContact CG2-CD2 4.45Å; T618-Y621 HydrophobicContact CG2-CE1 4.27Å; T618-Y621 HydrophobicContact CG2-CE2 3.77Å; T618-Y621 PolarHBondContact N-O 2.84Å; T618-Y621 VanDerWaalsContact O-O 3.09Å; T618-Y621 VanDerWaalsContact OG1-CD1 3.32Å; T618-Y621 WeakPolarHBondContact OG1-CD1 3.45Å; T618-Y621 WeakPolarHBondContact OG1-CD2 3.18Å; T618-Y621 WeakPolarHBondContact OG1-CE1 3.47Å; T618-Y621 PolarHBondContact OG1-N 2.95Å; T618-Y621 VanDerWaalsContact OG1-N 3.07Å; T618-Y621 PolarHBondContact OG1-O 2.88Å; Y621-T623 WeakPolarHBondContact CD2-O 3.45Å; Y621-P624 HydrophobicContact CD2-CG 4.36Å; Y621-P624 HydrophobicContact CE2-CB 4.23Å; Y621-P624 HydrophobicContact CE2-CG 3.7Å; Y621-Y627 AromaticContact CD1-CD2 3.71Å; Y621-Y627 HydrophobicContact CD1-CD2 3.71Å; Y621-Y627 HydrophobicContact CD1-CE2 4.44Å; Y621-Y627 HydrophobicContact CD1-CG 4.29Å; Y621-Y627 HydrophobicContact CG-CD2 4.34Å
622	V	76.5	Confident	81.3	Confident	86 Å²	86	98.4 Å²	98.4	52%	0.521	49%	0.492	S	S	.	.	S	Bend	trans	-77.3	-49.6	174.3	179.8	0	0	0	0	110	E617	E617-V622 WeakPolarHBondContact CA-O 3.35Å; E617-V622 HydrophobicContact CG-CG1 4.02Å
623	T	80.2	Confident	81.2	Confident	28 Å²	28	99.6 Å²	99.6	17%	0.172	50%	0.497	C	S	.	.	S	Bend	trans	-129.5	150.4	169.4	60.6	0	0	0	0	109.2	T613 Y621 E625 T626	T613-T623 HydrophobicContact CG2-CG2 3.66Å; Y621-T623 WeakPolarHBondContact CD2-O 3.45Å; T623-E625 PolarHBondContact O-N 3.02Å; T623-E625 VanDerWaalsContact O-N 3.07Å; T623-T626 PolarHBondContact N-OG1 3.41Å; T623-T626 VanDerWaalsContact N-OG1 3.13Å; T623-T626 PolarHBondContact O-N 3.04Å; T623-T626 PolarHBondContact O-OG1 3.23Å; T623-T626 VanDerWaalsContact OG1-CG2 3.26Å; T623-T626 WeakPolarHBondContact OG1-CG2 3.19Å; T623-T626 PolarHBondContact OG1-OG1 3.42Å
624	P	81.4	Confident	81.4	Confident	81 Å²	81	100 Å²	100	53%	0.526	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-53.9	-30.2	177.9	-26.6	34.1	0	0	0	113.5	Y621 T626 Y627	Y621-P624 HydrophobicContact CD2-CG 4.36Å; Y621-P624 HydrophobicContact CE2-CB 4.23Å; Y621-P624 HydrophobicContact CE2-CG 3.7Å; P624-T626 VanDerWaalsContact C-N 3.31Å; P624-T626 PolarHBondContact O-N 2.68Å; P624-Y627 WeakPolarHBondContact O-CB 3.32Å; P624-Y627 PolarHBondContact O-N 3.4Å
625	E	84.5	Confident	81.6	Confident	184 Å²	184	98.1 Å²	98.1	86%	0.86	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-68.7	-26.9	177.6	-61.3	170.5	-175	0	0	113.6	T623 Y627	T623-E625 PolarHBondContact O-N 3.02Å; T623-E625 VanDerWaalsContact O-N 3.07Å; E625-Y627 VanDerWaalsContact C-N 3.3Å
