A0A077ZF68_TRITR Loading...

RasGEF N and RasGEF domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZF68, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 497 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	41.4	Very low	34.2	Very low	51 Å²	51	89.7 Å²	89.7	25%	0.251	48%	0.477	S	S	.	.				0	-47.2	0	-87.4	-71.1	-97	0	0	112.6	K3 L4 F5 I306 Q309 L310 L313	M1-K3 PolarHBondContact O-N 3.15Å; M1-K3 VanDerWaalsContact O-N 3.14Å; M1-L4 HydrophobicContact CG-CD1 4.28Å; M1-L4 CarbonylContact O-C 3.55Å; M1-L4 VanDerWaalsContact O-CA 3.28Å; M1-L4 WeakPolarHBondContact O-CA 3.33Å; M1-L4 VanDerWaalsContact O-CB 3.24Å; M1-L4 WeakPolarHBondContact O-CB 3.23Å; M1-L4 PolarHBondContact O-N 3.22Å; M1-L4 HydrophobicContact SD-CB 4.04Å; M1-L4 HydrophobicContact SD-CD1 3.36Å; M1-L4 WeakPolarHBondContact SD-CD1 3.37Å; M1-L4 HydrophobicContact SD-CG 4.31Å; M1-F5 HydrophobicContact CB-CD2 4.44Å; M1-F5 HydrophobicContact CB-CE2 4.21Å; M1-F5 HydrophobicContact CE-CE2 3.76Å; M1-F5 HydrophobicContact CE-CZ 4.12Å; M1-F5 WeakPolarHBondContact O-CD2 3.1Å; M1-F5 PolarHBondContact O-N 3.37Å; M1-F5 HydrophobicContact SD-CE2 4.17Å; M1-I306 HydrophobicContact CE-CG2 4.35Å; M1-Q309 HydrophobicContact CB-CG 3.73Å; M1-Q309 HydrophobicContact CG-CB 3.91Å; M1-Q309 HydrophobicContact CG-CG 3.29Å; M1-L310 HydrophobicContact CE-CB 4.39Å; M1-L310 HydrophobicContact CE-CD2 3.1Å; M1-L310 HydrophobicContact CE-CG 3.42Å; M1-L310 VanDerWaalsContact CE-CG 3.42Å; M1-L313 HydrophobicContact CB-CD1 3.92Å
2	E	34.8	Very low	33.9	Very low	136 Å²	136	90.3 Å²	90.3	64%	0.636	48%	0.48	S	S	*	.	H	α-helix	trans	-53.4	-35.3	172.4	-70.1	-177.6	159.6	0	0	113.4	L4 F5 S6	E2-L4 VanDerWaalsContact C-N 3.34Å; E2-L4 PolarHBondContact O-N 3.36Å; E2-F5 CarbonylContact O-C 3.51Å; E2-F5 PolarHBondContact O-N 2.83Å; E2-S6 WeakPolarHBondContact O-CB 3.34Å; E2-S6 PolarHBondContact O-N 3.17Å
3	K	35.8	Very low	33.6	Very low	81 Å²	81	88.6 Å²	88.6	35%	0.352	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-31.9	168	-68.1	-173.6	178.4	-171.7	0	115.4	M1 S6 C291 L295	M1-K3 PolarHBondContact O-N 3.15Å; M1-K3 VanDerWaalsContact O-N 3.14Å; K3-S6 PolarHBondContact O-OG 3.4Å; K3-C291 WeakPolarHBondContact CE-O 3.49Å; K3-C291 PolarHBondContact NZ-O 3.2Å; K3-L295 HydrophobicContact CB-CD2 4.01Å
4	L	39.5	Very low	33.5	Very low	18 Å²	18	89.6 Å²	89.6	9%	0.094	50%	0.497	C	S	.	.	H	α-helix	trans	-71.2	-39.5	173.3	-77.6	164.1	0	0	0	109.3	M1 E2 W354	M1-L4 HydrophobicContact CG-CD1 4.28Å; M1-L4 CarbonylContact O-C 3.55Å; M1-L4 VanDerWaalsContact O-CA 3.28Å; M1-L4 WeakPolarHBondContact O-CA 3.33Å; M1-L4 VanDerWaalsContact O-CB 3.24Å; M1-L4 WeakPolarHBondContact O-CB 3.23Å; M1-L4 PolarHBondContact O-N 3.22Å; M1-L4 HydrophobicContact SD-CB 4.04Å; M1-L4 HydrophobicContact SD-CD1 3.36Å; M1-L4 WeakPolarHBondContact SD-CD1 3.37Å; M1-L4 HydrophobicContact SD-CG 4.31Å; E2-L4 VanDerWaalsContact C-N 3.34Å; E2-L4 PolarHBondContact O-N 3.36Å; L4-W354 HydrophobicContact CB-CZ2 4.15Å; L4-W354 HydrophobicContact CD1-CZ2 4.05Å; L4-W354 HydrophobicContact CD2-CZ2 3.91Å; L4-W354 HydrophobicContact CG-CZ2 4.25Å; L4-W354 PolarHBondContact O-NE1 3.19Å
5	F	38.6	Very low	33.4	Very low	18 Å²	18	92.6 Å²	92.6	8%	0.079	50%	0.503	C	S	.	.	H	α-helix	trans	-76.2	-25.3	176.4	-71.1	-77.5	0	0	0	115.5	M1 E2 M7 S8 L310 L313 H347 K350 M351	M1-F5 HydrophobicContact CB-CD2 4.44Å; M1-F5 HydrophobicContact CB-CE2 4.21Å; M1-F5 HydrophobicContact CE-CE2 3.76Å; M1-F5 HydrophobicContact CE-CZ 4.12Å; M1-F5 WeakPolarHBondContact O-CD2 3.1Å; M1-F5 PolarHBondContact O-N 3.37Å; M1-F5 HydrophobicContact SD-CE2 4.17Å; E2-F5 CarbonylContact O-C 3.51Å; E2-F5 PolarHBondContact O-N 2.83Å; F5-M7 PolarHBondContact O-N 3.42Å; F5-S8 PolarHBondContact O-N 3.25Å; F5-L310 HydrophobicContact CZ-CD2 3.95Å; F5-L313 HydrophobicContact CD2-CD1 4.3Å; F5-L313 HydrophobicContact CE2-CD1 3.64Å; F5-L313 HydrophobicContact CZ-CD1 4.43Å; F5-H347 AromaticContact CE1-CE1 3.66Å; F5-H347 AromaticContact CE2-CE1 3.8Å; F5-H347 AromaticContact CZ-CE1 3.4Å; F5-H347 WeakPolarHBondContact CZ-CE1 3.46Å; F5-K350 HydrophobicContact CD1-CB 4.1Å; F5-M351 HydrophobicContact CE1-CB 4.12Å; F5-M351 HydrophobicContact CE1-CE 3.49Å; F5-M351 VanDerWaalsContact CE1-CE 3.49Å; F5-M351 HydrophobicContact CE1-CG 4.45Å; F5-M351 HydrophobicContact CE1-SD 3.37Å; F5-M351 WeakPolarHBondContact CE1-SD 3.41Å; F5-M351 HydrophobicContact CE2-CE 4.49Å; F5-M351 HydrophobicContact CZ-CE 3.25Å; F5-M351 HydrophobicContact CZ-SD 3.31Å; F5-M351 WeakPolarHBondContact CZ-SD 3.38Å
6	S	36	Very low	33.3	Very low	89 Å²	89	96.4 Å²	96.4	62%	0.622	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	5.1	-176.2	68.7	0	0	0	0	113.8	E2 K3 S8	E2-S6 WeakPolarHBondContact O-CB 3.34Å; E2-S6 PolarHBondContact O-N 3.17Å; K3-S6 PolarHBondContact O-OG 3.4Å; S6-S8 VanDerWaalsContact C-N 3.25Å; S6-S8 PolarHBondContact O-N 2.81Å
7	M	34.1	Very low	33.3	Very low	85 Å²	85	98.5 Å²	98.5	42%	0.419	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	15	173	-63.9	-162.4	74.9	0	0	113.6	F5 S9 R358 E361	F5-M7 PolarHBondContact O-N 3.42Å; M7-S9 PolarHBondContact O-N 3.34Å; M7-R358 PolarHBondContact SD-NH1 2.79Å; M7-R358 VanDerWaalsContact SD-NH1 3.38Å; M7-R358 PolarHBondContact SD-NH2 3.21Å; M7-E361 WeakPolarHBondContact CE-OE1 2.82Å
8	S	29.5	Very low	33.4	Very low	57 Å²	57	100.1 Å²	100.1	40%	0.399	53%	0.531	S	S	.	.			trans	-88.3	78.4	173.2	67.7	0	0	0	0	111.8	F5 S6	F5-S8 PolarHBondContact O-N 3.25Å; S6-S8 VanDerWaalsContact C-N 3.25Å; S6-S8 PolarHBondContact O-N 2.81Å
9	S	28.9	Very low	33.4	Very low	98 Å²	98	102.6 Å²	102.6	69%	0.685	54%	0.539	S	S	*	.			trans	166.7	89.7	147.3	55.3	0	0	0	0	110.9	M7	M7-S9 PolarHBondContact O-N 3.34Å
10	N	26.2	Very low	33.4	Very low	160 Å²	160	100.5 Å²	100.5	86%	0.856	54%	0.537	S	S	*	.			trans	-138.5	77.1	146.5	-99.1	-12.7	0	0	0	106.4	D12	N10-D12 VanDerWaalsContact C-N 3.26Å; N10-D12 PolarHBondContact O-N 3.29Å
11	F	31	Very low	33.3	Very low	194 Å²	194	102 Å²	102	85%	0.851	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	90.1	161.9	-101.8	-89.9	0	0	0	106.8
12	D	30.6	Very low	32.8	Very low	97 Å²	97	104.4 Å²	104.4	52%	0.519	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-176.4	-3.7	152.8	-98.7	-27.9	0	0	0	113	N10 T14 K15	N10-D12 VanDerWaalsContact C-N 3.26Å; N10-D12 PolarHBondContact O-N 3.29Å; D12-T14 PolarHBondContact O-N 2.83Å; D12-K15 PolarHBondContact O-N 3.14Å; D12-K15 VanDerWaalsContact O-N 3.15Å; D12-K15 IonicContact OD1-NZ 2.66Å; D12-K15 PolarHBondContact OD1-NZ 3.3Å
13	A	30.4	Very low	32.6	Very low	68 Å²	68	106.6 Å²	106.6	56%	0.562	57%	0.574	S	S	*	*	H	α-helix	trans	-66.4	-15.8	174.9	0	0	0	0	0	114.2	K15	A13-K15 VanDerWaalsContact C-N 3.33Å
14	T	32.3	Very low	32	Very low	103 Å²	103	110.6 Å²	110.6	63%	0.632	60%	0.596	S	S	*	*	H	α-helix	trans	-73.7	-20.9	173.9	44.3	0	0	0	0	113.2	D12	D12-T14 PolarHBondContact O-N 2.83Å
15	K	32.4	Very low	31.5	Very low	134 Å²	134	119.8 Å²	119.8	58%	0.583	64%	0.635	S	S	*	*	H	α-helix	trans	-80	-30	178.1	-74.3	-178.8	-172.6	142.4	0	113.7	D12 A13	D12-K15 PolarHBondContact O-N 3.14Å; D12-K15 VanDerWaalsContact O-N 3.15Å; D12-K15 IonicContact OD1-NZ 2.66Å; D12-K15 PolarHBondContact OD1-NZ 3.3Å; A13-K15 VanDerWaalsContact C-N 3.33Å
16	E	30.6	Very low	30.9	Very low	154 Å²	154	124.4 Å²	124.4	72%	0.72	67%	0.67	S	S	*	*	H	α-helix	trans	-79.9	-31.4	-177.3	-73.6	-173	156.8	0	0	112.8	A20	E16-A20 PolarHBondContact O-N 3.04Å
17	Q	34.7	Very low	30.8	Very low	132 Å²	132	125 Å²	125	62%	0.617	67%	0.672	S	S	*	*	H	α-helix	trans	-74.2	-34.4	-179.5	-142.4	101.4	20.2	0	0	112.5	A20 N21	Q17-A20 PolarHBondContact O-N 3.43Å; Q17-N21 PolarHBondContact O-N 3.11Å
18	D	34.6	Very low	30.3	Very low	126 Å²	126	129.2 Å²	129.2	67%	0.674	69%	0.69	S	S	*	*	H	α-helix	trans	-72.6	-30.4	178	-73.6	-17.8	0	0	0	112.1
19	Q	34.2	Very low	30.1	Very low	149 Å²	149	133.5 Å²	133.5	70%	0.696	71%	0.714	S	S	*	*	H	α-helix	trans	-76.4	-28.6	172.8	-75.2	-172.8	-1.1	0	0	113.4
20	A	32.4	Very low	29.8	Very low	59 Å²	59	133.9 Å²	133.9	49%	0.488	72%	0.716	S	S	.	*	H	α-helix	trans	-74.5	-36.2	178.1	0	0	0	0	0	112.5	E16 Q17	E16-A20 PolarHBondContact O-N 3.04Å; Q17-A20 PolarHBondContact O-N 3.43Å
21	N	31	Very low	29.6	Very low	134 Å²	134	132.1 Å²	132.1	72%	0.717	72%	0.715	S	S	*	*	H	α-helix	trans	-81.9	-11.1	-176.9	-80.8	-16	0	0	0	114.7	Q17	Q17-N21 PolarHBondContact O-N 3.11Å
22	S	31.5	Very low	29.2	Very low	100 Å²	100	128 Å²	128	70%	0.699	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-4.6	175.4	121.4	0	0	0	0	114.2
23	K	29.5	Very low	28.8	Very low	182 Å²	182	131.5 Å²	131.5	79%	0.791	73%	0.729	S	S	*	*	S	Bend	trans	-111.2	17.4	-172.8	-83.4	-172.1	177	178.8	0	116.2
24	M	24	Very low	28.4	Very low	166 Å²	166	134.4 Å²	134.4	82%	0.818	74%	0.74	S	S	*	*			trans	-122.6	123.2	174.5	-71.4	-176.8	104.2	0	0	112.2
25	K	28.3	Very low	27.9	Very low	210 Å²	210	137.7 Å²	137.7	91%	0.913	75%	0.748	S	S	*	*	S	Bend	trans	92.5	121.9	-177.4	-57.3	175.3	179.7	-178.9	0	113.1
26	S	27.2	Very low	27.5	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	76%	0.762	S	S	*	*			cis	-165.6	-179	9.1	71.7	0	0	0	0	108.6
27	P	33.5	Very low	26.9	Very low	102 Å²	102	142.6 Å²	142.6	66%	0.662	77%	0.767	S	S	*	*			trans	-107.7	172.9	-141	43.7	-40.8	0	0	0	117.6
28	H	23.5	Very low	26.3	Very low	174 Å²	174	145.1 Å²	145.1	81%	0.806	78%	0.778	S	S	*	*			trans	59.2	107.1	155.8	-66.1	-64.5	0	0	0	119.4
29	T	25.6	Very low	25.6	Very low	147 Å²	147	146 Å²	146	90%	0.902	78%	0.782	S	S	*	*				-178.4	154.1	113.3	20.8	0	0	0	0	112.2
30	S	22.4	Very low	25	Very low	105 Å²	105	145.9 Å²	145.9	73%	0.734	79%	0.786	S	S	*	*			trans	-74.7	141.2	-167.9	48.9	0	0	0	0	115.9
31	C	21.4	Very low	24.6	Very low	124 Å²	124	151.1 Å²	151.1	84%	0.838	80%	0.8	S	S	*	*			trans	30.6	107.5	134.6	-148.6	0	0	0	0	118.7
32	S	23	Very low	24.2	Very low	108 Å²	108	154.7 Å²	154.7	76%	0.755	81%	0.809	S	S	*	*			trans	-179.6	136.5	132	28.7	0	0	0	0	110.8
33	D	22.1	Very low	24	Very low	169 Å²	169	155.1 Å²	155.1	90%	0.904	81%	0.812	S	S	*	*			trans	-54.6	131.5	175.7	-70.6	-57.4	0	0	0	112.6
34	V	23.4	Very low	24	Very low	129 Å²	129	153.7 Å²	153.7	78%	0.782	81%	0.813	S	S	*	*			trans	-133.4	115.3	166.8	-178.4	0	0	0	0	110.7
35	H	20.6	Very low	24.2	Very low	173 Å²	173	153.1 Å²	153.1	80%	0.801	81%	0.808	S	S	*	*			trans	-50.2	126.8	166.2	-104.6	27.8	0	0	0	112.6	R37	H35-R37 PolarHBondContact O-N 2.8Å
36	I	23.5	Very low	24.2	Very low	171 Å²	171	152.3 Å²	152.3	88%	0.877	81%	0.805	S	S	*	*			trans	-85.2	103	167.9	-59.9	176.8	0	0	0	108.1
37	R	19.7	Very low	24.1	Very low	219 Å²	219	153.4 Å²	153.4	83%	0.826	81%	0.807	S	S	*	*			trans	-85	133.1	164.6	-79.9	-171	-178.2	167.5	2.2	109.9	H35 I39	H35-R37 PolarHBondContact O-N 2.8Å; R37-I39 PolarHBondContact O-N 2.77Å
38	H	20.7	Very low	23.8	Very low	185 Å²	185	154.7 Å²	154.7	86%	0.856	81%	0.813	S	S	*	*			trans	-49.1	120.4	166.9	-124.2	-120.8	0	0	0	110.7
39	I	21.3	Very low	23.9	Very low	145 Å²	145	151.6 Å²	151.6	74%	0.744	81%	0.811	S	S	*	*			trans	-118.4	111.7	161	-64.8	178.8	0	0	0	106.8	R37 Q41	R37-I39 PolarHBondContact O-N 2.77Å; I39-Q41 HydrophobicContact CG2-CG 4.26Å
40	D	20.3	Very low	23.8	Very low	146 Å²	146	153.7 Å²	153.7	78%	0.781	80%	0.802	S	S	*	*			trans	-80.6	107.9	173.4	-149.5	-2.8	0	0	0	107.4
41	Q	24.6	Very low	24	Very low	169 Å²	169	157 Å²	157	79%	0.79	80%	0.803	S	S	*	*			trans	-135.6	111.7	164.9	-82.7	-168.1	-18.4	0	0	109.5	I39 S43	I39-Q41 HydrophobicContact CG2-CG 4.26Å; Q41-S43 PolarHBondContact O-N 3.49Å; Q41-S43 VanDerWaalsContact O-N 3.11Å
42	K	22.3	Very low	24.1	Very low	210 Å²	210	157 Å²	157	91%	0.913	80%	0.799	S	S	*	*			trans	-45.9	108.3	164.4	-65.2	173.6	175.7	178.6	0	110.5
43	S	27.4	Very low	24.3	Very low	108 Å²	108	158.8 Å²	158.8	76%	0.755	79%	0.794	S	S	*	*			trans	-156.5	133.9	142.7	59.7	0	0	0	0	108.4	Q41	Q41-S43 PolarHBondContact O-N 3.49Å; Q41-S43 VanDerWaalsContact O-N 3.11Å