626	T	83.9	Confident	81.9	Confident	90 Å²	90	98.8 Å²	98.8	55%	0.552	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-85.9	-2.6	178.7	58	0	0	0	0	113.1	T623 P624	T623-T626 PolarHBondContact N-OG1 3.41Å; T623-T626 VanDerWaalsContact N-OG1 3.13Å; T623-T626 PolarHBondContact O-N 3.04Å; T623-T626 PolarHBondContact O-OG1 3.23Å; T623-T626 VanDerWaalsContact OG1-CG2 3.26Å; T623-T626 WeakPolarHBondContact OG1-CG2 3.19Å; T623-T626 PolarHBondContact OG1-OG1 3.42Å; P624-T626 VanDerWaalsContact C-N 3.31Å; P624-T626 PolarHBondContact O-N 2.68Å
627	Y	85	Confident	82.4	Confident	85 Å²	85	97.3 Å²	97.3	33%	0.333	51%	0.51	S	S	.	.			trans	-69	134.8	179.8	-174.1	-104.2	0	0	0	110.9	E620 Y621 P624 E625 E629 D633	E620-Y627 HydrophobicContact CB-CE2 4.34Å; Y621-Y627 AromaticContact CD1-CD2 3.71Å; Y621-Y627 HydrophobicContact CD1-CD2 3.71Å; Y621-Y627 HydrophobicContact CD1-CE2 4.44Å; Y621-Y627 HydrophobicContact CD1-CG 4.29Å; Y621-Y627 HydrophobicContact CG-CD2 4.34Å; P624-Y627 WeakPolarHBondContact O-CB 3.32Å; P624-Y627 PolarHBondContact O-N 3.4Å; E625-Y627 VanDerWaalsContact C-N 3.3Å; Y627-E629 HydrophobicContact CD1-CG 4.47Å; Y627-E629 HydrophobicContact CE1-CG 4.36Å; Y627-D633 PolarHBondContact OH-OD2 3.27Å
628	Q	85.1	Confident	83.2	Confident	170 Å²	170	99.9 Å²	99.9	79%	0.794	53%	0.525	S	S	*	.			trans	-110.4	119.8	174.1	-171.7	170.8	19.8	0	0	108.9	C630	Q628-C630 PolarHBondContact O-N 3.19Å
629	E	85.8	Confident	84.2	Confident	118 Å²	118	103 Å²	103	55%	0.551	54%	0.544	S	S	*	.			trans	-61.5	130.6	179.7	-62.7	176.9	171.4	0	0	110.8	Y627	Y627-E629 HydrophobicContact CD1-CG 4.47Å; Y627-E629 HydrophobicContact CE1-CG 4.36Å
630	C	85.1	Confident	85.6	Confident	79 Å²	79	104.5 Å²	104.5	53%	0.534	55%	0.55	S	S	.	*			trans	-88.7	162.8	173.6	-66.9	0	0	0	0	111.1	Q628 K632 D633	Q628-C630 PolarHBondContact O-N 3.19Å; C630-K632 PolarHBondContact O-N 3.34Å; C630-D633 WeakPolarHBondContact CB-OD2 3.33Å; C630-D633 PolarHBondContact N-OD2 3.25Å; C630-D633 WeakPolarHBondContact O-CB 3.37Å; C630-D633 PolarHBondContact O-N 2.78Å
631	E	90	Very high	87	Confident	198 Å²	198	103.9 Å²	103.9	93%	0.925	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-28	178.1	-173.5	-174.7	175.3	0	0	113.9
632	K	89.6	Confident	88	Confident	196 Å²	196	109.4 Å²	109.4	85%	0.852	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	0.7	179.8	-65.7	-174.9	178.1	-179.7	0	113.9	C630	C630-K632 PolarHBondContact O-N 3.34Å
633	D	88.5	Confident	88.7	Confident	55 Å²	55	110.8 Å²	110.8	29%	0.294	59%	0.587	S	S	.	*	S	Bend	trans	-89.6	136.8	178.3	-60.9	-19.9	0	0	0	109.6	Y627 C630 P635	Y627-D633 PolarHBondContact OH-OD2 3.27Å; C630-D633 WeakPolarHBondContact CB-OD2 3.33Å; C630-D633 PolarHBondContact N-OD2 3.25Å; C630-D633 WeakPolarHBondContact O-CB 3.37Å; C630-D633 PolarHBondContact O-N 2.78Å; D633-P635 WeakPolarHBondContact O-CD 3.45Å
634	T	91.1	Very high	89.3	Confident	95 Å²	95	117.7 Å²	117.7	58%	0.583	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-76.7	124.6	176.5	-47.8	0	0	0	0	109.5	D638 V639	T634-D638 HydrophobicContact CG2-CB 3.97Å; T634-V639 HydrophobicContact CG2-CG2 3.56Å
635	P	91.7	Very high	89.8	Confident	53 Å²	53	118.8 Å²	118.8	34%	0.344	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-57.6	147.2	178.3	-24.9	33.9	0	0	0	112.4	D633 A637 D638 V639	D633-P635 WeakPolarHBondContact O-CD 3.45Å; P635-A637 PolarHBondContact O-N 3.13Å; P635-A637 VanDerWaalsContact O-N 3.09Å; P635-D638 PolarHBondContact O-N 3.02Å; P635-D638 VanDerWaalsContact O-N 3.13Å; P635-V639 PolarHBondContact O-N 3.28Å
636	A	90.8	Very high	90.2	Very high	50 Å²	50	115.3 Å²	115.3	41%	0.413	61%	0.614	S	S	.	*	H	α-helix	trans	-60.7	-23.5	-179	0	0	0	0	0	114.1	K640	A636-K640 WeakPolarHBondContact O-CB 3.25Å; A636-K640 WeakPolarHBondContact O-CD 3.31Å; A636-K640 VanDerWaalsContact O-CG 3.25Å; A636-K640 WeakPolarHBondContact O-CG 3.45Å; A636-K640 PolarHBondContact O-N 3.09Å
637	A	92.1	Very high	90.6	Very high	73 Å²	73	114.4 Å²	114.4	60%	0.603	61%	0.608	S	S	*	*	H	α-helix	trans	-68	-48.4	175.6	0	0	0	0	0	111.4	P635 V639 K640 D641	P635-A637 PolarHBondContact O-N 3.13Å; P635-A637 VanDerWaalsContact O-N 3.09Å; A637-V639 PolarHBondContact O-N 3.42Å; A637-K640 PolarHBondContact O-N 3.13Å; A637-D641 PolarHBondContact O-N 3.14Å
638	D	93.6	Very high	91	Very high	105 Å²	105	119.6 Å²	119.6	56%	0.561	64%	0.638	S	S	*	*	H	α-helix	trans	-67.6	-36.8	-178.1	-58.8	-10.8	0	0	0	111.4	T634 P635 K640 D641	T634-D638 HydrophobicContact CG2-CB 3.97Å; P635-D638 PolarHBondContact O-N 3.02Å; P635-D638 VanDerWaalsContact O-N 3.13Å; D638-K640 VanDerWaalsContact C-N 3.31Å; D638-K640 PolarHBondContact O-N 2.93Å; D638-D641 PolarHBondContact O-N 2.91Å
639	V	92.5	Very high	91.3	Very high	103 Å²	103	115.2 Å²	115.2	62%	0.624	62%	0.616	S	S	*	*	H	α-helix	trans	-68.2	-31.4	177.7	179.4	0	0	0	0	112.3	T634 P635 A637 D641	T634-V639 HydrophobicContact CG2-CG2 3.56Å; P635-V639 PolarHBondContact O-N 3.28Å; A637-V639 PolarHBondContact O-N 3.42Å; V639-D641 VanDerWaalsContact C-N 3.34Å