44	D	28.3	Very low	24.8	Very low	153 Å²	153	157.5 Å²	157.5	82%	0.818	79%	0.792	S	S	*	*	S	Bend	trans	-42.7	149.4	177.7	-62.6	-57.7	0	0	0	112.5
45	Q	28.3	Very low	25	Very low	153 Å²	153	159.1 Å²	159.1	72%	0.715	80%	0.796	S	S	*	*			trans	91.9	90.5	171.9	-51.2	175.9	-12.7	0	0	116.2
46	K	28.8	Very low	25.3	Very low	193 Å²	193	154.6 Å²	154.6	84%	0.839	80%	0.795	S	S	*	*			trans	167.9	90.4	133.3	-91.3	162.9	-173.6	-178.3	0	109.6	V48	K46-V48 PolarHBondContact O-N 3.15Å
47	T	25.8	Very low	25.4	Very low	139 Å²	139	148.8 Å²	148.8	85%	0.853	78%	0.778	S	S	*	*			trans	-93.7	93	171.4	-41.7	0	0	0	0	109.3	S49	T47-S49 PolarHBondContact O-N 3.19Å
48	V	27.1	Very low	25.6	Very low	129 Å²	129	143.4 Å²	143.4	78%	0.782	77%	0.77	S	S	*	*			trans	-82.7	105.1	173.6	-179.7	0	0	0	0	108.5	K46	K46-V48 PolarHBondContact O-N 3.15Å
49	S	24.4	Very low	25.9	Very low	109 Å²	109	140.7 Å²	140.7	76%	0.762	77%	0.767	S	S	*	*			trans	-97.9	108.8	176.3	-63.7	0	0	0	0	110.5	T47	T47-S49 PolarHBondContact O-N 3.19Å
50	R	24.6	Very low	26.1	Very low	190 Å²	190	139.9 Å²	139.9	72%	0.717	76%	0.759	S	S	*	*			trans	-92.5	111.1	-178.4	-150.9	176.9	-162.8	159.4	6.2	109.5
51	K	25.5	Very low	26.4	Very low	175 Å²	175	139.5 Å²	139.5	76%	0.761	76%	0.762	S	S	*	*			trans	-102.3	112.2	169.8	-100.1	-179.3	178.3	175.5	0	109.7	F53	K51-F53 HydrophobicContact CB-CE2 3.97Å; K51-F53 HydrophobicContact CD-CE2 4.42Å; K51-F53 HydrophobicContact CD-CZ 4.26Å
52	V	24.3	Very low	26.5	Very low	123 Å²	123	139.4 Å²	139.4	75%	0.745	76%	0.76	S	S	*	*			trans	-90.8	119.1	176.9	-179.1	0	0	0	0	108.1
53	F	27.4	Very low	26.8	Very low	147 Å²	147	135.1 Å²	135.1	65%	0.645	76%	0.756	S	S	*	*			trans	-102.4	140.5	173	-71.7	-81.8	0	0	0	110.9	K51 N55	K51-F53 HydrophobicContact CB-CE2 3.97Å; K51-F53 HydrophobicContact CD-CE2 4.42Å; K51-F53 HydrophobicContact CD-CZ 4.26Å; F53-N55 PolarHBondContact O-N 3.37Å
54	V	33	Very low	27	Very low	142 Å²	142	134.4 Å²	134.4	86%	0.861	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	79.6	179.4	-173.6	0	0	0	0	108.7
55	N	26.9	Very low	27.1	Very low	163 Å²	163	132.7 Å²	132.7	87%	0.872	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	179.3	34.8	151.9	-85.9	-16	0	0	0	111.2	F53 G57	F53-N55 PolarHBondContact O-N 3.37Å; N55-G57 VanDerWaalsContact C-N 3.33Å; N55-G57 PolarHBondContact O-N 3.2Å
56	G	27.4	Very low	27.3	Very low	77 Å²	77	131 Å²	131	79%	0.794	74%	0.739	S	S	*	*	S	Bend	trans	75.6	8.9	164.3	0	0	0	0	0	116.7
57	G	25.1	Very low	27.6	Very low	50 Å²	50	126.7 Å²	126.7	52%	0.515	73%	0.73	S	S	.	*			trans	-86.9	113.6	173.3	0	0	0	0	0	112	N55	N55-G57 VanDerWaalsContact C-N 3.33Å; N55-G57 PolarHBondContact O-N 3.2Å
58	T	24.7	Very low	28.1	Very low	106 Å²	106	123.8 Å²	123.8	65%	0.65	72%	0.715	S	S	*	*			trans	-97.7	117.3	166.9	-1.5	0	0	0	0	108.9
59	T	26.4	Very low	28.5	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	71%	0.711	S	S	*	*			trans	-117.4	116.8	171	-42.2	0	0	0	0	108.7
60	E	26	Very low	29.2	Very low	127 Å²	127	128.4 Å²	128.4	59%	0.593	71%	0.706	S	S	*	*			trans	-89.6	117.9	176.7	-64.5	-175.6	163.7	0	0	109	F62	E60-F62 HydrophobicContact CB-CD2 4.37Å; E60-F62 HydrophobicContact CB-CE2 3.62Å; E60-F62 HydrophobicContact CB-CZ 4Å; E60-F62 WeakPolarHBondContact OE2-CZ 3.43Å
61	V	26.3	Very low	29.8	Very low	139 Å²	139	125.4 Å²	125.4	84%	0.842	70%	0.7	S	S	*	*			trans	-100.3	110.5	177.8	-177.9	0	0	0	0	108.3
62	F	26	Very low	30.5	Very low	167 Å²	167	123.2 Å²	123.2	73%	0.732	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-92.1	119.3	178.2	-63.8	-89	0	0	0	109.9	E60	E60-F62 HydrophobicContact CB-CD2 4.37Å; E60-F62 HydrophobicContact CB-CE2 3.62Å; E60-F62 HydrophobicContact CB-CZ 4Å; E60-F62 WeakPolarHBondContact OE2-CZ 3.43Å
63	S	29.2	Very low	31.2	Very low	120 Å²	120	122.7 Å²	122.7	84%	0.839	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-81.6	124.8	171.9	-176.8	0	0	0	0	109.6
64	A	31	Very low	31.9	Very low	93 Å²	93	119.2 Å²	119.2	77%	0.769	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-71.8	137.7	-174.6	0	0	0	0	0	113.6
65	D	30.5	Very low	32.4	Very low	116 Å²	116	118.9 Å²	118.9	62%	0.62	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-65	140.4	-175.3	-80.6	-32.7	0	0	0	114.6	T67 S68	D65-T67 PolarHBondContact O-N 2.84Å; D65-T67 VanDerWaalsContact O-N 3.16Å; D65-S68 PolarHBondContact O-N 3.46Å
66	E	32.6	Very low	33	Very low	117 Å²	117	119.4 Å²	119.4	55%	0.547	66%	0.655	S	S	.	*	H	α-helix	trans	-63.3	-18.4	-179.2	-167.1	164.2	-177.3	0	0	114.3	S68 R69 K70	E66-S68 VanDerWaalsContact C-N 3.32Å; E66-S68 PolarHBondContact O-N 2.96Å; E66-R69 PolarHBondContact O-N 3Å; E66-K70 PolarHBondContact O-N 3.41Å
67	T	35.7	Very low	33.5	Very low	104 Å²	104	119.5 Å²	119.5	64%	0.638	64%	0.644	S	S	*	*	H	α-helix	trans	-64.9	-32.6	175	41.7	0	0	0	0	112.7	D65 K70 H71	D65-T67 PolarHBondContact O-N 2.84Å; D65-T67 VanDerWaalsContact O-N 3.16Å; T67-K70 PolarHBondContact O-N 3.14Å; T67-H71 PolarHBondContact O-N 3.25Å
68	S	36.1	Very low	34	Very low	78 Å²	78	124.5 Å²	124.5	55%	0.545	66%	0.655	S	S	.	*	H	α-helix	trans	-67.1	-37.5	176	-68.8	0	0	0	0	111.7	D65 E66 K70 H71 E72	D65-S68 PolarHBondContact O-N 3.46Å; E66-S68 VanDerWaalsContact C-N 3.32Å; E66-S68 PolarHBondContact O-N 2.96Å; S68-K70 PolarHBondContact O-N 3.38Å; S68-H71 PolarHBondContact O-N 3Å; S68-E72 PolarHBondContact O-N 3.22Å
69	R	36.2	Very low	34.7	Very low	182 Å²	182	126.4 Å²	126.4	69%	0.687	66%	0.661	S	S	*	*	H	α-helix	trans	-63.9	-38.7	177.1	-83.1	-174.2	-168.6	143.1	4.1	113	E66 H71 E72 L73	E66-R69 PolarHBondContact O-N 3Å; R69-H71 VanDerWaalsContact C-N 3.35Å; R69-E72 PolarHBondContact O-N 3.49Å; R69-L73 WeakPolarHBondContact O-CB 3.41Å; R69-L73 WeakPolarHBondContact O-CG 2.9Å; R69-L73 PolarHBondContact O-N 2.97Å
70	K	38.7	Very low	35.1	Very low	153 Å²	153	127.2 Å²	127.2	67%	0.665	66%	0.66	S	S	*	*	H	α-helix	trans	-66.9	-36.9	-180	-78.2	-175.9	177.1	175.8	0	112.1	E66 T67 S68 S74	E66-K70 PolarHBondContact O-N 3.41Å; T67-K70 PolarHBondContact O-N 3.14Å; S68-K70 PolarHBondContact O-N 3.38Å; K70-S74 WeakPolarHBondContact O-CB 3.26Å; K70-S74 PolarHBondContact O-N 3.13Å; K70-S74 VanDerWaalsContact O-N 3.1Å
71	H	37.3	Very low	35.3	Very low	126 Å²	126	129 Å²	129	58%	0.583	67%	0.668	S	S	*	*	H	α-helix	trans	-69.9	-35.9	177.3	-157.6	-38.2	0	0	0	112.1	T67 S68 R69 K75	T67-H71 PolarHBondContact O-N 3.25Å; S68-H71 PolarHBondContact O-N 3Å; R69-H71 VanDerWaalsContact C-N 3.35Å; H71-K75 PolarHBondContact O-N 3.07Å
72	E	39.2	Very low	35.4	Very low	129 Å²	129	129.5 Å²	129.5	60%	0.603	67%	0.666	S	S	*	*	H	α-helix	trans	-67.1	-44.2	175.8	-145.9	91.4	-144.3	0	0	111.9	S68 R69 S74 K75 R76	S68-E72 PolarHBondContact O-N 3.22Å; R69-E72 PolarHBondContact O-N 3.49Å; E72-S74 PolarHBondContact O-N 3.27Å; E72-K75 PolarHBondContact O-N 3.37Å; E72-R76 PolarHBondContact O-N 3.35Å
73	L	39.9	Very low	35.5	Very low	112 Å²	112	129.6 Å²	129.6	59%	0.586	67%	0.674	S	S	*	*	H	α-helix	trans	-66.2	-37.1	178.9	-74.4	167.6	0	0	0	112.2	R69 R76 S77	R69-L73 WeakPolarHBondContact O-CB 3.41Å; R69-L73 WeakPolarHBondContact O-CG 2.9Å; R69-L73 PolarHBondContact O-N 2.97Å; L73-R76 PolarHBondContact O-N 3.21Å; L73-S77 PolarHBondContact O-N 3.23Å
74	S	42.2	Very low	35.4	Very low	74 Å²	74	131.4 Å²	131.4	52%	0.517	67%	0.674	S	S	.	*	H	α-helix	trans	-64.3	-41.2	175.2	-175.1	0	0	0	0	112.1	K70 E72 R76 S77 M78	K70-S74 WeakPolarHBondContact O-CB 3.26Å; K70-S74 PolarHBondContact O-N 3.13Å; K70-S74 VanDerWaalsContact O-N 3.1Å; E72-S74 PolarHBondContact O-N 3.27Å; S74-R76 PolarHBondContact O-N 2.98Å; S74-S77 PolarHBondContact O-N 3.3Å; S74-M78 WeakPolarHBondContact O-CG 3.34Å; S74-M78 PolarHBondContact O-N 3.4Å
75	K	43.4	Very low	35.1	Very low	136 Å²	136	136.4 Å²	136.4	59%	0.591	68%	0.679	S	S	*	*	H	α-helix	trans	-62.6	-40.2	173	-86.6	-177.3	175.3	176.4	0	112.4	H71 E72 M78 L79	H71-K75 PolarHBondContact O-N 3.07Å; E72-K75 PolarHBondContact O-N 3.37Å; K75-M78 PolarHBondContact O-N 2.88Å; K75-L79 PolarHBondContact O-N 3.46Å
76	R	38.3	Very low	34.7	Very low	173 Å²	173	139.3 Å²	139.3	65%	0.653	69%	0.693	S	S	*	*	H	α-helix	trans	-66	-39.1	176.6	-97.7	-179.2	169.4	168.5	-2.5	113	E72 L73 S74 M78 L79 L80	E72-R76 PolarHBondContact O-N 3.35Å; L73-R76 PolarHBondContact O-N 3.21Å; S74-R76 PolarHBondContact O-N 2.98Å; R76-M78 VanDerWaalsContact C-N 3.31Å; R76-M78 PolarHBondContact O-N 2.94Å; R76-L79 PolarHBondContact O-N 3.16Å; R76-L80 PolarHBondContact O-N 3.32Å
77	S	37.9	Very low	34.1	Very low	79 Å²	79	141.7 Å²	141.7	55%	0.552	71%	0.709	S	S	*	*	H	α-helix	trans	-65.3	-33.7	177.6	-171.4	0	0	0	0	112.7	L73 S74	L73-S77 PolarHBondContact O-N 3.23Å; S74-S77 PolarHBondContact O-N 3.3Å
78	M	37.4	Very low	33.6	Very low	155 Å²	155	143 Å²	143	76%	0.764	72%	0.717	S	S	*	*	H	α-helix	trans	-70.2	-31.9	177.1	-73.1	-97.9	-78.2	0	0	112.6	S74 K75 R76 L80	S74-M78 WeakPolarHBondContact O-CG 3.34Å; S74-M78 PolarHBondContact O-N 3.4Å; K75-M78 PolarHBondContact O-N 2.88Å; R76-M78 VanDerWaalsContact C-N 3.31Å; R76-M78 PolarHBondContact O-N 2.94Å; M78-L80 VanDerWaalsContact C-N 3.35Å
79	L	37.7	Very low	32.9	Very low	146 Å²	146	148.1 Å²	148.1	76%	0.764	73%	0.732	S	S	*	*	H	α-helix	trans	-77.3	-19	-178.6	-74.4	167	0	0	0	113.7	K75 R76	K75-L79 PolarHBondContact O-N 3.46Å; R76-L79 PolarHBondContact O-N 3.16Å
80	L	34.9	Very low	32.2	Very low	146 Å²	146	148.6 Å²	148.6	76%	0.764	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-8.9	-177	-73.7	164.8	0	0	0	114.2	R76 M78 N82	R76-L80 PolarHBondContact O-N 3.32Å; M78-L80 VanDerWaalsContact C-N 3.35Å; L80-N82 PolarHBondContact O-N 2.94Å
81	H	30.3	Very low	31.4	Very low	165 Å²	165	149.2 Å²	149.2	76%	0.764	75%	0.748	S	S	*	*	S	Bend	trans	-92.7	16	-171.1	-124.4	77	0	0	0	115.9
82	N	28	Very low	30.6	Very low	148 Å²	148	152.1 Å²	152.1	79%	0.791	76%	0.761	S	S	*	*			trans	-128.1	30.2	-173.2	-118.5	10.5	0	0	0	116.3	L80	L80-N82 PolarHBondContact O-N 2.94Å
83	N	29.9	Very low	29.8	Very low	169 Å²	169	154.8 Å²	154.8	90%	0.904	77%	0.771	S	S	*	*			trans	-125.1	87	164.4	-83	-26.1	0	0	0	110.6
84	N	26.5	Very low	29.1	Very low	158 Å²	158	154.6 Å²	154.6	85%	0.845	78%	0.779	S	S	*	*			trans	-73.6	135.3	166.6	-98.6	-34.8	0	0	0	110.6
85	K	23.8	Very low	28.3	Very low	199 Å²	199	157.7 Å²	157.7	87%	0.865	80%	0.795	S	S	*	*			trans	69.5	90.2	159.8	-64.6	-178.8	176.1	-179.8	0	118
86	L	23	Very low	27.4	Very low	176 Å²	176	159.4 Å²	159.4	92%	0.921	81%	0.806	S	S	*	*			trans	-144.9	123.9	131	-95.7	166.7	0	0	0	108.5
87	N	20.5	Very low	26.7	Very low	167 Å²	167	156.1 Å²	156.1	89%	0.893	81%	0.809	S	S	*	*			trans	-98.7	101.7	-172.2	-160.5	24.7	0	0	0	107.4
88	V	24.8	Very low	26	Very low	133 Å²	133	160.4 Å²	160.4	81%	0.806	83%	0.826	S	S	*	*			trans	-142.2	136.3	167.9	-177.5	0	0	0	0	108.4
89	Q	20.7	Very low	25.2	Very low	184 Å²	184	157.7 Å²	157.7	86%	0.86	82%	0.818	S	S	*	*			trans	-56.4	144.4	-164.5	-69.8	165.1	-36.2	0	0	114.7	E91	Q89-E91 PolarHBondContact O-N 2.71Å; Q89-E91 VanDerWaalsContact O-N 3.08Å
90	E	21.7	Very low	24.6	Very low	193 Å²	193	157.7 Å²	157.7	90%	0.902	82%	0.817	S	S	*	*			trans	-61.2	96.3	178.3	-64.2	170.4	152.2	0	0	111.4
91	E	21.8	Very low	23.8	Very low	165 Å²	165	158.1 Å²	158.1	77%	0.771	82%	0.815	S	S	*	*			trans	-96.4	121.7	153.9	-76	-165.2	164.9	0	0	108.4	Q89 F93	Q89-E91 PolarHBondContact O-N 2.71Å; Q89-E91 VanDerWaalsContact O-N 3.08Å; E91-F93 VanDerWaalsContact C-N 3.29Å; E91-F93 PolarHBondContact O-N 2.97Å
92	H	21.6	Very low	23.6	Very low	187 Å²	187	156.3 Å²	156.3	87%	0.866	81%	0.81	S	S	*	*			trans	-56.6	86.7	177	-76.9	-87.7	0	0	0	111.1	S94	H92-S94 PolarHBondContact O-N 3.47Å; H92-S94 VanDerWaalsContact O-N 3.13Å
93	F	22.6	Very low	23.3	Very low	185 Å²	185	156.2 Å²	156.2	81%	0.811	81%	0.809	S	S	*	*			trans	-70	105.1	161.9	-90.8	-90	0	0	0	107.7	E91 T95	E91-F93 VanDerWaalsContact C-N 3.29Å; E91-F93 PolarHBondContact O-N 2.97Å; F93-T95 PolarHBondContact O-N 3.41Å