640	K	94.1	Very high	91.6	Very high	159 Å²	159	112.9 Å²	112.9	69%	0.691	61%	0.61	S	S	*	*	H	α-helix	trans	-86.3	-7.9	179.6	-71.8	175.6	-176.1	175.1	0	112.9	A636 A637 D638 H642	A636-K640 WeakPolarHBondContact O-CB 3.25Å; A636-K640 WeakPolarHBondContact O-CD 3.31Å; A636-K640 VanDerWaalsContact O-CG 3.25Å; A636-K640 WeakPolarHBondContact O-CG 3.45Å; A636-K640 PolarHBondContact O-N 3.09Å; A637-K640 PolarHBondContact O-N 3.13Å; D638-K640 VanDerWaalsContact C-N 3.31Å; D638-K640 PolarHBondContact O-N 2.93Å; K640-H642 PolarHBondContact O-N 2.88Å
641	D	94.5	Very high	92	Very high	107 Å²	107	116.5 Å²	116.5	57%	0.572	62%	0.617	S	S	*	*			trans	-70.8	125.4	179.5	-166.8	20.2	0	0	0	110.8	A637 D638 V639 T643	A637-D641 PolarHBondContact O-N 3.14Å; D638-D641 PolarHBondContact O-N 2.91Å; V639-D641 VanDerWaalsContact C-N 3.34Å; D641-T643 PolarHBondContact O-N 3.46Å
642	H	92.7	Very high	92.1	Very high	183 Å²	183	112.7 Å²	112.7	85%	0.847	60%	0.599	S	S	*	*			trans	-90.7	87	-176.6	-75.6	-74.7	0	0	0	109.8	K640	K640-H642 PolarHBondContact O-N 2.88Å
643	T	91.6	Very high	92.1	Very high	114 Å²	114	108.2 Å²	108.2	70%	0.699	58%	0.581	S	S	*	*			trans	-90.5	-16.4	-179.3	55.7	0	0	0	0	114.1	D641 V645	D641-T643 PolarHBondContact O-N 3.46Å; T643-V645 PolarHBondContact O-N 3.3Å
644	F	92.7	Very high	92.2	Very high	174 Å²	174	108.7 Å²	108.7	76%	0.763	58%	0.584	S	S	*	*			trans	-72.9	122.3	-178	177.6	-106.4	0	0	0	112.2	P646	F644-P646 HydrophobicContact CE1-CB 4.21Å
645	V	91.1	Very high	92.3	Very high	104 Å²	104	107 Å²	107	63%	0.63	57%	0.571	S	S	*	*			trans	-108	124	173.1	-178.1	0	0	0	0	108.9	T643 V647	T643-V645 PolarHBondContact O-N 3.3Å; V645-V647 HydrophobicContact CG1-CG2 4.15Å; V645-V647 PolarHBondContact O-N 3.38Å; V645-V647 VanDerWaalsContact O-N 3.16Å
646	P	93	Very high	92.3	Very high	110 Å²	110	107.9 Å²	107.9	71%	0.714	57%	0.571	S	S	*	*			trans	-72.6	109.7	-179.7	28.7	-33.3	0	0	0	110.8	F644	F644-P646 HydrophobicContact CE1-CB 4.21Å
647	V	91.7	Very high	92.2	Very high	72 Å²	72	111.2 Å²	111.2	44%	0.436	58%	0.578	S	S	.	*			trans	-121.5	148.7	178.1	-174.1	0	0	0	0	109.9	V645 K649	V645-V647 HydrophobicContact CG1-CG2 4.15Å; V645-V647 PolarHBondContact O-N 3.38Å; V645-V647 VanDerWaalsContact O-N 3.16Å; V647-K649 HydrophobicContact CG1-CB 4.23Å; V647-K649 HydrophobicContact CG1-CD 3.92Å; V647-K649 HydrophobicContact CG1-CG 3.89Å; V647-K649 PolarHBondContact O-N 3.34Å
648	M	93.8	Very high	92.1	Very high	194 Å²	194	114 Å²	114	96%	0.956	58%	0.579	S	S	*	*	S	Bend	trans	-78.9	49	175.7	-65.8	-66.2	-66	0	0	112.4
649	K	92	Very high	92.1	Very high	78 Å²	78	115.2 Å²	115.2	34%	0.339	58%	0.581	S	S	.	*	S	Bend	trans	-130.9	153	177.7	-69.1	175.6	-168	172.8	0	109.2	V647 Q653 D654 E657	V647-K649 HydrophobicContact CG1-CB 4.23Å; V647-K649 HydrophobicContact CG1-CD 3.92Å; V647-K649 HydrophobicContact CG1-CG 3.89Å; V647-K649 PolarHBondContact O-N 3.34Å; K649-Q653 HydrophobicContact CB-CB 4.09Å; K649-D654 HydrophobicContact CB-CB 4.48Å; K649-E657 VanDerWaalsContact CE-OE2 3.28Å; K649-E657 WeakPolarHBondContact CE-OE2 3.35Å; K649-E657 IonicContact NZ-OE1 2.87Å; K649-E657 PolarHBondContact NZ-OE1 2.94Å; K649-E657 IonicContact NZ-OE2 2.59Å; K649-E657 PolarHBondContact NZ-OE2 3.46Å
650	T	92.2	Very high	92	Very high	69 Å²	69	117 Å²	117	42%	0.423	59%	0.587	S	S	.	*			trans	-73.9	162.5	168.4	74.9	0	0	0	0	110.5	E652 Q653 D654	T650-E652 WeakPolarHBondContact CB-OE2 3.45Å; T650-E652 PolarHBondContact O-N 3.27Å; T650-E652 PolarHBondContact OG1-OE2 3.34Å; T650-Q653 VanDerWaalsContact N-OE1 3.08Å; T650-Q653 PolarHBondContact O-N 3.47Å; T650-Q653 VanDerWaalsContact O-N 3.13Å; T650-Q653 WeakPolarHBondContact OG1-CG 3.39Å; T650-Q653 PolarHBondContact OG1-N 2.81Å; T650-D654 PolarHBondContact O-N 3.46Å
651	F	92.7	Very high	91.8	Very high	154 Å²	154	114.1 Å²	114.1	68%	0.675	58%	0.578	S	S	*	*	H	α-helix	trans	-53.9	-42.5	175.3	173.7	-103	0	0	0	111.3	D654 I655	F651-D654 PolarHBondContact O-N 3.48Å; F651-I655 HydrophobicContact CD2-CG1 4.31Å; F651-I655 HydrophobicContact CE1-CG1 4.25Å; F651-I655 HydrophobicContact CE2-CD1 4.21Å; F651-I655 HydrophobicContact CE2-CG1 3.91Å; F651-I655 HydrophobicContact CZ-CD1 4.36Å; F651-I655 HydrophobicContact CZ-CG1 3.88Å; F651-I655 VanDerWaalsContact O-CG1 3.31Å; F651-I655 WeakPolarHBondContact O-CG1 3.25Å; F651-I655 PolarHBondContact O-N 3.01Å; F651-I655 VanDerWaalsContact O-N 3.09Å
652	E	91.6	Very high	91.3	Very high	119 Å²	119	117.4 Å²	117.4	56%	0.556	59%	0.587	S	S	*	*	H	α-helix	trans	-65.1	-43.4	178.6	-58.9	76.4	-167.3	0	0	111.8	T650 M656	T650-E652 WeakPolarHBondContact CB-OE2 3.45Å; T650-E652 PolarHBondContact O-N 3.27Å; T650-E652 PolarHBondContact OG1-OE2 3.34Å; E652-M656 WeakPolarHBondContact O-CB 3.35Å; E652-M656 WeakPolarHBondContact O-CG 3.44Å; E652-M656 PolarHBondContact O-N 2.96Å