94	S	23.5	Very low	22.9	Very low	109 Å²	109	150.3 Å²	150.3	76%	0.762	79%	0.788	S	S	*	*			trans	-49.7	110.8	158.7	-3.2	0	0	0	0	107.6	H92 E96	H92-S94 PolarHBondContact O-N 3.47Å; H92-S94 VanDerWaalsContact O-N 3.13Å; S94-E96 PolarHBondContact O-N 3.47Å
95	T	25.2	Very low	22.9	Very low	139 Å²	139	149.4 Å²	149.4	85%	0.853	79%	0.793	S	S	*	*			trans	-69.6	75.9	174.3	44.4	0	0	0	0	109.7	F93	F93-T95 PolarHBondContact O-N 3.41Å
96	E	24.6	Very low	23.1	Very low	172 Å²	172	146.6 Å²	146.6	80%	0.804	79%	0.787	S	S	*	*			trans	-126.7	74.3	163.5	-71.7	-173.8	177.8	0	0	107.4	S94 N98	S94-E96 PolarHBondContact O-N 3.47Å; E96-N98 PolarHBondContact O-N 2.64Å
97	S	24.6	Very low	23.4	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	77%	0.765	S	S	*	*			trans	-61.5	127	160.9	-76.7	0	0	0	0	107.9	T99	S97-T99 VanDerWaalsContact CB-OG1 3.29Å; S97-T99 WeakPolarHBondContact CB-OG1 3.45Å; S97-T99 PolarHBondContact O-N 3.3Å
98	N	22.9	Very low	24.2	Very low	170 Å²	170	138.7 Å²	138.7	91%	0.909	75%	0.753	S	S	*	*			trans	-67.3	39.2	167.3	-72	-37.7	0	0	0	112.2	E96 I100	E96-N98 PolarHBondContact O-N 2.64Å; N98-I100 PolarHBondContact O-N 3.09Å
99	T	21.1	Very low	24.8	Very low	98 Å²	98	135.7 Å²	135.7	60%	0.601	73%	0.729	S	S	*	*			trans	-72.2	107.7	173.2	-51.6	0	0	0	0	107.1	S97 E101	S97-T99 VanDerWaalsContact CB-OG1 3.29Å; S97-T99 WeakPolarHBondContact CB-OG1 3.45Å; S97-T99 PolarHBondContact O-N 3.3Å; T99-E101 VanDerWaalsContact C-N 3.3Å; T99-E101 PolarHBondContact O-N 2.77Å
100	I	23.5	Very low	25.6	Very low	145 Å²	145	127.7 Å²	127.7	74%	0.744	69%	0.693	S	S	*	*			trans	-61.5	102.7	156.8	-60.1	174.6	0	0	0	105.2	N98 I102	N98-I100 PolarHBondContact O-N 3.09Å; I100-I102 VanDerWaalsContact C-N 3.31Å; I100-I102 HydrophobicContact CG2-CD1 4.28Å; I100-I102 HydrophobicContact CG2-CG1 3.74Å; I100-I102 PolarHBondContact O-N 3.14Å
101	E	20.1	Very low	26.3	Very low	156 Å²	156	123 Å²	123	73%	0.729	67%	0.671	S	S	*	*			trans	-64.8	93.7	169.3	-71.8	-168	158.1	0	0	108.4	T99 N103	T99-E101 VanDerWaalsContact C-N 3.3Å; T99-E101 PolarHBondContact O-N 2.77Å; E101-N103 PolarHBondContact O-N 3.46Å
102	I	25.2	Very low	27.1	Very low	127 Å²	127	116 Å²	116	65%	0.651	64%	0.639	S	S	*	*			trans	-90.8	58.6	158.6	-46.6	-175.3	0	0	0	107	I100 G104	I100-I102 VanDerWaalsContact C-N 3.31Å; I100-I102 HydrophobicContact CG2-CD1 4.28Å; I100-I102 HydrophobicContact CG2-CG1 3.74Å; I100-I102 PolarHBondContact O-N 3.14Å; I102-G104 VanDerWaalsContact C-N 3.34Å; I102-G104 PolarHBondContact O-N 3.19Å
103	N	21.7	Very low	27.8	Very low	146 Å²	146	110.1 Å²	110.1	78%	0.781	61%	0.614	S	S	*	*			trans	-89.6	80.2	164.3	-85.3	-27.2	0	0	0	107.5	E101	E101-N103 PolarHBondContact O-N 3.46Å
104	G	22.5	Very low	28.5	Very low	44 Å²	44	102.5 Å²	102.5	45%	0.454	58%	0.58	S	S	.	*	S	Bend	trans	-159.6	121.1	172.5	0	0	0	0	0	106.8	I102 D106	I102-G104 VanDerWaalsContact C-N 3.34Å; I102-G104 PolarHBondContact O-N 3.19Å; G104-D106 PolarHBondContact O-N 2.74Å
105	C	26.4	Very low	28.8	Very low	140 Å²	140	102.8 Å²	102.8	95%	0.946	57%	0.565	S	S	*	*			trans	-60.7	85.8	174	-161.8	0	0	0	0	108
106	D	26.4	Very low	29	Very low	139 Å²	139	102.6 Å²	102.6	74%	0.743	56%	0.559	S	S	*	*			trans	-148.5	139.6	-178.7	-107.6	-30	0	0	0	113.2	G104 S108	G104-D106 PolarHBondContact O-N 2.74Å; D106-S108 PolarHBondContact O-N 2.94Å
107	D	30.5	Very low	29.4	Very low	85 Å²	85	98.5 Å²	98.5	46%	0.455	54%	0.542	S	S	.	.			trans	-64.8	41	-165.9	-79.4	-42.5	0	0	0	115.5	F109 N110	D107-F109 VanDerWaalsContact C-N 3.33Å; D107-F109 PolarHBondContact O-N 3.48Å; D107-N110 HydrophobicContact CB-CB 4.09Å; D107-N110 VanDerWaalsContact CB-ND2 3.35Å; D107-N110 WeakPolarHBondContact CB-ND2 3.44Å; D107-N110 WeakPolarHBondContact O-CA 3.42Å; D107-N110 VanDerWaalsContact O-CB 3.24Å; D107-N110 WeakPolarHBondContact O-CB 3.38Å; D107-N110 PolarHBondContact O-N 3.39Å; D107-N110 PolarHBondContact OD1-ND2 2.9Å
108	S	36.8	Very low	29.3	Very low	93 Å²	93	100.6 Å²	100.6	65%	0.65	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-63.6	-30.8	-171.8	62.7	0	0	0	0	114.7	D106 N110	D106-S108 PolarHBondContact O-N 2.94Å; S108-N110 PolarHBondContact O-N 3.14Å
109	F	37.4	Very low	29.4	Very low	70 Å²	70	95.3 Å²	95.3	31%	0.307	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-73.8	-13.6	173.6	-128.1	-85.5	0	0	0	112.5	D107 A396 I423	D107-F109 VanDerWaalsContact C-N 3.33Å; D107-F109 PolarHBondContact O-N 3.48Å; F109-A396 HydrophobicContact CD1-CB 3.65Å; F109-A396 HydrophobicContact CE1-CB 4.18Å; F109-I423 HydrophobicContact CE1-CG2 4.45Å; F109-I423 HydrophobicContact CE2-CG1 4.39Å; F109-I423 HydrophobicContact CE2-CG2 4.18Å; F109-I423 HydrophobicContact CZ-CB 4.33Å; F109-I423 HydrophobicContact CZ-CG1 3.75Å; F109-I423 HydrophobicContact CZ-CG2 3.62Å
110	N	37.6	Very low	29.5	Very low	16 Å²	16	97.5 Å²	97.5	9%	0.086	54%	0.543	C	S	.	.	G	3₁₀ helix	trans	-84.8	-18.3	-168.7	-68.6	-18.6	0	0	0	114.7	D107 S108 R356 A396 C400	D107-N110 HydrophobicContact CB-CB 4.09Å; D107-N110 VanDerWaalsContact CB-ND2 3.35Å; D107-N110 WeakPolarHBondContact CB-ND2 3.44Å; D107-N110 WeakPolarHBondContact O-CA 3.42Å; D107-N110 VanDerWaalsContact O-CB 3.24Å; D107-N110 WeakPolarHBondContact O-CB 3.38Å; D107-N110 PolarHBondContact O-N 3.39Å; D107-N110 PolarHBondContact OD1-ND2 2.9Å; S108-N110 PolarHBondContact O-N 3.14Å; N110-R356 VanDerWaalsContact CB-NH2 3.34Å; N110-R356 VanDerWaalsContact CG-NH2 3.31Å; N110-R356 PolarHBondContact O-NH1 3.39Å; N110-R356 PolarHBondContact O-NH2 3.08Å; N110-R356 PolarHBondContact OD1-NH2 3.3Å; N110-A396 PolarHBondContact OD1-O 3.23Å; N110-C400 WeakPolarHBondContact OD1-CA 3.31Å; N110-C400 WeakPolarHBondContact OD1-CB 3.4Å
111	H	35.7	Very low	29.6	Very low	95 Å²	95	94.5 Å²	94.5	44%	0.44	54%	0.54	S	S	.	.			trans	-141.5	110	-177.3	-161.8	-67.9	0	0	0	109.1	N113 Y353	H111-N113 VanDerWaalsContact C-N 3.25Å; H111-N113 PolarHBondContact O-N 3.34Å; H111-Y353 PolarHBondContact CD2-OH 3.32Å
112	V	39.9	Very low	29.7	Very low	18 Å²	18	97.3 Å²	97.3	11%	0.109	55%	0.55	C	S	.	*			trans	-74.8	90.1	168.3	-176.8	0	0	0	0	106.7	F114 T345 F348 N349 Y446	V112-F114 HydrophobicContact CG1-CD1 3.87Å; V112-F114 HydrophobicContact CG1-CD2 4.11Å; V112-F114 HydrophobicContact CG1-CE1 3.32Å; V112-F114 HydrophobicContact CG1-CE2 3.65Å; V112-F114 HydrophobicContact CG1-CG 4.21Å; V112-F114 HydrophobicContact CG1-CZ 3.2Å; V112-T345 HydrophobicContact CB-CG2 4.05Å; V112-T345 HydrophobicContact CG1-CG2 3.67Å; V112-F348 HydrophobicContact CB-CD1 4.39Å; V112-F348 HydrophobicContact CG2-CD1 3.62Å; V112-F348 HydrophobicContact CG2-CE1 3.35Å; V112-F348 HydrophobicContact CG2-CZ 4.16Å; V112-N349 WeakPolarHBondContact CB-OD1 3.18Å; V112-N349 PolarHBondContact N-OD1 3.35Å; V112-N349 PolarHBondContact O-ND2 2.91Å; V112-Y446 HydrophobicContact CG2-CE2 4.31Å
113	N	35.4	Very low	29.6	Very low	62 Å²	62	95.5 Å²	95.5	33%	0.332	55%	0.554	S	S	.	*			trans	-107.9	102.5	164.2	-167.8	0.9	0	0	0	107.8	H111 R115	H111-N113 VanDerWaalsContact C-N 3.25Å; H111-N113 PolarHBondContact O-N 3.34Å; N113-R115 PolarHBondContact O-N 2.9Å; N113-R115 PolarHBondContact OD1-N 3.48Å
114	F	36.8	Very low	29.6	Very low	25 Å²	25	96.2 Å²	96.2	11%	0.11	56%	0.558	C	S	.	*	T	Hydrogen-bonded Turn	trans	-68.6	1.7	-178.1	-69.3	-52.5	0	0	0	114.3	V112 W329 Q333 T345 L451	V112-F114 HydrophobicContact CG1-CD1 3.87Å; V112-F114 HydrophobicContact CG1-CD2 4.11Å; V112-F114 HydrophobicContact CG1-CE1 3.32Å; V112-F114 HydrophobicContact CG1-CE2 3.65Å; V112-F114 HydrophobicContact CG1-CG 4.21Å; V112-F114 HydrophobicContact CG1-CZ 3.2Å; F114-W329 HydrophobicContact CB-CH2 4.45Å; F114-W329 HydrophobicContact CB-CZ2 3.32Å; F114-W329 HydrophobicContact CD2-CZ2 4.16Å; F114-W329 HydrophobicContact CG-CZ2 4.19Å; F114-W329 AromaticContact CG-NE1 3.89Å; F114-Q333 PolarHBondContact O-NE2 3.45Å; F114-Q333 PolarHBondContact O-OE1 2.8Å; F114-T345 HydrophobicContact CD2-CG2 3.94Å; F114-T345 HydrophobicContact CE2-CG2 3.44Å; F114-T345 VanDerWaalsContact CE2-CG2 3.44Å; F114-T345 VanDerWaalsContact CE2-OG1 3.31Å; F114-T345 WeakPolarHBondContact CE2-OG1 3.24Å; F114-T345 HydrophobicContact CZ-CG2 4.18Å; F114-L451 HydrophobicContact CD1-CD1 4.33Å; F114-L451 HydrophobicContact CD2-CD1 3.93Å; F114-L451 HydrophobicContact CE1-CD1 4.04Å; F114-L451 HydrophobicContact CE2-CD1 3.53Å; F114-L451 HydrophobicContact CG-CD1 4.31Å; F114-L451 HydrophobicContact CZ-CD1 3.62Å
115	R	30.2	Very low	29.7	Very low	116 Å²	116	99.8 Å²	99.8	44%	0.438	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	-25.4	176.7	-75.5	-174.6	160.3	118.8	2.9	114.7	N113 L117 E335	N113-R115 PolarHBondContact O-N 2.9Å; N113-R115 PolarHBondContact OD1-N 3.48Å; R115-L117 PolarHBondContact O-N 2.89Å; R115-L117 VanDerWaalsContact O-N 3.09Å; R115-E335 IonicContact CZ-OE1 3.36Å; R115-E335 IonicContact NH1-OE1 2.66Å; R115-E335 PolarHBondContact NH1-OE1 3.39Å; R115-E335 IonicContact NH2-OE1 2.69Å
116	D	30.9	Very low	29.5	Very low	135 Å²	135	102 Å²	102	72%	0.722	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	17.3	-167.2	-69.1	-24.9	0	0	0	115.1	N118	D116-N118 VanDerWaalsContact C-N 3.32Å; D116-N118 PolarHBondContact O-N 3.3Å
117	L	31	Very low	29.3	Very low	86 Å²	86	103.2 Å²	103.2	45%	0.45	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.4	3.3	178.5	-69.8	170.1	0	0	0	114.5	R115 G119	R115-L117 PolarHBondContact O-N 2.89Å; R115-L117 VanDerWaalsContact O-N 3.09Å; L117-G119 VanDerWaalsContact C-N 3.26Å; L117-G119 PolarHBondContact O-N 3.04Å
118	N	23.8	Very low	28.8	Very low	147 Å²	147	111 Å²	111	79%	0.786	59%	0.593	S	S	*	*			trans	-85.9	33	-179.1	-88.1	-13.4	0	0	0	115	D116 T120	D116-N118 VanDerWaalsContact C-N 3.32Å; D116-N118 PolarHBondContact O-N 3.3Å; N118-T120 PolarHBondContact O-N 3.25Å
119	G	24.2	Very low	28.2	Very low	58 Å²	58	115.7 Å²	115.7	60%	0.598	60%	0.602	S	S	*	*	S	Bend	trans	-84.7	94.8	171.2	0	0	0	0	0	112.4	L117	L117-G119 VanDerWaalsContact C-N 3.26Å; L117-G119 PolarHBondContact O-N 3.04Å
120	T	24.1	Very low	27.7	Very low	144 Å²	144	119 Å²	119	88%	0.883	63%	0.628	S	S	*	*			trans	52.5	67.4	154.9	52.8	0	0	0	0	118.1	N118	N118-T120 PolarHBondContact O-N 3.25Å
121	A	25.7	Very low	27.1	Very low	82 Å²	82	126.3 Å²	126.3	68%	0.678	67%	0.667	S	S	*	*			trans	-104	74.6	162.8	0	0	0	0	0	111	V459	A121-V459 HydrophobicContact CB-CG1 4.29Å
122	K	21.2	Very low	26.7	Very low	216 Å²	216	125 Å²	125	94%	0.939	68%	0.679	S	S	*	*			trans	-123.5	68.9	158.4	-77.2	-171.4	179.1	179.8	0	107.9
123	A	24.3	Very low	26.1	Very low	89 Å²	89	131.2 Å²	131.2	74%	0.736	72%	0.718	S	S	*	*			trans	-108.5	120	172.7	0	0	0	0	0	108.9	V125	A123-V125 PolarHBondContact O-N 3.46Å
124	N	21.3	Very low	25.7	Very low	161 Å²	161	133.9 Å²	133.9	86%	0.861	74%	0.741	S	S	*	*			trans	-58.5	119.4	-177.7	-77.8	-35.9	0	0	0	111.5	H126	N124-H126 PolarHBondContact O-N 2.89Å
125	V	23.8	Very low	25.3	Very low	118 Å²	118	138.3 Å²	138.3	72%	0.715	78%	0.775	S	S	*	*			trans	-87.7	100.1	174.7	178.8	0	0	0	0	108.8	A123 M127	A123-V125 PolarHBondContact O-N 3.46Å; V125-M127 HydrophobicContact CG1-CE 4.44Å
126	H	22.2	Very low	25.2	Very low	186 Å²	186	137.8 Å²	137.8	86%	0.861	80%	0.796	S	S	*	*			trans	-100.6	113.8	161.6	-93.5	-55.5	0	0	0	109.9	N124	N124-H126 PolarHBondContact O-N 2.89Å
127	M	22.5	Very low	25.1	Very low	166 Å²	166	134.9 Å²	134.9	82%	0.818	80%	0.797	S	S	*	*			trans	-65.8	126.6	175.6	-73.1	-78.1	179.7	0	0	111	V125	V125-M127 HydrophobicContact CG1-CE 4.44Å
128	R	21	Very low	25	Very low	248 Å²	248	137.6 Å²	137.6	94%	0.936	81%	0.812	S	S	*	*			trans	-135.6	127.9	159.7	-127.2	178	-176	170.6	0.5	110.2
129	K	23.9	Very low	25.2	Very low	191 Å²	191	139.9 Å²	139.9	83%	0.83	82%	0.815	S	S	*	*			trans	-78.4	136.4	178.6	-63.8	173.8	173.7	-178.7	0	110
130	T	26.6	Very low	25.2	Very low	140 Å²	140	143.1 Å²	143.1	86%	0.859	82%	0.823	S	S	*	*			trans	-152.6	144.3	155.8	45.9	0	0	0	0	111.4