653	Q	90.1	Very high	90.5	Very high	102 Å²	102	111.5 Å²	111.5	48%	0.477	58%	0.575	S	S	.	*	H	α-helix	trans	-65	-41.2	178.4	-72.8	174.4	-19.5	0	0	112.2	K649 T650 M656 E657	K649-Q653 HydrophobicContact CB-CB 4.09Å; T650-Q653 VanDerWaalsContact N-OE1 3.08Å; T650-Q653 PolarHBondContact O-N 3.47Å; T650-Q653 VanDerWaalsContact O-N 3.13Å; T650-Q653 WeakPolarHBondContact OG1-CG 3.39Å; T650-Q653 PolarHBondContact OG1-N 2.81Å; Q653-M656 PolarHBondContact O-N 2.59Å; Q653-E657 PolarHBondContact O-N 3.32Å
654	D	91.6	Very high	89.5	Confident	65 Å²	65	113 Å²	113	35%	0.348	58%	0.579	S	S	.	*	H	α-helix	trans	-64.3	-46.9	179.9	-162.2	37.6	0	0	0	111.1	K649 T650 F651 E657 Q658	K649-D654 HydrophobicContact CB-CB 4.48Å; T650-D654 PolarHBondContact O-N 3.46Å; F651-D654 PolarHBondContact O-N 3.48Å; D654-E657 PolarHBondContact O-N 3.06Å; D654-Q658 WeakPolarHBondContact O-CB 3.48Å; D654-Q658 PolarHBondContact O-N 3.23Å
655	I	92.2	Very high	88.3	Confident	60 Å²	60	112.3 Å²	112.3	31%	0.308	58%	0.583	S	S	.	*	H	α-helix	trans	-65	-41.3	175.5	-64.5	-62.5	0	0	0	111.7	F651 E657 Q658 E659	F651-I655 HydrophobicContact CD2-CG1 4.31Å; F651-I655 HydrophobicContact CE1-CG1 4.25Å; F651-I655 HydrophobicContact CE2-CD1 4.21Å; F651-I655 HydrophobicContact CE2-CG1 3.91Å; F651-I655 HydrophobicContact CZ-CD1 4.36Å; F651-I655 HydrophobicContact CZ-CG1 3.88Å; F651-I655 VanDerWaalsContact O-CG1 3.31Å; F651-I655 WeakPolarHBondContact O-CG1 3.25Å; F651-I655 PolarHBondContact O-N 3.01Å; F651-I655 VanDerWaalsContact O-N 3.09Å; I655-E657 VanDerWaalsContact C-N 3.29Å; I655-E657 PolarHBondContact O-N 2.92Å; I655-Q658 PolarHBondContact O-N 2.81Å; I655-E659 HydrophobicContact CG2-CG 4.1Å; I655-E659 WeakPolarHBondContact O-CB 3.39Å; I655-E659 WeakPolarHBondContact O-CG 3.37Å; I655-E659 PolarHBondContact O-N 3.42Å
656	M	90.8	Very high	87.5	Confident	71 Å²	71	116.4 Å²	116.4	35%	0.35	60%	0.595	S	S	.	*	H	α-helix	trans	-59	-41.7	177.1	-80.2	-178.3	70.9	0	0	111.8	E652 Q653 N660 I661	E652-M656 WeakPolarHBondContact O-CB 3.35Å; E652-M656 WeakPolarHBondContact O-CG 3.44Å; E652-M656 PolarHBondContact O-N 2.96Å; Q653-M656 PolarHBondContact O-N 2.59Å; M656-N660 CarbonylContact O-C 3.56Å; M656-N660 PolarHBondContact O-N 3.43Å; M656-N660 VanDerWaalsContact O-N 3.13Å; M656-I661 HydrophobicContact CB-CB 4.33Å; M656-I661 HydrophobicContact CE-CG2 4.12Å; M656-I661 WeakPolarHBondContact CE-O 3.28Å; M656-I661 HydrophobicContact CG-CB 4.29Å; M656-I661 HydrophobicContact CG-CG2 4.49Å; M656-I661 PolarHBondContact O-N 2.8Å