131	D	24.8	Very low	25.6	Very low	169 Å²	169	142.3 Å²	142.3	90%	0.904	81%	0.805	S	S	*	*			trans	-72.2	163.6	-167.7	-64.8	-54.5	0	0	0	115.9
132	G	26.4	Very low	25.8	Very low	68 Å²	68	144.2 Å²	144.2	70%	0.701	81%	0.81	S	S	*	*			trans	-76	163.4	-168.1	0	0	0	0	0	117.4
133	T	28.8	Very low	26.1	Very low	149 Å²	149	141.6 Å²	141.6	91%	0.914	80%	0.801	S	S	*	*			trans	-160.3	149.3	140.5	-6.2	0	0	0	0	109.6
134	S	26	Very low	26.2	Very low	117 Å²	117	146.7 Å²	146.7	82%	0.818	81%	0.807	S	S	*	*			trans	-71.9	136.5	-163.8	59.4	0	0	0	0	115.2
135	S	28.4	Very low	26.4	Very low	118 Å²	118	147.1 Å²	147.1	83%	0.825	81%	0.808	S	S	*	*			trans	-154.2	143.3	140.1	62.4	0	0	0	0	110.1
136	A	28	Very low	26.5	Very low	106 Å²	106	146.3 Å²	146.3	88%	0.876	81%	0.814	S	S	*	*			trans	-67.4	144.9	-168.6	0	0	0	0	0	113.9
137	G	28.8	Very low	26.8	Very low	73 Å²	73	144.4 Å²	144.4	75%	0.753	81%	0.809	S	S	*	*			trans	90.3	59.6	155	0	0	0	0	0	117.2
138	L	28.8	Very low	27	Very low	144 Å²	144	143 Å²	143	75%	0.754	81%	0.81	S	S	*	*	S	Bend	trans	-157.7	131.3	151	-137.5	78.8	0	0	0	108.2	T140	L138-T140 PolarHBondContact O-N 3.49Å
139	F	29.7	Very low	27.1	Very low	195 Å²	195	140.2 Å²	140.2	86%	0.855	81%	0.808	S	S	*	*			trans	-53.6	112.4	177.7	-107	-95.9	0	0	0	110.4
140	T	23.3	Very low	27.3	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	79%	0.786	S	S	*	*			trans	-120.9	139.2	169.8	43.4	0	0	0	0	109.7	L138	L138-T140 PolarHBondContact O-N 3.49Å
141	Y	32.5	Very low	27.4	Very low	128 Å²	128	129.6 Å²	129.6	50%	0.502	77%	0.774	S	S	.	*			trans	-79.4	134.3	-170.3	-66.6	-79.3	0	0	0	112	Q483	Y141-Q483 HydrophobicContact CD1-CG 3.89Å; Y141-Q483 HydrophobicContact CE1-CB 4.34Å; Y141-Q483 HydrophobicContact CE1-CG 3.59Å
142	P	28.9	Very low	27.6	Very low	122 Å²	122	125.3 Å²	125.3	79%	0.792	75%	0.753	S	S	*	*			trans	-72.3	138.1	174.1	-13.7	27.7	0	0	0	112.6
143	E	27.8	Very low	27.7	Very low	161 Å²	161	132.3 Å²	132.3	75%	0.752	76%	0.758	S	S	*	*			trans	-90.9	115.5	179	-141	179	177.6	0	0	110.3
144	K	27.1	Very low	27.7	Very low	196 Å²	196	133.4 Å²	133.4	85%	0.852	75%	0.753	S	S	*	*			trans	62.5	112	165.3	-70.7	178.5	174.6	179.3	0	118.8
145	L	26.3	Very low	28	Very low	169 Å²	169	133.3 Å²	133.3	89%	0.885	75%	0.753	S	S	*	*			trans	-112.9	131.5	153.2	-84.6	157.3	0	0	0	109.1
146	A	25.7	Very low	28.7	Very low	102 Å²	102	136.4 Å²	136.4	84%	0.843	75%	0.754	S	S	*	*			trans	-82.8	129.4	-179.9	0	0	0	0	0	110.2
147	L	27	Very low	29.5	Very low	145 Å²	145	138 Å²	138	76%	0.759	75%	0.748	S	S	*	*			trans	-136.6	100	-178.5	-72.3	169.1	0	0	0	109.8
148	T	26.7	Very low	30.5	Very low	136 Å²	136	139 Å²	139	83%	0.834	73%	0.73	S	S	*	*			trans	-158.7	112.5	154.7	45.2	0	0	0	0	109.1
149	E	24	Very low	32	Very low	191 Å²	191	138.3 Å²	138.3	89%	0.893	73%	0.727	S	S	*	*			trans	-177.4	137.7	141	-100	163.2	-157.4	0	0	108.6
150	G	28.4	Very low	33.8	Very low	35 Å²	35	130.1 Å²	130.1	36%	0.361	69%	0.692	S	S	.	*			trans	96.7	84	166.2	0	0	0	0	0	118.2
151	A	28.5	Very low	35.9	Very low	73 Å²	73	128.5 Å²	128.5	60%	0.603	68%	0.679	S	S	*	*			trans	-133.5	99.5	160.7	0	0	0	0	0	109.3
152	V	28.8	Very low	37.5	Very low	79 Å²	79	127.2 Å²	127.2	48%	0.479	68%	0.676	S	S	.	*			trans	-94.9	145.5	176.8	169.5	0	0	0	0	111.2	E164	V152-E164 VanDerWaalsContact CB-CD 3.46Å; V152-E164 HydrophobicContact CB-CG 3.77Å; V152-E164 WeakPolarHBondContact CB-OE1 3.48Å; V152-E164 HydrophobicContact CG2-CG 4.17Å; V152-E164 WeakPolarHBondContact CG2-OE1 3.35Å
153	R	27.9	Very low	39.1	Very low	214 Å²	214	122.2 Å²	122.2	81%	0.808	64%	0.644	S	S	*	*			trans	-99.6	128.5	-174.5	-66.7	173.4	171.3	-170.4	-4.6	110.2
154	E	29.8	Very low	40.4	Very low	172 Å²	172	120 Å²	120	80%	0.804	63%	0.633	S	S	*	*			trans	-144.9	134.3	162.4	-75.5	-163.9	163.8	0	0	115.4
155	S	31.6	Very low	41.6	Very low	116 Å²	116	114.6 Å²	114.6	81%	0.811	61%	0.614	S	S	*	*			trans	85.3	136.6	152.7	-146.9	0	0	0	0	122.5	N157	S155-N157 PolarHBondContact O-N 3.26Å
156	E	42.2	Very low	42.9	Very low	183 Å²	183	115 Å²	115	86%	0.855	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	104.8	-158.6	-63.4	171.8	159.8	0	0	113.9
157	N	44.8	Very low	44.1	Very low	139 Å²	139	114.9 Å²	114.9	74%	0.743	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	168.2	-1.3	130.8	-98.6	-41	0	0	0	113.8	S155	S155-N157 PolarHBondContact O-N 3.26Å
158	Y	51.6	Low	45.4	Very low	95 Å²	95	117.1 Å²	117.1	37%	0.373	61%	0.605	S	S	.	*	S	Bend	trans	-147.9	119	172.2	-68	-68.7	0	0	0	106.1	V160 A178 F219	Y158-V160 PolarHBondContact O-N 3.09Å; Y158-A178 HydrophobicContact CD1-CB 4.21Å; Y158-A178 HydrophobicContact CG-CB 4.35Å; Y158-F219 AromaticContact CE1-CE1 3.93Å; Y158-F219 HydrophobicContact CE1-CE1 3.93Å; Y158-F219 AromaticContact CE1-CZ 3.96Å; Y158-F219 HydrophobicContact CE1-CZ 3.96Å; Y158-F219 AromaticContact CZ-CE1 3.87Å; Y158-F219 WeakPolarHBondContact OH-CE1 3.43Å
159	D	59.5	Low	46.7	Very low	129 Å²	129	114 Å²	114	69%	0.69	59%	0.588	S	S	*	*			trans	-64.6	71.9	176.8	-70.7	-38.8	0	0	0	110.1	G174	D159-G174 WeakPolarHBondContact O-CA 3.24Å
160	V	66.5	Low	48.8	Very low	22 Å²	22	105.9 Å²	105.9	13%	0.133	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-98	114.4	171.5	-175.9	0	0	0	0	106.4	Y158 K162 I171 G173 A178	Y158-V160 PolarHBondContact O-N 3.09Å; V160-K162 PolarHBondContact O-N 3.42Å; V160-I171 HydrophobicContact CG1-CB 4.14Å; V160-I171 HydrophobicContact CG1-CD1 3.69Å; V160-I171 HydrophobicContact CG1-CG1 3.63Å; V160-I171 HydrophobicContact CG1-CG2 3.45Å; V160-I171 VanDerWaalsContact CG1-CG2 3.45Å; V160-G173 CarbonylContact C-O 3.58Å; V160-G173 WeakPolarHBondContact CA-O 3.41Å; V160-A178 HydrophobicContact CG2-CB 3.9Å
161	L	68.6	Low	50.9	Low	91 Å²	91	105 Å²	105	48%	0.476	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	119.7	174.1	-61	173.2	0	0	0	108.5	I171 R172 G173	L161-I171 CarbonylContact O-C 3.37Å; L161-I171 WeakPolarHBondContact O-CA 3.36Å; L161-R172 HydrophobicContact CB-CB 4.36Å; L161-R172 PolarHBondContact O-N 3.04Å; L161-G173 PolarHBondContact N-O 3.11Å
162	K	66	Low	53	Low	102 Å²	102	107.9 Å²	107.9	44%	0.443	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	148.2	172	-67.6	-177.1	178.7	179.8	0	111.2	V160 S170	V160-K162 PolarHBondContact O-N 3.42Å; K162-S170 CarbonylContact C-O 3.58Å; K162-S170 WeakPolarHBondContact CA-O 3.12Å
163	S	62	Low	55.4	Low	17 Å²	17	105.1 Å²	105.1	12%	0.119	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-78.6	147.9	166.5	60.5	0	0	0	0	110.4	D165 S170	S163-D165 PolarHBondContact OG-O 3.32Å; S163-D165 VanDerWaalsContact OG-O 3.06Å; S163-S170 PolarHBondContact N-O 3.46Å; S163-S170 PolarHBondContact OG-O 3.01Å
164	E	55.5	Low	58	Low	113 Å²	113	96.4 Å²	96.4	53%	0.528	50%	0.499	S	S	.	.	S	Bend	trans	-79.4	-30.2	168	-65.7	-173.8	118.8	0	0	111.6	V152	V152-E164 VanDerWaalsContact CB-CD 3.46Å; V152-E164 HydrophobicContact CB-CG 3.77Å; V152-E164 WeakPolarHBondContact CB-OE1 3.48Å; V152-E164 HydrophobicContact CG2-CG 4.17Å; V152-E164 WeakPolarHBondContact CG2-OE1 3.35Å
165	D	52.8	Low	60.6	Low	83 Å²	83	91.8 Å²	91.8	44%	0.444	48%	0.482	S	S	.	.	S	Bend	trans	-73.8	136.5	179.9	-60.6	-40.9	0	0	0	110.3	S163 E167	S163-D165 PolarHBondContact OG-O 3.32Å; S163-D165 VanDerWaalsContact OG-O 3.06Å; D165-E167 HydrophobicContact CB-CG 4.01Å; D165-E167 PolarHBondContact O-N 3.04Å
166	N	53.2	Low	63.1	Low	177 Å²	177	88.3 Å²	88.3	95%	0.947	46%	0.457	S	S	*	.			trans	-65.7	49.2	170	-77.3	-28.4	0	0	0	111.8
167	E	50.2	Low	65.1	Low	101 Å²	101	82.6 Å²	82.6	47%	0.472	43%	0.432	S	S	.	.			trans	-74.1	156.3	168.5	-67.5	-175	145.5	0	0	110	D165 C169 R172	D165-E167 HydrophobicContact CB-CG 4.01Å; D165-E167 PolarHBondContact O-N 3.04Å; E167-C169 PolarHBondContact O-N 3.45Å; E167-R172 IonicContact OE1-NH2 2.8Å; E167-R172 IonicContact OE2-CZ 3.61Å; E167-R172 IonicContact OE2-NH2 3.52Å; E167-R172 PolarHBondContact OE2-NH2 3.22Å
168	E	54.8	Low	66.8	Low	191 Å²	191	76 Å²	76	89%	0.893	40%	0.396	S	S	*	.	S	Bend	trans	-56.9	-14.5	-176.2	-67.1	179.9	162.8	0	0	114.8
169	C	54.6	Low	68.3	Low	70 Å²	70	72.5 Å²	72.5	47%	0.473	38%	0.384	S	S	.	.			trans	-135.3	107.4	176.7	-178.9	0	0	0	0	110.9	E167 I171	E167-C169 PolarHBondContact O-N 3.45Å; C169-I171 VanDerWaalsContact C-N 3.29Å; C169-I171 PolarHBondContact O-N 3.24Å; C169-I171 PolarHBondContact SG-O 3.2Å
170	S	66.6	Low	69.4	Low	22 Å²	22	66.3 Å²	66.3	15%	0.154	35%	0.351	C	S	.	.			trans	-67.3	-25.4	-177.3	76.5	0	0	0	0	113.8	K162 S163 E191	K162-S170 CarbonylContact C-O 3.58Å; K162-S170 WeakPolarHBondContact CA-O 3.12Å; S163-S170 PolarHBondContact N-O 3.46Å; S163-S170 PolarHBondContact OG-O 3.01Å; S170-E191 WeakPolarHBondContact CB-OE1 3.38Å; S170-E191 PolarHBondContact OG-OE1 3.06Å
171	I	73.8	Confident	70.1	Confident	16 Å²	16	65.3 Å²	65.3	8%	0.082	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	118.7	-175	-64.6	173.4	0	0	0	110.5	V160 L161 C169 L179 Y182 F195	V160-I171 HydrophobicContact CG1-CB 4.14Å; V160-I171 HydrophobicContact CG1-CD1 3.69Å; V160-I171 HydrophobicContact CG1-CG1 3.63Å; V160-I171 HydrophobicContact CG1-CG2 3.45Å; V160-I171 VanDerWaalsContact CG1-CG2 3.45Å; L161-I171 CarbonylContact O-C 3.37Å; L161-I171 WeakPolarHBondContact O-CA 3.36Å; C169-I171 VanDerWaalsContact C-N 3.29Å; C169-I171 PolarHBondContact O-N 3.24Å; C169-I171 PolarHBondContact SG-O 3.2Å; I171-L179 HydrophobicContact CG2-CD2 4.21Å; I171-Y182 HydrophobicContact CD1-CD1 3.31Å; I171-Y182 HydrophobicContact CD1-CD2 3.82Å; I171-Y182 HydrophobicContact CD1-CE1 3.1Å; I171-Y182 HydrophobicContact CD1-CE2 3.62Å; I171-Y182 HydrophobicContact CD1-CG 3.67Å; I171-Y182 HydrophobicContact CG1-CE1 4.43Å; I171-F195 HydrophobicContact CB-CD2 3.98Å; I171-F195 HydrophobicContact CB-CE2 3.93Å; I171-F195 HydrophobicContact CD1-CD2 3.41Å; I171-F195 VanDerWaalsContact CD1-CD2 3.41Å; I171-F195 HydrophobicContact CD1-CE2 3.46Å; I171-F195 VanDerWaalsContact CD1-CE2 3.46Å; I171-F195 HydrophobicContact CD1-CG 3.96Å; I171-F195 HydrophobicContact CD1-CZ 4.06Å; I171-F195 HydrophobicContact CG1-CD2 4.2Å; I171-F195 HydrophobicContact CG1-CE2 4.28Å; I171-F195 HydrophobicContact CG2-CD2 4.31Å; I171-F195 HydrophobicContact CG2-CE2 3.73Å
172	R	73.1	Confident	70.6	Confident	134 Å²	134	62.5 Å²	62.5	51%	0.506	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-21.4	175.8	-68.6	-153.9	165.8	-176.9	0.5	114.2	L161 E167	L161-R172 HydrophobicContact CB-CB 4.36Å; L161-R172 PolarHBondContact O-N 3.04Å; E167-R172 IonicContact OE1-NH2 2.8Å; E167-R172 IonicContact OE2-CZ 3.61Å; E167-R172 IonicContact OE2-NH2 3.52Å; E167-R172 PolarHBondContact OE2-NH2 3.22Å
173	G	77.5	Confident	71.2	Confident	21 Å²	21	58 Å²	58	22%	0.216	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.4	179	177.3	0	0	0	0	0	113	V160 L161	V160-G173 CarbonylContact C-O 3.58Å; V160-G173 WeakPolarHBondContact CA-O 3.41Å; L161-G173 PolarHBondContact N-O 3.11Å
174	G	82.8	Confident	71.8	Confident	31 Å²	31	58.7 Å²	58.7	32%	0.32	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	176.5	173.1	175.8	0	0	0	0	0	111.7	D159	D159-G174 WeakPolarHBondContact O-CA 3.24Å
175	T	84.6	Confident	72.5	Confident	74 Å²	74	56 Å²	56	45%	0.454	31%	0.305	S	S	.	.			trans	-64.4	157.4	171.7	64.5	0	0	0	0	110.5	D177 A178 L179	T175-D177 VanDerWaalsContact C-N 3.29Å; T175-D177 PolarHBondContact O-N 2.76Å; T175-A178 WeakPolarHBondContact O-CA 3.28Å; T175-A178 WeakPolarHBondContact O-CB 3.11Å; T175-A178 PolarHBondContact O-N 3.42Å; T175-A178 WeakPolarHBondContact OG1-CB 3.36Å; T175-A178 PolarHBondContact OG1-N 3.4Å; T175-L179 WeakPolarHBondContact O-CG 3.34Å; T175-L179 PolarHBondContact O-N 3.08Å