657	E	89.5	Confident	86.9	Confident	119 Å²	119	116.3 Å²	116.3	56%	0.556	60%	0.597	S	S	*	*	H	α-helix	trans	-71.1	-41.7	177.4	-168.3	170.1	143.2	0	0	112.1	K649 Q653 D654 I655 E659 N660	K649-E657 VanDerWaalsContact CE-OE2 3.28Å; K649-E657 WeakPolarHBondContact CE-OE2 3.35Å; K649-E657 IonicContact NZ-OE1 2.87Å; K649-E657 PolarHBondContact NZ-OE1 2.94Å; K649-E657 IonicContact NZ-OE2 2.59Å; K649-E657 PolarHBondContact NZ-OE2 3.46Å; Q653-E657 PolarHBondContact O-N 3.32Å; D654-E657 PolarHBondContact O-N 3.06Å; I655-E657 VanDerWaalsContact C-N 3.29Å; I655-E657 PolarHBondContact O-N 2.92Å; E657-E659 VanDerWaalsContact C-N 3.35Å; E657-E659 PolarHBondContact O-N 3.25Å; E657-N660 PolarHBondContact O-N 3.21Å; E657-N660 VanDerWaalsContact O-N 3.14Å
658	Q	90.6	Very high	86.6	Confident	133 Å²	133	118 Å²	118	62%	0.621	61%	0.609	S	S	*	*	H	α-helix	trans	-63.9	-39	179.5	-160.3	175.3	9.2	0	0	112.3	D654 I655 N660	D654-Q658 WeakPolarHBondContact O-CB 3.48Å; D654-Q658 PolarHBondContact O-N 3.23Å; I655-Q658 PolarHBondContact O-N 2.81Å; Q658-N660 VanDerWaalsContact C-N 3.32Å
659	E	93.7	Very high	86.4	Confident	130 Å²	130	116.5 Å²	116.5	61%	0.607	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	3.6	176.5	-64.7	-63.8	143.3	0	0	113.1	I655 E657 I661	I655-E659 HydrophobicContact CG2-CG 4.1Å; I655-E659 WeakPolarHBondContact O-CB 3.39Å; I655-E659 WeakPolarHBondContact O-CG 3.37Å; I655-E659 PolarHBondContact O-N 3.42Å; E657-E659 VanDerWaalsContact C-N 3.35Å; E657-E659 PolarHBondContact O-N 3.25Å; E659-I661 HydrophobicContact CB-CD1 3.89Å; E659-I661 HydrophobicContact CB-CG1 3.85Å; E659-I661 PolarHBondContact O-N 3.09Å
660	N	90.4	Very high	86.2	Confident	141 Å²	141	117.5 Å²	117.5	75%	0.754	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.4	34	-176.8	-66.6	-72.7	0	0	0	114.6	M656 E657 Q658 K662	M656-N660 CarbonylContact O-C 3.56Å; M656-N660 PolarHBondContact O-N 3.43Å; M656-N660 VanDerWaalsContact O-N 3.13Å; E657-N660 PolarHBondContact O-N 3.21Å; E657-N660 VanDerWaalsContact O-N 3.14Å; Q658-N660 VanDerWaalsContact C-N 3.32Å; N660-K662 PolarHBondContact O-N 3Å
661	I	90.3	Very high	86.1	Confident	97 Å²	97	124.2 Å²	124.2	50%	0.497	64%	0.637	S	S	.	*			trans	-80.3	107.2	176.2	-56.1	172.4	0	0	0	108.9	M656 E659	M656-I661 HydrophobicContact CB-CB 4.33Å; M656-I661 HydrophobicContact CE-CG2 4.12Å; M656-I661 WeakPolarHBondContact CE-O 3.28Å; M656-I661 HydrophobicContact CG-CB 4.29Å; M656-I661 HydrophobicContact CG-CG2 4.49Å; M656-I661 PolarHBondContact O-N 2.8Å; E659-I661 HydrophobicContact CB-CD1 3.89Å; E659-I661 HydrophobicContact CB-CG1 3.85Å; E659-I661 PolarHBondContact O-N 3.09Å