176	V	83.7	Confident	73.2	Confident	44 Å²	44	52.7 Å²	52.7	27%	0.267	29%	0.288	S	S	.	.	H	α-helix	trans	-57.5	-43.9	-177.5	177.2	0	0	0	0	111.6	A178 L179 I180 F206 I207 K215	V176-A178 VanDerWaalsContact C-N 3.33Å; V176-A178 PolarHBondContact O-N 2.91Å; V176-L179 PolarHBondContact O-N 3.31Å; V176-I180 HydrophobicContact CG1-CD1 3.76Å; V176-I180 HydrophobicContact CG1-CG1 4.47Å; V176-I180 WeakPolarHBondContact O-CB 3.38Å; V176-I180 WeakPolarHBondContact O-CD1 3.32Å; V176-I180 WeakPolarHBondContact O-CG1 3.23Å; V176-I180 PolarHBondContact O-N 3.4Å; V176-F206 HydrophobicContact CG2-CD2 4.23Å; V176-I207 HydrophobicContact CG1-CB 4.16Å; V176-I207 HydrophobicContact CG1-CD1 3.49Å; V176-I207 VanDerWaalsContact CG1-CD1 3.49Å; V176-I207 HydrophobicContact CG1-CG1 4.33Å; V176-I207 HydrophobicContact CG1-CG2 4.42Å; V176-K215 HydrophobicContact CG1-CD 4.44Å
177	D	84.3	Confident	73.8	Confident	62 Å²	62	48.5 Å²	48.5	33%	0.332	27%	0.265	S	S	.	.	H	α-helix	trans	-67.1	-33	176.6	-67.5	-61.4	0	0	0	112.4	T175 G181 K215 F219	T175-D177 VanDerWaalsContact C-N 3.29Å; T175-D177 PolarHBondContact O-N 2.76Å; D177-G181 PolarHBondContact O-N 3.42Å; D177-K215 WeakPolarHBondContact OD1-CD 3.33Å; D177-K215 IonicContact OD1-NZ 2.75Å; D177-K215 PolarHBondContact OD1-NZ 3.15Å; D177-K215 IonicContact OD2-NZ 3.16Å; D177-K215 PolarHBondContact OD2-NZ 2.86Å; D177-F219 HydrophobicContact CB-CZ 4.46Å; D177-F219 WeakPolarHBondContact O-CZ 3.5Å
178	A	80.6	Confident	74.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67	-44	174.2	0	0	0	0	0	113.1	Y158 V160 T175 V176 G181 Y182	Y158-A178 HydrophobicContact CD1-CB 4.21Å; Y158-A178 HydrophobicContact CG-CB 4.35Å; V160-A178 HydrophobicContact CG2-CB 3.9Å; T175-A178 WeakPolarHBondContact O-CA 3.28Å; T175-A178 WeakPolarHBondContact O-CB 3.11Å; T175-A178 PolarHBondContact O-N 3.42Å; T175-A178 WeakPolarHBondContact OG1-CB 3.36Å; T175-A178 PolarHBondContact OG1-N 3.4Å; V176-A178 VanDerWaalsContact C-N 3.33Å; V176-A178 PolarHBondContact O-N 2.91Å; A178-G181 PolarHBondContact O-N 3.45Å; A178-Y182 WeakPolarHBondContact O-CB 3.16Å; A178-Y182 PolarHBondContact O-N 3.2Å
179	L	84	Confident	75.4	Confident	22 Å²	22	41.8 Å²	41.8	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-66.9	-38.6	177	-63.4	174	0	0	0	111.5	I171 T175 V176 A183 F195 F199	I171-L179 HydrophobicContact CG2-CD2 4.21Å; T175-L179 WeakPolarHBondContact O-CG 3.34Å; T175-L179 PolarHBondContact O-N 3.08Å; V176-L179 PolarHBondContact O-N 3.31Å; L179-A183 VanDerWaalsContact O-CB 3.31Å; L179-A183 WeakPolarHBondContact O-CB 3.33Å; L179-A183 PolarHBondContact O-N 3.16Å; L179-F195 HydrophobicContact CB-CZ 4.28Å; L179-F195 HydrophobicContact CD2-CE2 4.06Å; L179-F195 HydrophobicContact CD2-CZ 3.76Å; L179-F199 HydrophobicContact CB-CD2 3.98Å; L179-F199 HydrophobicContact CB-CE2 3.64Å
180	I	83.2	Confident	76.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.2	-47.8	173.3	-67.4	165.5	0	0	0	110.4	V176 Y182 A183 V184 F199 I207 L212 K215 L216 F219	V176-I180 HydrophobicContact CG1-CD1 3.76Å; V176-I180 HydrophobicContact CG1-CG1 4.47Å; V176-I180 WeakPolarHBondContact O-CB 3.38Å; V176-I180 WeakPolarHBondContact O-CD1 3.32Å; V176-I180 WeakPolarHBondContact O-CG1 3.23Å; V176-I180 PolarHBondContact O-N 3.4Å; I180-Y182 VanDerWaalsContact C-N 3.33Å; I180-Y182 PolarHBondContact O-N 3.43Å; I180-A183 PolarHBondContact O-N 2.8Å; I180-A183 VanDerWaalsContact O-N 3.14Å; I180-V184 HydrophobicContact CG2-CG2 4.41Å; I180-V184 WeakPolarHBondContact O-CG2 3.26Å; I180-V184 PolarHBondContact O-N 3.22Å; I180-F199 HydrophobicContact CG1-CE1 4.33Å; I180-F199 HydrophobicContact CG1-CE2 4.3Å; I180-F199 HydrophobicContact CG1-CZ 3.55Å; I180-I207 HydrophobicContact CD1-CD1 4.18Å; I180-L212 HydrophobicContact CD1-CD1 3.52Å; I180-L212 HydrophobicContact CG1-CD1 3.58Å; I180-K215 HydrophobicContact CD1-CB 3.8Å; I180-K215 HydrophobicContact CD1-CD 3.57Å; I180-K215 HydrophobicContact CD1-CG 4.29Å; I180-L216 HydrophobicContact CG2-CD2 3.74Å; I180-L216 HydrophobicContact CG2-CG 4.3Å; I180-F219 HydrophobicContact CB-CD2 4.49Å; I180-F219 HydrophobicContact CB-CE2 4.09Å; I180-F219 HydrophobicContact CG2-CD2 3.55Å; I180-F219 HydrophobicContact CG2-CE2 3.64Å; I180-F219 HydrophobicContact CG2-CG 4.29Å; I180-F219 HydrophobicContact CG2-CZ 4.41Å
181	G	80	Confident	76.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-53.2	-52.4	176.4	0	0	0	0	0	110.7	D177 A178 A183 V184 T185	D177-G181 PolarHBondContact O-N 3.42Å; A178-G181 PolarHBondContact O-N 3.45Å; G181-A183 PolarHBondContact O-N 3.45Å; G181-V184 PolarHBondContact O-N 3.16Å; G181-V184 VanDerWaalsContact O-N 3.15Å; G181-T185 WeakPolarHBondContact O-CB 3.28Å; G181-T185 WeakPolarHBondContact O-CG2 3.48Å; G181-T185 PolarHBondContact O-N 2.98Å; G181-T185 PolarHBondContact O-OG1 2.69Å
182	Y	79.5	Confident	76.7	Confident	33 Å²	33	47.5 Å²	47.5	13%	0.129	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-40.7	176.6	-172	-82.2	0	0	0	112.5	I171 A178 I180 V184 T185 S186 E191 F195	I171-Y182 HydrophobicContact CD1-CD1 3.31Å; I171-Y182 HydrophobicContact CD1-CD2 3.82Å; I171-Y182 HydrophobicContact CD1-CE1 3.1Å; I171-Y182 HydrophobicContact CD1-CE2 3.62Å; I171-Y182 HydrophobicContact CD1-CG 3.67Å; I171-Y182 HydrophobicContact CG1-CE1 4.43Å; A178-Y182 WeakPolarHBondContact O-CB 3.16Å; A178-Y182 PolarHBondContact O-N 3.2Å; I180-Y182 VanDerWaalsContact C-N 3.33Å; I180-Y182 PolarHBondContact O-N 3.43Å; Y182-V184 PolarHBondContact O-N 3.47Å; Y182-T185 PolarHBondContact O-N 3.19Å; Y182-S186 VanDerWaalsContact CE1-CB 3.46Å; Y182-S186 WeakPolarHBondContact O-CA 3.38Å; Y182-S186 WeakPolarHBondContact O-CB 3.28Å; Y182-S186 PolarHBondContact O-N 2.92Å; Y182-S186 PolarHBondContact O-OG 3.02Å; Y182-E191 PolarHBondContact OH-OE1 3.45Å; Y182-F195 AromaticContact CD1-CD1 3.35Å; Y182-F195 HydrophobicContact CD1-CD1 3.35Å; Y182-F195 HydrophobicContact CD1-CD2 4.3Å; Y182-F195 AromaticContact CD1-CE1 3.44Å; Y182-F195 HydrophobicContact CD1-CE1 3.44Å; Y182-F195 VanDerWaalsContact CD1-CE1 3.44Å; Y182-F195 HydrophobicContact CD1-CE2 4.36Å; Y182-F195 AromaticContact CD1-CG 3.8Å; Y182-F195 HydrophobicContact CD1-CG 3.8Å; Y182-F195 AromaticContact CD1-CZ 3.95Å; Y182-F195 HydrophobicContact CD1-CZ 3.95Å; Y182-F195 HydrophobicContact CE1-CB 4Å; Y182-F195 AromaticContact CE1-CD1 3.66Å; Y182-F195 HydrophobicContact CE1-CD1 3.66Å; Y182-F195 HydrophobicContact CE1-CD2 4.26Å; Y182-F195 HydrophobicContact CE1-CE1 4.19Å; Y182-F195 AromaticContact CE1-CG 3.68Å; Y182-F195 HydrophobicContact CE1-CG 3.68Å; Y182-F195 HydrophobicContact CG-CE1 4.33Å
183	A	79.2	Confident	76.7	Confident	6 Å²	6	46.1 Å²	46.1	5%	0.05	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-31.1	176	0	0	0	0	0	112.7	L179 I180 G181 F195 K196 F199	L179-A183 VanDerWaalsContact O-CB 3.31Å; L179-A183 WeakPolarHBondContact O-CB 3.33Å; L179-A183 PolarHBondContact O-N 3.16Å; I180-A183 PolarHBondContact O-N 2.8Å; I180-A183 VanDerWaalsContact O-N 3.14Å; G181-A183 PolarHBondContact O-N 3.45Å; A183-F195 HydrophobicContact CB-CD1 4.47Å; A183-F195 HydrophobicContact CB-CE1 4Å; A183-K196 VanDerWaalsContact O-CE 3.26Å; A183-K196 WeakPolarHBondContact O-CE 3.45Å; A183-F199 HydrophobicContact CB-CD1 3.97Å; A183-F199 HydrophobicContact CB-CE1 4.34Å; A183-F199 HydrophobicContact CB-CG 4.25Å
184	V	72.9	Confident	76.7	Confident	32 Å²	32	48.7 Å²	48.7	19%	0.194	26%	0.262	C	S	.	.	H	α-helix	trans	-83.4	-41	178.4	174.3	0	0	0	0	111.8	I180 G181 Y182 L216	I180-V184 HydrophobicContact CG2-CG2 4.41Å; I180-V184 WeakPolarHBondContact O-CG2 3.26Å; I180-V184 PolarHBondContact O-N 3.22Å; G181-V184 PolarHBondContact O-N 3.16Å; G181-V184 VanDerWaalsContact O-N 3.15Å; Y182-V184 PolarHBondContact O-N 3.47Å; V184-L216 HydrophobicContact CG2-CD2 3.61Å
185	T	70.9	Confident	76.6	Confident	58 Å²	58	48.2 Å²	48.2	36%	0.356	25%	0.251	S	S	.	.	H	α-helix	trans	-95.9	-21.3	-170.8	61.4	0	0	0	0	114.8	G181 Y182	G181-T185 WeakPolarHBondContact O-CB 3.28Å; G181-T185 WeakPolarHBondContact O-CG2 3.48Å; G181-T185 PolarHBondContact O-N 2.98Å; G181-T185 PolarHBondContact O-OG1 2.69Å; Y182-T185 PolarHBondContact O-N 3.19Å
186	S	68.5	Low	76.4	Confident	12 Å²	12	45.4 Å²	45.4	8%	0.084	23%	0.233	C	C	.	.	S	Bend	trans	-56.2	139.9	-179.3	47.8	0	0	0	0	111.8	Y182 K196	Y182-S186 VanDerWaalsContact CE1-CB 3.46Å; Y182-S186 WeakPolarHBondContact O-CA 3.38Å; Y182-S186 WeakPolarHBondContact O-CB 3.28Å; Y182-S186 PolarHBondContact O-N 2.92Å; Y182-S186 PolarHBondContact O-OG 3.02Å; S186-K196 PolarHBondContact O-NZ 2.98Å; S186-K196 WeakPolarHBondContact OG-CE 3.35Å
187	D	64.7	Low	76	Confident	89 Å²	89	45.9 Å²	45.9	48%	0.476	23%	0.232	S	C	.	.			trans	-62.1	161.1	177.6	-75.5	-45.4	0	0	0	111.4	N189 R235	D187-N189 PolarHBondContact O-N 3.39Å; D187-N189 PolarHBondContact O-OD1 3.41Å; D187-R235 IonicContact OD1-CZ 3.47Å; D187-R235 IonicContact OD1-NE 2.75Å; D187-R235 IonicContact OD1-NH2 3.15Å; D187-R235 PolarHBondContact OD1-NH2 3.24Å
188	N	66.1	Low	75.8	Confident	80 Å²	80	45.3 Å²	45.3	43%	0.428	24%	0.236	S	C	.	.	S	Bend	trans	-83.1	35.9	177.5	-68.7	-22.5	0	0	0	111.5	K196 R235	N188-K196 PolarHBondContact OD1-NZ 2.94Å; N188-R235 PolarHBondContact ND2-O 3.21Å
189	N	73.3	Confident	76	Confident	72 Å²	72	45.7 Å²	45.7	39%	0.385	24%	0.238	S	C	.	.	S	Bend	trans	-75.1	168.4	167.7	63.7	-11.5	0	0	0	109.9	D187 E191 G192 F193	D187-N189 PolarHBondContact O-N 3.39Å; D187-N189 PolarHBondContact O-OD1 3.41Å; N189-E191 VanDerWaalsContact C-N 3.28Å; N189-E191 PolarHBondContact O-N 3.24Å; N189-G192 PolarHBondContact O-N 3.03Å; N189-G192 WeakPolarHBondContact OD1-CA 3.15Å; N189-G192 PolarHBondContact OD1-N 2.85Å; N189-F193 WeakPolarHBondContact O-CB 3.47Å; N189-F193 PolarHBondContact O-N 3.22Å
190	E	72.8	Confident	75.9	Confident	161 Å²	161	45.1 Å²	45.1	75%	0.752	24%	0.235	S	C	*	.	H	α-helix	trans	-56.9	-43.3	-179.2	-173.3	169.5	-169.6	0	0	111.8	F193 L194	E190-F193 PolarHBondContact O-N 2.89Å; E190-L194 HydrophobicContact CG-CD1 4.18Å; E190-L194 WeakPolarHBondContact O-CB 3.42Å; E190-L194 VanDerWaalsContact O-CG 3.29Å; E190-L194 WeakPolarHBondContact O-CG 3.13Å; E190-L194 PolarHBondContact O-N 2.92Å
191	E	73.4	Confident	75.6	Confident	67 Å²	67	46.6 Å²	46.6	31%	0.313	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-48.3	176.6	-171.4	-163.8	144	0	0	113	S170 Y182 N189 F193 L194 F195	S170-E191 WeakPolarHBondContact CB-OE1 3.38Å; S170-E191 PolarHBondContact OG-OE1 3.06Å; Y182-E191 PolarHBondContact OH-OE1 3.45Å; N189-E191 VanDerWaalsContact C-N 3.28Å; N189-E191 PolarHBondContact O-N 3.24Å; E191-F193 VanDerWaalsContact C-N 3.3Å; E191-F193 PolarHBondContact O-N 3.41Å; E191-L194 PolarHBondContact O-N 3.29Å; E191-F195 WeakPolarHBondContact O-CB 3.47Å; E191-F195 PolarHBondContact O-N 3.4Å
192	G	74.9	Confident	75.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.9	-34.1	177.1	0	0	0	0	0	112.1	N189 K196	N189-G192 PolarHBondContact O-N 3.03Å; N189-G192 WeakPolarHBondContact OD1-CA 3.15Å; N189-G192 PolarHBondContact OD1-N 2.85Å; G192-K196 WeakPolarHBondContact O-CB 3.29Å; G192-K196 WeakPolarHBondContact O-CD 3.24Å; G192-K196 WeakPolarHBondContact O-CG 3.37Å; G192-K196 PolarHBondContact O-N 3.11Å
193	F	74.2	Confident	76	Confident	104 Å²	104	48 Å²	48	46%	0.456	26%	0.256	S	S	.	.	H	α-helix	trans	-65.5	-48.7	172.5	-176.5	-90.6	0	0	0	111.6	N189 E190 E191 F195 K196 E197	N189-F193 WeakPolarHBondContact O-CB 3.47Å; N189-F193 PolarHBondContact O-N 3.22Å; E190-F193 PolarHBondContact O-N 2.89Å; E191-F193 VanDerWaalsContact C-N 3.3Å; E191-F193 PolarHBondContact O-N 3.41Å; F193-F195 VanDerWaalsContact C-N 3.34Å; F193-F195 PolarHBondContact O-N 2.9Å; F193-K196 PolarHBondContact O-N 3.42Å; F193-E197 WeakPolarHBondContact CE1-OE2 3.42Å; F193-E197 WeakPolarHBondContact O-CB 3.33Å; F193-E197 PolarHBondContact O-N 3.27Å
194	L	76.7	Confident	76.1	Confident	75 Å²	75	51.7 Å²	51.7	39%	0.393	27%	0.268	S	S	.	.	H	α-helix	trans	-59.7	-43.5	176.7	-75.2	168.9	0	0	0	111.4	E190 E191 E197 A198	E190-L194 HydrophobicContact CG-CD1 4.18Å; E190-L194 WeakPolarHBondContact O-CB 3.42Å; E190-L194 VanDerWaalsContact O-CG 3.29Å; E190-L194 WeakPolarHBondContact O-CG 3.13Å; E190-L194 PolarHBondContact O-N 2.92Å; E191-L194 PolarHBondContact O-N 3.29Å; L194-E197 PolarHBondContact O-N 3.15Å; L194-A198 WeakPolarHBondContact O-CB 3.38Å; L194-A198 PolarHBondContact O-N 3.19Å
195	F	81.5	Confident	76.5	Confident	21 Å²	21	55 Å²	55	9%	0.092	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-46.7	175.5	-179.4	-89.3	0	0	0	111.7	I171 L179 Y182 A183 E191 F193 E197 A198 F199	I171-F195 HydrophobicContact CB-CD2 3.98Å; I171-F195 HydrophobicContact CB-CE2 3.93Å; I171-F195 HydrophobicContact CD1-CD2 3.41Å; I171-F195 VanDerWaalsContact CD1-CD2 3.41Å; I171-F195 HydrophobicContact CD1-CE2 3.46Å; I171-F195 VanDerWaalsContact CD1-CE2 3.46Å; I171-F195 HydrophobicContact CD1-CG 3.96Å; I171-F195 HydrophobicContact CD1-CZ 4.06Å; I171-F195 HydrophobicContact CG1-CD2 4.2Å; I171-F195 HydrophobicContact CG1-CE2 4.28Å; I171-F195 HydrophobicContact CG2-CD2 4.31Å; I171-F195 HydrophobicContact CG2-CE2 3.73Å; L179-F195 HydrophobicContact CB-CZ 4.28Å; L179-F195 HydrophobicContact CD2-CE2 4.06Å; L179-F195 HydrophobicContact CD2-CZ 3.76Å; Y182-F195 AromaticContact CD1-CD1 3.35Å; Y182-F195 HydrophobicContact CD1-CD1 3.35Å; Y182-F195 HydrophobicContact CD1-CD2 4.3Å; Y182-F195 AromaticContact CD1-CE1 3.44Å; Y182-F195 HydrophobicContact CD1-CE1 3.44Å; Y182-F195 VanDerWaalsContact CD1-CE1 3.44Å; Y182-F195 HydrophobicContact CD1-CE2 4.36Å; Y182-F195 AromaticContact CD1-CG 3.8Å; Y182-F195 HydrophobicContact CD1-CG 3.8Å; Y182-F195 AromaticContact CD1-CZ 3.95Å; Y182-F195 HydrophobicContact CD1-CZ 3.95Å; Y182-F195 HydrophobicContact CE1-CB 4Å; Y182-F195 AromaticContact CE1-CD1 3.66Å; Y182-F195 HydrophobicContact CE1-CD1 3.66Å; Y182-F195 HydrophobicContact CE1-CD2 4.26Å; Y182-F195 HydrophobicContact CE1-CE1 4.19Å; Y182-F195 AromaticContact CE1-CG 3.68Å; Y182-F195 HydrophobicContact CE1-CG 3.68Å; Y182-F195 HydrophobicContact CG-CE1 4.33Å; A183-F195 HydrophobicContact CB-CD1 4.47Å; A183-F195 HydrophobicContact CB-CE1 4Å; E191-F195 WeakPolarHBondContact O-CB 3.47Å; E191-F195 PolarHBondContact O-N 3.4Å; F193-F195 VanDerWaalsContact C-N 3.34Å; F193-F195 PolarHBondContact O-N 2.9Å; F195-E197 VanDerWaalsContact C-N 3.28Å; F195-E197 PolarHBondContact O-N 3.48Å; F195-A198 PolarHBondContact O-N 3.11Å; F195-F199 HydrophobicContact CD1-CB 4.41Å; F195-F199 HydrophobicContact CE1-CB 4.09Å; F195-F199 HydrophobicContact CE1-CD2 4.42Å; F195-F199 HydrophobicContact CE1-CG 4.4Å; F195-F199 HydrophobicContact CZ-CB 4.47Å; F195-F199 HydrophobicContact CZ-CD2 4.36Å; F195-F199 WeakPolarHBondContact O-CB 3.43Å; F195-F199 PolarHBondContact O-N 3.49Å
196	K	80	Confident	77.1	Confident	15 Å²	15	56.3 Å²	56.3	7%	0.065	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-42.6	176.2	-73.7	168	-161.4	178.5	0	110.7	A183 S186 N188 G192 F193 L200 P243	A183-K196 VanDerWaalsContact O-CE 3.26Å; A183-K196 WeakPolarHBondContact O-CE 3.45Å; S186-K196 PolarHBondContact O-NZ 2.98Å; S186-K196 WeakPolarHBondContact OG-CE 3.35Å; N188-K196 PolarHBondContact OD1-NZ 2.94Å; G192-K196 WeakPolarHBondContact O-CB 3.29Å; G192-K196 WeakPolarHBondContact O-CD 3.24Å; G192-K196 WeakPolarHBondContact O-CG 3.37Å; G192-K196 PolarHBondContact O-N 3.11Å; F193-K196 PolarHBondContact O-N 3.42Å; K196-L200 WeakPolarHBondContact O-CB 3.43Å; K196-L200 WeakPolarHBondContact O-CD1 3.44Å; K196-L200 WeakPolarHBondContact O-CG 3.25Å; K196-L200 PolarHBondContact O-N 3.46Å; K196-P243 HydrophobicContact CB-CG 4.35Å; K196-P243 HydrophobicContact CD-CG 4.27Å; K196-P243 HydrophobicContact CG-CG 4.32Å
197	E	75.8	Confident	77.9	Confident	55 Å²	55	56.1 Å²	56.1	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-48.4	177.2	-170.4	174.9	175.6	0	0	111.7	F193 L194 F195 L200 T201	F193-E197 WeakPolarHBondContact CE1-OE2 3.42Å; F193-E197 WeakPolarHBondContact O-CB 3.33Å; F193-E197 PolarHBondContact O-N 3.27Å; L194-E197 PolarHBondContact O-N 3.15Å; F195-E197 VanDerWaalsContact C-N 3.28Å; F195-E197 PolarHBondContact O-N 3.48Å; E197-L200 PolarHBondContact O-N 2.97Å; E197-T201 VanDerWaalsContact O-CB 3.25Å; E197-T201 WeakPolarHBondContact O-CB 3.46Å; E197-T201 PolarHBondContact O-N 3.09Å; E197-T201 PolarHBondContact O-OG1 2.97Å
198	A	79.1	Confident	78.8	Confident	49 Å²	49	54.8 Å²	54.8	41%	0.405	29%	0.289	S	S	.	.	H	α-helix	trans	-60.9	-48.1	177.5	0	0	0	0	0	111.7	L194 F195 T201 T202	L194-A198 WeakPolarHBondContact O-CB 3.38Å; L194-A198 PolarHBondContact O-N 3.19Å; F195-A198 PolarHBondContact O-N 3.11Å; A198-T201 PolarHBondContact O-N 3.31Å; A198-T202 WeakPolarHBondContact O-CB 3.4Å; A198-T202 WeakPolarHBondContact O-CG2 3.31Å; A198-T202 PolarHBondContact O-N 3.38Å; A198-T202 PolarHBondContact O-OG1 2.85Å
199	F	85.5	Confident	79.5	Confident	9 Å²	9	51.3 Å²	51.3	4%	0.039	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-51	178.4	-179.5	-93.4	0	0	0	111.1	L179 I180 A183 F195 T201 T202 Y203 F206 L212	L179-F199 HydrophobicContact CB-CD2 3.98Å; L179-F199 HydrophobicContact CB-CE2 3.64Å; I180-F199 HydrophobicContact CG1-CE1 4.33Å; I180-F199 HydrophobicContact CG1-CE2 4.3Å; I180-F199 HydrophobicContact CG1-CZ 3.55Å; A183-F199 HydrophobicContact CB-CD1 3.97Å; A183-F199 HydrophobicContact CB-CE1 4.34Å; A183-F199 HydrophobicContact CB-CG 4.25Å; F195-F199 HydrophobicContact CD1-CB 4.41Å; F195-F199 HydrophobicContact CE1-CB 4.09Å; F195-F199 HydrophobicContact CE1-CD2 4.42Å; F195-F199 HydrophobicContact CE1-CG 4.4Å; F195-F199 HydrophobicContact CZ-CB 4.47Å; F195-F199 HydrophobicContact CZ-CD2 4.36Å; F195-F199 WeakPolarHBondContact O-CB 3.43Å; F195-F199 PolarHBondContact O-N 3.49Å; F199-T201 VanDerWaalsContact C-N 3.3Å; F199-T201 PolarHBondContact O-N 3.17Å; F199-T202 PolarHBondContact O-N 3.39Å; F199-Y203 WeakPolarHBondContact O-CB 3.37Å; F199-Y203 PolarHBondContact O-N 3.06Å; F199-F206 AromaticContact CD2-CZ 3.96Å; F199-F206 HydrophobicContact CD2-CZ 3.96Å; F199-F206 AromaticContact CE2-CE2 3.87Å; F199-F206 HydrophobicContact CE2-CE2 3.87Å; F199-F206 AromaticContact CE2-CZ 3.67Å; F199-F206 HydrophobicContact CE2-CZ 3.67Å; F199-F206 HydrophobicContact CZ-CE2 4.42Å; F199-F206 HydrophobicContact CZ-CZ 4.45Å; F199-L212 HydrophobicContact CE1-CD1 3.99Å; F199-L212 HydrophobicContact CE1-CD2 4.25Å; F199-L212 HydrophobicContact CZ-CD1 3.94Å
200	L	81.5	Confident	79.9	Confident	10 Å²	10	49 Å²	49	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-67.2	-29.3	180	-68.5	164.2	0	0	0	114.2	K196 E197 Y203 P243 I247	K196-L200 WeakPolarHBondContact O-CB 3.43Å; K196-L200 WeakPolarHBondContact O-CD1 3.44Å; K196-L200 WeakPolarHBondContact O-CG 3.25Å; K196-L200 PolarHBondContact O-N 3.46Å; E197-L200 PolarHBondContact O-N 2.97Å; L200-Y203 VanDerWaalsContact O-CD1 3.23Å; L200-Y203 WeakPolarHBondContact O-CD1 3.39Å; L200-P243 HydrophobicContact CD1-CB 3.53Å; L200-P243 HydrophobicContact CD1-CG 3.96Å; L200-P243 HydrophobicContact CD2-CB 3.7Å; L200-P243 WeakPolarHBondContact CD2-O 3.27Å; L200-P243 HydrophobicContact CG-CB 3.93Å; L200-I247 HydrophobicContact CD2-CD1 3.94Å; L200-I247 HydrophobicContact CD2-CG1 3.92Å
201	T	77.6	Confident	80.5	Confident	30 Å²	30	45.2 Å²	45.2	18%	0.184	24%	0.242	C	C	.	.	H	α-helix	trans	-74.6	-34.1	177.8	-57	0	0	0	0	110.8	E197 A198 F199 S324	E197-T201 VanDerWaalsContact O-CB 3.25Å; E197-T201 WeakPolarHBondContact O-CB 3.46Å; E197-T201 PolarHBondContact O-N 3.09Å; E197-T201 PolarHBondContact O-OG1 2.97Å; A198-T201 PolarHBondContact O-N 3.31Å; F199-T201 VanDerWaalsContact C-N 3.3Å; F199-T201 PolarHBondContact O-N 3.17Å; T201-S324 WeakPolarHBondContact O-CB 3.46Å; T201-S324 PolarHBondContact O-OG 3.33Å
202	T	82.6	Confident	81.1	Confident	63 Å²	63	42 Å²	42	39%	0.387	23%	0.227	S	C	.	.	H	α-helix	trans	-110.4	-10.6	-168.2	62.5	0	0	0	0	115.4	A198 F199 R204 S205	A198-T202 WeakPolarHBondContact O-CB 3.4Å; A198-T202 WeakPolarHBondContact O-CG2 3.31Å; A198-T202 PolarHBondContact O-N 3.38Å; A198-T202 PolarHBondContact O-OG1 2.85Å; F199-T202 PolarHBondContact O-N 3.39Å; T202-R204 PolarHBondContact O-N 3.45Å; T202-S205 WeakPolarHBondContact O-CB 3.35Å; T202-S205 PolarHBondContact O-N 2.89Å; T202-S205 PolarHBondContact O-OG 3.03Å
203	Y	85.7	Confident	81.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-52.7	-33.5	-173.8	80.5	-93.1	0	0	0	113.8	F199 L200 S205 F206 I207 S209 L212 I247	F199-Y203 WeakPolarHBondContact O-CB 3.37Å; F199-Y203 PolarHBondContact O-N 3.06Å; L200-Y203 VanDerWaalsContact O-CD1 3.23Å; L200-Y203 WeakPolarHBondContact O-CD1 3.39Å; Y203-S205 PolarHBondContact O-N 3.43Å; Y203-F206 VanDerWaalsContact CA-CE1 3.5Å; Y203-F206 VanDerWaalsContact CA-CZ 3.5Å; Y203-F206 PolarHBondContact O-N 3.02Å; Y203-I207 HydrophobicContact CD2-CG2 3.85Å; Y203-I207 WeakPolarHBondContact CD2-O 3.04Å; Y203-I207 HydrophobicContact CG-CG2 4.37Å; Y203-I207 PolarHBondContact O-N 3.07Å; Y203-S209 PolarHBondContact OH-OG 2.93Å; Y203-S209 VanDerWaalsContact OH-OG 3.05Å; Y203-L212 HydrophobicContact CD1-CD2 3.86Å; Y203-L212 HydrophobicContact CD2-CB 4.45Å; Y203-L212 HydrophobicContact CD2-CD2 3.39Å; Y203-L212 HydrophobicContact CE1-CD2 4.15Å; Y203-L212 HydrophobicContact CE2-CD2 3.71Å; Y203-L212 HydrophobicContact CG-CD2 3.46Å; Y203-L212 VanDerWaalsContact CG-CD2 3.46Å; Y203-I247 HydrophobicContact CE1-CG1 4.16Å
204	R	80.8	Confident	82.1	Confident	84 Å²	84	41.2 Å²	41.2	32%	0.317	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-59.9	-17.9	-179.7	-66.3	-176.4	174.4	82.5	1.5	114.1	T202 F206 E249	T202-R204 PolarHBondContact O-N 3.45Å; R204-F206 VanDerWaalsContact C-N 3.3Å; R204-E249 IonicContact CZ-OE1 3.39Å; R204-E249 IonicContact NE-OE1 3.1Å; R204-E249 PolarHBondContact NE-OE1 2.85Å; R204-E249 IonicContact NH2-OE1 2.76Å
205	S	80.9	Confident	82.4	Confident	100 Å²	100	38.6 Å²	38.6	70%	0.699	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-77.2	-14.6	174.3	64.8	0	0	0	0	113.5	T202 Y203	T202-S205 WeakPolarHBondContact O-CB 3.35Å; T202-S205 PolarHBondContact O-N 2.89Å; T202-S205 PolarHBondContact O-OG 3.03Å; Y203-S205 PolarHBondContact O-N 3.43Å
206	F	84	Confident	82.5	Confident	86 Å²	86	37.9 Å²	37.9	38%	0.377	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141.8	-13.8	-174.1	61.1	-102.1	0	0	0	116.6	V176 F199 Y203 R204	V176-F206 HydrophobicContact CG2-CD2 4.23Å; F199-F206 AromaticContact CD2-CZ 3.96Å; F199-F206 HydrophobicContact CD2-CZ 3.96Å; F199-F206 AromaticContact CE2-CE2 3.87Å; F199-F206 HydrophobicContact CE2-CE2 3.87Å; F199-F206 AromaticContact CE2-CZ 3.67Å; F199-F206 HydrophobicContact CE2-CZ 3.67Å; F199-F206 HydrophobicContact CZ-CE2 4.42Å; F199-F206 HydrophobicContact CZ-CZ 4.45Å; Y203-F206 VanDerWaalsContact CA-CE1 3.5Å; Y203-F206 VanDerWaalsContact CA-CZ 3.5Å; Y203-F206 PolarHBondContact O-N 3.02Å; R204-F206 VanDerWaalsContact C-N 3.3Å
207	I	84.8	Confident	82.6	Confident	9 Å²	9	38 Å²	38	5%	0.046	21%	0.209	C	C	.	.	S	Bend	trans	-143.8	143.9	173.7	-176.9	167.7	0	0	0	110.9	V176 I180 Y203 E211 L212 K215	V176-I207 HydrophobicContact CG1-CB 4.16Å; V176-I207 HydrophobicContact CG1-CD1 3.49Å; V176-I207 VanDerWaalsContact CG1-CD1 3.49Å; V176-I207 HydrophobicContact CG1-CG1 4.33Å; V176-I207 HydrophobicContact CG1-CG2 4.42Å; I180-I207 HydrophobicContact CD1-CD1 4.18Å; Y203-I207 HydrophobicContact CD2-CG2 3.85Å; Y203-I207 WeakPolarHBondContact CD2-O 3.04Å; Y203-I207 HydrophobicContact CG-CG2 4.37Å; Y203-I207 PolarHBondContact O-N 3.07Å; I207-E211 HydrophobicContact CD1-CB 4.11Å; I207-E211 HydrophobicContact CD1-CG 3.85Å; I207-E211 HydrophobicContact CG1-CB 3.97Å; I207-E211 HydrophobicContact CG1-CG 4.11Å; I207-L212 HydrophobicContact CD1-CB 4Å; I207-L212 HydrophobicContact CG1-CB 4.16Å; I207-L212 HydrophobicContact CG2-CB 4.2Å; I207-L212 HydrophobicContact CG2-CD2 4.5Å; I207-K215 HydrophobicContact CD1-CD 3.67Å