662	K	83.2	Confident	85.8	Confident	176 Å²	176	128.3 Å²	128.3	77%	0.765	65%	0.648	S	S	*	*			trans	-83.3	124.2	173.7	-65.3	-175.2	179.2	-178.6	0	110.8	N660	N660-K662 PolarHBondContact O-N 3Å
663	G	75.7	Confident	85.6	Confident	59 Å²	59	136.2 Å²	136.2	61%	0.608	68%	0.675	S	S	*	*			trans	-91.6	91.5	171	0	0	0	0	0	110.3	L665	G663-L665 PolarHBondContact O-N 3.05Å
664	D	69.8	Low	85.3	Confident	146 Å²	146	138 Å²	138	78%	0.781	69%	0.685	S	S	*	*			trans	-80.3	10.9	-175.7	-64.2	-21.6	0	0	0	113.9
665	L	67.9	Low	85	Confident	160 Å²	160	141.8 Å²	141.8	84%	0.838	70%	0.703	S	S	*	*			trans	-123.8	110.5	-178.5	-71.8	163	0	0	0	110.2	G663 S667	G663-L665 PolarHBondContact O-N 3.05Å; L665-S667 PolarHBondContact O-N 3.13Å
666	E	75.7	Confident	84.6	Confident	190 Å²	190	146.3 Å²	146.3	89%	0.888	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-63	128.8	162.6	-70	-176	171	0	0	108.6
667	S	80.4	Confident	84.2	Confident	108 Å²	108	150.8 Å²	150.8	76%	0.755	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.5	128.1	177.4	-70.3	0	0	0	0	109.2	L665	L665-S667 PolarHBondContact O-N 3.13Å
668	P	84.1	Confident	83.9	Confident	107 Å²	107	152.8 Å²	152.8	70%	0.695	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-62	148.7	176.5	26.4	-33.6	0	0	0	110	T670	P668-T670 PolarHBondContact O-N 2.87Å
669	N	89.4	Confident	83.5	Confident	163 Å²	163	154.1 Å²	154.1	87%	0.872	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-57.8	128.7	176.4	-70.9	-22.5	0	0	0	110.4
670	T	89.4	Confident	82.7	Confident	99 Å²	99	155.8 Å²	155.8	61%	0.607	78%	0.779	S	S	*	*			trans	-116.2	146	177.3	50.2	0	0	0	0	110.1	P668 W672	P668-T670 PolarHBondContact O-N 2.87Å; T670-W672 PolarHBondContact OG1-NE1 3.16Å
671	Y	89.8	Confident	82.1	Confident	209 Å²	209	156.9 Å²	156.9	82%	0.82	78%	0.781	S	S	*	*			trans	-97.2	133.1	171.6	-60.8	-82.7	0	0	0	109
672	W	85.3	Confident	81.5	Confident	240 Å²	240	161.9 Å²	161.9	91%	0.909	81%	0.805	S	S	*	*			trans	-107.1	111.3	173.5	-65.5	79.7	0	0	0	107.6	T670	T670-W672 PolarHBondContact OG1-NE1 3.16Å
673	Y	86.8	Confident	81.3	Confident	286 Å²	286	160.6 Å²	160.6	100%	1.122	81%	0.809	S	S	*	*			trans	-124.1	0	-179.8	55.8	-98.1	0	0	0	111.7

Retrieved 673 of 673 residues in 274.2 ms (Link to these results)

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