208	S	83	Confident	82.7	Confident	61 Å²	61	42.3 Å²	42.3	43%	0.427	22%	0.222	S	C	.	.			trans	-72.6	150.9	176.4	77.5	0	0	0	0	112	V210 E211 L212	S208-V210 VanDerWaalsContact C-N 3.26Å; S208-V210 PolarHBondContact O-N 2.86Å; S208-E211 PolarHBondContact O-N 3.46Å; S208-E211 WeakPolarHBondContact OG-CB 3.47Å; S208-E211 PolarHBondContact OG-N 2.89Å; S208-E211 VanDerWaalsContact OG-N 3.12Å; S208-L212 VanDerWaalsContact O-CB 3.31Å; S208-L212 WeakPolarHBondContact O-CB 3.23Å; S208-L212 PolarHBondContact O-N 3.12Å
209	S	81.3	Confident	82.4	Confident	7 Å²	7	41.4 Å²	41.4	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-59.8	-36.7	179.1	-42.9	0	0	0	0	112.8	Y203 L213 E249	Y203-S209 PolarHBondContact OH-OG 2.93Å; Y203-S209 VanDerWaalsContact OH-OG 3.05Å; S209-L213 WeakPolarHBondContact O-CB 3.46Å; S209-L213 PolarHBondContact O-N 3.2Å; S209-E249 WeakPolarHBondContact CB-OE2 3.32Å; S209-E249 PolarHBondContact OG-OE1 3.42Å; S209-E249 PolarHBondContact OG-OE2 3.21Å
210	V	82.7	Confident	81.7	Confident	22 Å²	22	41.8 Å²	41.8	13%	0.133	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-50.5	177.3	173.8	0	0	0	0	110.4	S208 L212 L213 E214 Q253 I257	S208-V210 VanDerWaalsContact C-N 3.26Å; S208-V210 PolarHBondContact O-N 2.86Å; V210-L212 VanDerWaalsContact C-N 3.34Å; V210-L212 PolarHBondContact O-N 3.4Å; V210-L213 WeakPolarHBondContact O-CB 3.41Å; V210-L213 PolarHBondContact O-N 3.49Å; V210-E214 WeakPolarHBondContact O-CG 3.38Å; V210-E214 PolarHBondContact O-N 2.77Å; V210-Q253 HydrophobicContact CG1-CG 4.37Å; V210-Q253 HydrophobicContact CG2-CG 4.41Å; V210-I257 HydrophobicContact CG1-CD1 3.72Å
211	E	84.1	Confident	81.2	Confident	83 Å²	83	43.9 Å²	43.9	39%	0.388	22%	0.22	S	C	.	.	H	α-helix	trans	-64.5	-39.7	179.8	-172.2	-172.6	166.9	0	0	111.7	I207 S208 E214 K215	I207-E211 HydrophobicContact CD1-CB 4.11Å; I207-E211 HydrophobicContact CD1-CG 3.85Å; I207-E211 HydrophobicContact CG1-CB 3.97Å; I207-E211 HydrophobicContact CG1-CG 4.11Å; S208-E211 PolarHBondContact O-N 3.46Å; S208-E211 WeakPolarHBondContact OG-CB 3.47Å; S208-E211 PolarHBondContact OG-N 2.89Å; S208-E211 VanDerWaalsContact OG-N 3.12Å; E211-E214 PolarHBondContact O-N 2.77Å; E211-K215 HydrophobicContact CG-CD 4.36Å; E211-K215 WeakPolarHBondContact O-CB 3.45Å; E211-K215 WeakPolarHBondContact O-CG 3.33Å; E211-K215 PolarHBondContact O-N 3.35Å; E211-K215 VanDerWaalsContact OE1-CE 3.23Å; E211-K215 WeakPolarHBondContact OE1-CE 3.38Å
212	L	87.3	Confident	80.6	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-44.3	175.1	177.4	60.4	0	0	0	110.9	I180 F199 Y203 I207 S208 V210 K215 L216 I247	I180-L212 HydrophobicContact CD1-CD1 3.52Å; I180-L212 HydrophobicContact CG1-CD1 3.58Å; F199-L212 HydrophobicContact CE1-CD1 3.99Å; F199-L212 HydrophobicContact CE1-CD2 4.25Å; F199-L212 HydrophobicContact CZ-CD1 3.94Å; Y203-L212 HydrophobicContact CD1-CD2 3.86Å; Y203-L212 HydrophobicContact CD2-CB 4.45Å; Y203-L212 HydrophobicContact CD2-CD2 3.39Å; Y203-L212 HydrophobicContact CE1-CD2 4.15Å; Y203-L212 HydrophobicContact CE2-CD2 3.71Å; Y203-L212 HydrophobicContact CG-CD2 3.46Å; Y203-L212 VanDerWaalsContact CG-CD2 3.46Å; I207-L212 HydrophobicContact CD1-CB 4Å; I207-L212 HydrophobicContact CG1-CB 4.16Å; I207-L212 HydrophobicContact CG2-CB 4.2Å; I207-L212 HydrophobicContact CG2-CD2 4.5Å; S208-L212 VanDerWaalsContact O-CB 3.31Å; S208-L212 WeakPolarHBondContact O-CB 3.23Å; S208-L212 PolarHBondContact O-N 3.12Å; V210-L212 VanDerWaalsContact C-N 3.34Å; V210-L212 PolarHBondContact O-N 3.4Å; L212-K215 PolarHBondContact O-N 3.31Å; L212-L216 HydrophobicContact CD1-CD1 4.11Å; L212-L216 HydrophobicContact CD1-CG 4.09Å; L212-L216 HydrophobicContact CG-CD1 3.96Å; L212-L216 HydrophobicContact CG-CG 4.39Å; L212-L216 VanDerWaalsContact O-CB 3.28Å; L212-L216 WeakPolarHBondContact O-CB 3.35Å; L212-L216 VanDerWaalsContact O-CG 3.25Å; L212-L216 WeakPolarHBondContact O-CG 3.17Å; L212-L216 PolarHBondContact O-N 2.85Å; L212-I247 HydrophobicContact CD2-CD1 3.54Å; L212-I247 HydrophobicContact CD2-CG1 3.9Å; L212-I247 HydrophobicContact CD2-CG2 4.37Å; L212-I247 HydrophobicContact CG-CD1 3.92Å
213	L	83.7	Confident	79.5	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-45.3	176.7	178.7	68.9	0	0	0	111.3	S209 V210 L216 I217 F244 A254 I257 I258	S209-L213 WeakPolarHBondContact O-CB 3.46Å; S209-L213 PolarHBondContact O-N 3.2Å; V210-L213 WeakPolarHBondContact O-CB 3.41Å; V210-L213 PolarHBondContact O-N 3.49Å; L213-L216 PolarHBondContact O-N 3.35Å; L213-I217 HydrophobicContact CD1-CD1 4.18Å; L213-I217 HydrophobicContact CG-CD1 3.98Å; L213-I217 WeakPolarHBondContact O-CB 3.47Å; L213-I217 VanDerWaalsContact O-CG1 3.27Å; L213-I217 WeakPolarHBondContact O-CG1 3.43Å; L213-I217 PolarHBondContact O-N 2.77Å; L213-F244 HydrophobicContact CD1-CE1 4.38Å; L213-A254 HydrophobicContact CD2-CB 4.45Å; L213-I257 HydrophobicContact CD2-CB 3.84Å; L213-I257 HydrophobicContact CD2-CG2 3.51Å; L213-I257 HydrophobicContact CG-CG2 4.02Å; L213-I258 HydrophobicContact CD1-CD1 4.37Å; L213-I258 HydrophobicContact CD1-CG1 4.08Å; L213-I258 HydrophobicContact CD2-CD1 4.01Å; L213-I258 HydrophobicContact CD2-CG1 3.57Å; L213-I258 HydrophobicContact CG-CG1 4.45Å
214	E	85.2	Confident	77.8	Confident	81 Å²	81	47.3 Å²	47.3	38%	0.379	25%	0.246	S	C	.	.	H	α-helix	trans	-63.4	-43.4	176.3	-72.6	173.5	174	0	0	112	V210 E211 I217 R218 I257	V210-E214 WeakPolarHBondContact O-CG 3.38Å; V210-E214 PolarHBondContact O-N 2.77Å; E211-E214 PolarHBondContact O-N 2.77Å; E214-I217 PolarHBondContact O-N 2.76Å; E214-R218 WeakPolarHBondContact O-CB 3.5Å; E214-R218 WeakPolarHBondContact O-CG 3.49Å; E214-R218 PolarHBondContact O-N 3.37Å; E214-I257 HydrophobicContact CG-CD1 4.19Å
215	K	84.3	Confident	76.3	Confident	19 Å²	19	51.7 Å²	51.7	8%	0.083	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-46.4	173.9	-78.5	175.2	-178.5	-83.5	0	110.7	V176 D177 I180 I207 E211 L212 I217 R218 F219	V176-K215 HydrophobicContact CG1-CD 4.44Å; D177-K215 WeakPolarHBondContact OD1-CD 3.33Å; D177-K215 IonicContact OD1-NZ 2.75Å; D177-K215 PolarHBondContact OD1-NZ 3.15Å; D177-K215 IonicContact OD2-NZ 3.16Å; D177-K215 PolarHBondContact OD2-NZ 2.86Å; I180-K215 HydrophobicContact CD1-CB 3.8Å; I180-K215 HydrophobicContact CD1-CD 3.57Å; I180-K215 HydrophobicContact CD1-CG 4.29Å; I207-K215 HydrophobicContact CD1-CD 3.67Å; E211-K215 HydrophobicContact CG-CD 4.36Å; E211-K215 WeakPolarHBondContact O-CB 3.45Å; E211-K215 WeakPolarHBondContact O-CG 3.33Å; E211-K215 PolarHBondContact O-N 3.35Å; E211-K215 VanDerWaalsContact OE1-CE 3.23Å; E211-K215 WeakPolarHBondContact OE1-CE 3.38Å; L212-K215 PolarHBondContact O-N 3.31Å; K215-I217 PolarHBondContact O-N 3.3Å; K215-R218 CarbonylContact O-C 3.42Å; K215-R218 WeakPolarHBondContact O-CB 3.43Å; K215-R218 PolarHBondContact O-N 3.38Å; K215-R218 VanDerWaalsContact O-N 3.15Å; K215-F219 VanDerWaalsContact O-CD2 3.24Å; K215-F219 WeakPolarHBondContact O-CD2 3.24Å; K215-F219 PolarHBondContact O-N 3.43Å
216	L	83.5	Confident	74.6	Confident	7 Å²	7	52.7 Å²	52.7	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-41	178.5	-79	174	0	0	0	113.2	I180 V184 L212 L213 R218 F219 F220 F244 I247	I180-L216 HydrophobicContact CG2-CD2 3.74Å; I180-L216 HydrophobicContact CG2-CG 4.3Å; V184-L216 HydrophobicContact CG2-CD2 3.61Å; L212-L216 HydrophobicContact CD1-CD1 4.11Å; L212-L216 HydrophobicContact CD1-CG 4.09Å; L212-L216 HydrophobicContact CG-CD1 3.96Å; L212-L216 HydrophobicContact CG-CG 4.39Å; L212-L216 VanDerWaalsContact O-CB 3.28Å; L212-L216 WeakPolarHBondContact O-CB 3.35Å; L212-L216 VanDerWaalsContact O-CG 3.25Å; L212-L216 WeakPolarHBondContact O-CG 3.17Å; L212-L216 PolarHBondContact O-N 2.85Å; L213-L216 PolarHBondContact O-N 3.35Å; L216-R218 VanDerWaalsContact C-N 3.34Å; L216-F219 PolarHBondContact O-N 3.1Å; L216-F220 WeakPolarHBondContact O-CB 3.32Å; L216-F220 PolarHBondContact O-N 3.41Å; L216-F244 HydrophobicContact CB-CD2 4.33Å; L216-F244 HydrophobicContact CB-CE1 4.18Å; L216-F244 HydrophobicContact CB-CE2 3.58Å; L216-F244 HydrophobicContact CB-CZ 3.51Å; L216-F244 HydrophobicContact CD1-CD2 4.27Å; L216-F244 HydrophobicContact CD1-CE2 4.33Å; L216-F244 HydrophobicContact CD2-CD2 4.36Å; L216-F244 HydrophobicContact CD2-CE2 4.07Å; L216-F244 HydrophobicContact CG-CE2 4.22Å; L216-I247 HydrophobicContact CD1-CD1 3.14Å
217	I	80.3	Confident	72.7	Confident	18 Å²	18	54.7 Å²	54.7	9%	0.092	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-42.7	173.3	-70.4	166.7	0	0	0	110.1	L213 E214 K215 F220 H221 F244 I257 F261	L213-I217 HydrophobicContact CD1-CD1 4.18Å; L213-I217 HydrophobicContact CG-CD1 3.98Å; L213-I217 WeakPolarHBondContact O-CB 3.47Å; L213-I217 VanDerWaalsContact O-CG1 3.27Å; L213-I217 WeakPolarHBondContact O-CG1 3.43Å; L213-I217 PolarHBondContact O-N 2.77Å; E214-I217 PolarHBondContact O-N 2.76Å; K215-I217 PolarHBondContact O-N 3.3Å; I217-F220 WeakPolarHBondContact O-CB 3.46Å; I217-F220 PolarHBondContact O-N 3.43Å; I217-H221 WeakPolarHBondContact CG2-CE1 3.25Å; I217-H221 PolarHBondContact O-N 3.2Å; I217-H221 PolarHBondContact O-ND1 3.13Å; I217-F244 HydrophobicContact CG1-CE1 4.27Å; I217-F244 HydrophobicContact CG1-CZ 4.43Å; I217-I257 HydrophobicContact CD1-CG2 3.57Å; I217-F261 HydrophobicContact CD1-CB 4Å; I217-F261 HydrophobicContact CD1-CD1 4.34Å; I217-F261 HydrophobicContact CD1-CD2 4.3Å; I217-F261 HydrophobicContact CD1-CG 3.97Å; I217-F261 HydrophobicContact CG1-CD1 4.14Å; I217-F261 HydrophobicContact CG1-CD2 4.07Å; I217-F261 HydrophobicContact CG1-CE1 4.32Å; I217-F261 HydrophobicContact CG1-CE2 4.27Å; I217-F261 HydrophobicContact CG1-CG 4.01Å; I217-F261 HydrophobicContact CG1-CZ 4.4Å; I217-F261 HydrophobicContact CG2-CD2 3.83Å; I217-F261 HydrophobicContact CG2-CE2 3.92Å
218	R	79.3	Confident	71	Confident	145 Å²	145	57.3 Å²	57.3	55%	0.547	31%	0.305	S	S	.	.	H	α-helix	trans	-60.8	-44.9	173.9	-75.8	-174	-71.5	162.2	-13.4	112.4	E214 K215 L216 F220 H221 G222	E214-R218 WeakPolarHBondContact O-CB 3.5Å; E214-R218 WeakPolarHBondContact O-CG 3.49Å; E214-R218 PolarHBondContact O-N 3.37Å; K215-R218 CarbonylContact O-C 3.42Å; K215-R218 WeakPolarHBondContact O-CB 3.43Å; K215-R218 PolarHBondContact O-N 3.38Å; K215-R218 VanDerWaalsContact O-N 3.15Å; L216-R218 VanDerWaalsContact C-N 3.34Å; R218-F220 VanDerWaalsContact C-N 3.32Å; R218-F220 PolarHBondContact O-N 3.42Å; R218-H221 PolarHBondContact O-N 3.44Å; R218-G222 PolarHBondContact O-N 2.94Å
219	F	72.8	Confident	69.2	Low	30 Å²	30	60.8 Å²	60.8	13%	0.132	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-40.3	174.8	-90.1	-81.3	0	0	0	111.8	Y158 D177 I180 K215 L216 G222 Q223	Y158-F219 AromaticContact CE1-CE1 3.93Å; Y158-F219 HydrophobicContact CE1-CE1 3.93Å; Y158-F219 AromaticContact CE1-CZ 3.96Å; Y158-F219 HydrophobicContact CE1-CZ 3.96Å; Y158-F219 AromaticContact CZ-CE1 3.87Å; Y158-F219 WeakPolarHBondContact OH-CE1 3.43Å; D177-F219 HydrophobicContact CB-CZ 4.46Å; D177-F219 WeakPolarHBondContact O-CZ 3.5Å; I180-F219 HydrophobicContact CB-CD2 4.49Å; I180-F219 HydrophobicContact CB-CE2 4.09Å; I180-F219 HydrophobicContact CG2-CD2 3.55Å; I180-F219 HydrophobicContact CG2-CE2 3.64Å; I180-F219 HydrophobicContact CG2-CG 4.29Å; I180-F219 HydrophobicContact CG2-CZ 4.41Å; K215-F219 VanDerWaalsContact O-CD2 3.24Å; K215-F219 WeakPolarHBondContact O-CD2 3.24Å; K215-F219 PolarHBondContact O-N 3.43Å; L216-F219 PolarHBondContact O-N 3.1Å; F219-G222 PolarHBondContact O-N 3.09Å; F219-Q223 WeakPolarHBondContact O-CB 3.47Å; F219-Q223 VanDerWaalsContact O-CG 3.28Å; F219-Q223 WeakPolarHBondContact O-CG 3.35Å; F219-Q223 PolarHBondContact O-N 3.42Å
220	F	71.1	Confident	67.5	Low	17 Å²	17	65.4 Å²	65.4	8%	0.075	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-43.7	175.3	-177.3	-93.4	0	0	0	112.1	L216 I217 R218 L224 F261 L265 K270 W273	L216-F220 WeakPolarHBondContact O-CB 3.32Å; L216-F220 PolarHBondContact O-N 3.41Å; I217-F220 WeakPolarHBondContact O-CB 3.46Å; I217-F220 PolarHBondContact O-N 3.43Å; R218-F220 VanDerWaalsContact C-N 3.32Å; R218-F220 PolarHBondContact O-N 3.42Å; F220-L224 HydrophobicContact CE1-CD1 4.22Å; F220-L224 HydrophobicContact CZ-CD1 4.47Å; F220-L224 PolarHBondContact O-N 2.83Å; F220-F261 HydrophobicContact CD1-CE2 4Å; F220-F261 AromaticContact CD1-CZ 3.65Å; F220-F261 HydrophobicContact CD1-CZ 3.65Å; F220-F261 HydrophobicContact CE1-CE2 4.37Å; F220-F261 AromaticContact CE1-CZ 3.96Å; F220-F261 HydrophobicContact CE1-CZ 3.96Å; F220-F261 HydrophobicContact CG-CZ 4.11Å; F220-L265 HydrophobicContact CE1-CD2 3.68Å; F220-L265 HydrophobicContact CZ-CD2 4.01Å; F220-K270 HydrophobicContact CE1-CD 4.42Å; F220-K270 HydrophobicContact CZ-CD 4.4Å; F220-W273 HydrophobicContact CE2-CD2 4.21Å; F220-W273 HydrophobicContact CE2-CE3 4.36Å; F220-W273 HydrophobicContact CE2-CH2 4.41Å; F220-W273 HydrophobicContact CE2-CZ2 4.31Å; F220-W273 HydrophobicContact CE2-CZ3 4.46Å; F220-W273 HydrophobicContact CZ-CD2 4.27Å; F220-W273 HydrophobicContact CZ-CG 4.34Å
221	H	70.3	Confident	65.9	Low	53 Å²	53	68.8 Å²	68.8	25%	0.245	36%	0.363	C	S	.	.	H	α-helix	trans	-67.4	-39.9	175.3	-65.7	144.8	0	0	0	112.7	I217 R218 Q223 L224 F261 Q264	I217-H221 WeakPolarHBondContact CG2-CE1 3.25Å; I217-H221 PolarHBondContact O-N 3.2Å; I217-H221 PolarHBondContact O-ND1 3.13Å; R218-H221 PolarHBondContact O-N 3.44Å; H221-Q223 VanDerWaalsContact C-N 3.34Å; H221-Q223 PolarHBondContact O-N 3.46Å; H221-L224 VanDerWaalsContact O-CB 3.27Å; H221-L224 WeakPolarHBondContact O-CB 3.13Å; H221-L224 PolarHBondContact O-N 2.87Å; H221-F261 AromaticContact NE2-CE2 3.74Å; H221-Q264 PolarHBondContact CE1-NE2 3.4Å; H221-Q264 PolarHBondContact CE1-OE1 3.2Å; H221-Q264 PolarHBondContact NE2-NE2 2.95Å
222	G	65.9	Low	64.1	Low	54 Å²	54	66.8 Å²	66.8	56%	0.557	36%	0.355	S	S	*	.	H	α-helix	trans	-65.7	-33.6	179	0	0	0	0	0	113.7	R218 F219 L224	R218-G222 PolarHBondContact O-N 2.94Å; F219-G222 PolarHBondContact O-N 3.09Å; G222-L224 VanDerWaalsContact C-N 3.32Å
223	Q	58.5	Low	62.1	Low	46 Å²	46	70.6 Å²	70.6	22%	0.215	37%	0.371	C	S	.	.	H	α-helix	trans	-78.1	-15.6	177.3	-71	-78.5	-35.4	0	0	113.3	F219 H221 H225 Q226 M232	F219-Q223 WeakPolarHBondContact O-CB 3.47Å; F219-Q223 VanDerWaalsContact O-CG 3.28Å; F219-Q223 WeakPolarHBondContact O-CG 3.35Å; F219-Q223 PolarHBondContact O-N 3.42Å; H221-Q223 VanDerWaalsContact C-N 3.34Å; H221-Q223 PolarHBondContact O-N 3.46Å; Q223-H225 PolarHBondContact O-N 3.41Å; Q223-Q226 PolarHBondContact O-N 3.29Å; Q223-M232 HydrophobicContact CB-CE 4.1Å
224	L	49.8	Very low	60.1	Low	65 Å²	65	76.7 Å²	76.7	34%	0.34	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.7	-175	-152.4	84.8	0	0	0	114.3	F220 H221 G222 Q226 K270	F220-L224 HydrophobicContact CE1-CD1 4.22Å; F220-L224 HydrophobicContact CZ-CD1 4.47Å; F220-L224 PolarHBondContact O-N 2.83Å; H221-L224 VanDerWaalsContact O-CB 3.27Å; H221-L224 WeakPolarHBondContact O-CB 3.13Å; H221-L224 PolarHBondContact O-N 2.87Å; G222-L224 VanDerWaalsContact C-N 3.32Å; L224-Q226 VanDerWaalsContact C-N 3.27Å; L224-Q226 PolarHBondContact O-N 3.29Å; L224-K270 HydrophobicContact CD1-CD 4.3Å; L224-K270 VanDerWaalsContact CD1-CE 3.43Å
225	H	49.5	Very low	58.3	Low	177 Å²	177	77.3 Å²	77.3	82%	0.819	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-5.3	179.2	-80.7	-69.9	0	0	0	113.8	Q223	Q223-H225 PolarHBondContact O-N 3.41Å
226	Q	46.1	Very low	56.4	Low	121 Å²	121	77.6 Å²	77.6	57%	0.565	40%	0.399	S	S	*	.	S	Bend	trans	-92.1	131	174.5	-65.4	-173.6	-3.2	0	0	110.2	Q223 L224 T228	Q223-Q226 PolarHBondContact O-N 3.29Å; L224-Q226 VanDerWaalsContact C-N 3.27Å; L224-Q226 PolarHBondContact O-N 3.29Å; Q226-T228 PolarHBondContact O-N 2.86Å
227	S	44.1	Very low	54.4	Low	127 Å²	127	86.1 Å²	86.1	89%	0.888	43%	0.431	S	S	*	.	S	Bend	trans	-68.5	32.9	-167.5	68.3	0	0	0	0	116
228	T	47.6	Very low	52.5	Low	65 Å²	65	89 Å²	89	40%	0.399	45%	0.453	S	S	.	.			trans	-124.5	39.9	-169.5	-18.6	0	0	0	0	112.5	Q226 S230 L231 M232	Q226-T228 PolarHBondContact O-N 2.86Å; T228-S230 PolarHBondContact O-N 3.46Å; T228-L231 HydrophobicContact CG2-CB 3.53Å; T228-L231 HydrophobicContact CG2-CD2 4.35Å; T228-L231 HydrophobicContact CG2-CG 4.46Å; T228-L231 PolarHBondContact O-N 2.97Å; T228-M232 WeakPolarHBondContact O-CG 3.3Å; T228-M232 PolarHBondContact O-N 3.38Å; T228-M232 VanDerWaalsContact O-N 3.15Å
229	E	46.9	Very low	50.8	Low	134 Å²	134	83.7 Å²	83.7	63%	0.626	44%	0.435	S	S	*	.	H	α-helix	trans	-53.8	-39.7	178	-73.6	-168.2	140.7	0	0	112.7	M232 F233	E229-M232 PolarHBondContact O-N 3.34Å; E229-F233 WeakPolarHBondContact O-CB 3.41Å; E229-F233 PolarHBondContact O-N 2.85Å
230	S	45.4	Very low	49.2	Very low	104 Å²	104	92.6 Å²	92.6	73%	0.727	47%	0.474	S	S	*	.	H	α-helix	trans	-68.2	-38.8	-178.3	-58.4	0	0	0	0	113.5	T228 H234	T228-S230 PolarHBondContact O-N 3.46Å; S230-H234 PolarHBondContact O-N 3.21Å
231	L	48.2	Very low	47.7	Very low	93 Å²	93	93.2 Å²	93.2	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-72.9	-35.2	178.5	-152.4	95.6	0	0	0	110.6	T228 H234 R235	T228-L231 HydrophobicContact CG2-CB 3.53Å; T228-L231 HydrophobicContact CG2-CD2 4.35Å; T228-L231 HydrophobicContact CG2-CG 4.46Å; T228-L231 PolarHBondContact O-N 2.97Å; L231-H234 PolarHBondContact O-N 3.32Å; L231-R235 WeakPolarHBondContact O-CB 3.32Å; L231-R235 VanDerWaalsContact O-CG 3.3Å; L231-R235 WeakPolarHBondContact O-CG 3.25Å; L231-R235 PolarHBondContact O-N 3.27Å
232	M	47.5	Very low	46.3	Very low	41 Å²	41	90.7 Å²	90.7	20%	0.202	47%	0.473	C	S	.	.	H	α-helix	trans	-65.8	-42.5	174.4	-74.1	-78.2	-84.7	0	0	112.2	Q223 T228 E229 H234 R235 F236	Q223-M232 HydrophobicContact CB-CE 4.1Å; T228-M232 WeakPolarHBondContact O-CG 3.3Å; T228-M232 PolarHBondContact O-N 3.38Å; T228-M232 VanDerWaalsContact O-N 3.15Å; E229-M232 PolarHBondContact O-N 3.34Å; M232-H234 VanDerWaalsContact C-N 3.31Å; M232-H234 PolarHBondContact O-N 2.91Å; M232-R235 PolarHBondContact O-N 3.06Å; M232-F236 HydrophobicContact CE-CE2 4.37Å; M232-F236 PolarHBondContact O-N 3.25Å
233	F	43.5	Very low	45.1	Very low	80 Å²	80	89 Å²	89	35%	0.351	45%	0.452	S	S	.	.	H	α-helix	trans	-60.5	-41.7	176.4	-165	-103.1	0	0	0	111.8	E229 R237 A272 W273	E229-F233 WeakPolarHBondContact O-CB 3.41Å; E229-F233 PolarHBondContact O-N 2.85Å; F233-R237 WeakPolarHBondContact O-CB 3.44Å; F233-R237 PolarHBondContact O-N 2.88Å; F233-A272 HydrophobicContact CE2-CB 3.5Å; F233-A272 HydrophobicContact CZ-CB 3.92Å; F233-W273 HydrophobicContact CD2-CZ2 4.41Å
234	H	42.9	Very low	44.2	Very low	133 Å²	133	87.6 Å²	87.6	62%	0.616	45%	0.445	S	S	*	.	H	α-helix	trans	-71.3	-39.2	176.7	-137.1	-76.5	0	0	0	112.4	S230 L231 M232 S238	S230-H234 PolarHBondContact O-N 3.21Å; L231-H234 PolarHBondContact O-N 3.32Å; M232-H234 VanDerWaalsContact C-N 3.31Å; M232-H234 PolarHBondContact O-N 2.91Å; H234-S238 PolarHBondContact O-N 2.89Å; H234-S238 PolarHBondContact O-OG 3.36Å
235	R	46.8	Very low	43.9	Very low	95 Å²	95	86.2 Å²	86.2	36%	0.358	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-39	177.2	-81.5	178.1	167.6	179.6	-6.6	113	D187 N188 L231 M232 I239	D187-R235 IonicContact OD1-CZ 3.47Å; D187-R235 IonicContact OD1-NE 2.75Å; D187-R235 IonicContact OD1-NH2 3.15Å; D187-R235 PolarHBondContact OD1-NH2 3.24Å; N188-R235 PolarHBondContact ND2-O 3.21Å; L231-R235 WeakPolarHBondContact O-CB 3.32Å; L231-R235 VanDerWaalsContact O-CG 3.3Å; L231-R235 WeakPolarHBondContact O-CG 3.25Å; L231-R235 PolarHBondContact O-N 3.27Å; M232-R235 PolarHBondContact O-N 3.06Å; R235-I239 WeakPolarHBondContact O-CG1 3.47Å
236	F	44.7	Very low	43.9	Very low	25 Å²	25	82.7 Å²	82.7	11%	0.11	42%	0.416	C	S	.	.	H	α-helix	trans	-83	-34.8	177.7	-91.5	-95.5	0	0	0	113.9	M232 I239 F244 W273	M232-F236 HydrophobicContact CE-CE2 4.37Å; M232-F236 PolarHBondContact O-N 3.25Å; F236-I239 PolarHBondContact O-N 3.16Å; F236-F244 HydrophobicContact CE1-CD2 4.3Å; F236-W273 HydrophobicContact CB-CH2 3.39Å; F236-W273 HydrophobicContact CB-CZ3 3.63Å; F236-W273 HydrophobicContact CD1-CH2 4.01Å; F236-W273 AromaticContact CD1-CZ3 3.71Å; F236-W273 HydrophobicContact CD1-CZ3 3.71Å; F236-W273 AromaticContact CD2-CH2 3.61Å; F236-W273 HydrophobicContact CD2-CH2 3.61Å; F236-W273 HydrophobicContact CD2-CZ3 4.18Å; F236-W273 HydrophobicContact CE1-CZ3 4.38Å; F236-W273 HydrophobicContact CE2-CH2 4.34Å; F236-W273 AromaticContact CG-CH2 3.4Å; F236-W273 HydrophobicContact CG-CH2 3.4Å; F236-W273 VanDerWaalsContact CG-CH2 3.4Å; F236-W273 AromaticContact CG-CZ3 3.58Å; F236-W273 HydrophobicContact CG-CZ3 3.58Å
237	R	42.1	Very low	44.1	Very low	185 Å²	185	77.1 Å²	77.1	70%	0.698	39%	0.39	S	S	*	.	H	α-helix	trans	-68.4	-33.6	179.6	-179.7	175.6	163.1	156.3	-4.8	112.9	F233 I239	F233-R237 WeakPolarHBondContact O-CB 3.44Å; F233-R237 PolarHBondContact O-N 2.88Å; R237-I239 PolarHBondContact O-N 3.36Å
238	S	39.7	Very low	44.4	Very low	78 Å²	78	71.5 Å²	71.5	55%	0.545	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-12.9	175.2	-69.6	0	0	0	0	113.3	H234 K240	H234-S238 PolarHBondContact O-N 2.89Å; H234-S238 PolarHBondContact O-OG 3.36Å; S238-K240 PolarHBondContact O-N 2.87Å; S238-K240 VanDerWaalsContact O-N 3.13Å
239	I	44.7	Very low	44.8	Very low	34 Å²	34	71.4 Å²	71.4	17%	0.174	35%	0.345	C	S	.	.			trans	-87.4	83.7	174	-35.7	173.3	0	0	0	108.3	R235 F236 R237 G241 G242	R235-I239 WeakPolarHBondContact O-CG1 3.47Å; F236-I239 PolarHBondContact O-N 3.16Å; R237-I239 PolarHBondContact O-N 3.36Å; I239-G241 PolarHBondContact O-N 3.29Å; I239-G242 VanDerWaalsContact CG2-CA 3.44Å; I239-G242 PolarHBondContact O-N 3.31Å
240	K	37.4	Very low	45.4	Very low	218 Å²	218	69.8 Å²	69.8	95%	0.948	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	81.2	162.6	-77.3	-170.1	176.6	179.4	0	108.4	S238	S238-K240 PolarHBondContact O-N 2.87Å; S238-K240 VanDerWaalsContact O-N 3.13Å
241	G	39.4	Very low	46.5	Very low	29 Å²	29	67.2 Å²	67.2	30%	0.299	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.6	41.6	-174.8	0	0	0	0	0	115.4	I239	I239-G241 PolarHBondContact O-N 3.29Å
242	G	42.3	Very low	47.6	Very low	1 Å²	1	68.2 Å²	68.2	1%	0.01	34%	0.337	C	S	.	.			trans	-41.6	149.2	-178.3	0	0	0	0	0	117.2	I239 F244 F245	I239-G242 VanDerWaalsContact CG2-CA 3.44Å; I239-G242 PolarHBondContact O-N 3.31Å; G242-F244 VanDerWaalsContact C-N 3.29Å; G242-F244 PolarHBondContact O-N 3.16Å; G242-F245 PolarHBondContact O-N 3.21Å
243	P	40.6	Very low	48.9	Very low	17 Å²	17	71.9 Å²	71.9	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-51.2	-44.3	178.1	-26.5	32.1	0	0	0	115	K196 L200 F245 R246	K196-P243 HydrophobicContact CB-CG 4.35Å; K196-P243 HydrophobicContact CD-CG 4.27Å; K196-P243 HydrophobicContact CG-CG 4.32Å; L200-P243 HydrophobicContact CD1-CB 3.53Å; L200-P243 HydrophobicContact CD1-CG 3.96Å; L200-P243 HydrophobicContact CD2-CB 3.7Å; L200-P243 WeakPolarHBondContact CD2-O 3.27Å; L200-P243 HydrophobicContact CG-CB 3.93Å; P243-F245 PolarHBondContact O-N 3.09Å; P243-F245 VanDerWaalsContact O-N 3.1Å; P243-R246 PolarHBondContact O-N 3.26Å
244	F	40	Very low	50.5	Low	18 Å²	18	68.2 Å²	68.2	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-53.7	-32.3	177.5	-117.8	-89.9	0	0	0	113.4	L213 L216 I217 F236 G242 F261	L213-F244 HydrophobicContact CD1-CE1 4.38Å; L216-F244 HydrophobicContact CB-CD2 4.33Å; L216-F244 HydrophobicContact CB-CE1 4.18Å; L216-F244 HydrophobicContact CB-CE2 3.58Å; L216-F244 HydrophobicContact CB-CZ 3.51Å; L216-F244 HydrophobicContact CD1-CD2 4.27Å; L216-F244 HydrophobicContact CD1-CE2 4.33Å; L216-F244 HydrophobicContact CD2-CD2 4.36Å; L216-F244 HydrophobicContact CD2-CE2 4.07Å; L216-F244 HydrophobicContact CG-CE2 4.22Å; I217-F244 HydrophobicContact CG1-CE1 4.27Å; I217-F244 HydrophobicContact CG1-CZ 4.43Å; F236-F244 HydrophobicContact CE1-CD2 4.3Å; G242-F244 VanDerWaalsContact C-N 3.29Å; G242-F244 PolarHBondContact O-N 3.16Å; F244-F261 HydrophobicContact CE1-CE1 4.17Å
245	F	41.8	Very low	52.1	Low	35 Å²	35	63.8 Å²	63.8	15%	0.154	32%	0.318	C	S	.	.	H	α-helix	trans	-92.5	-15.9	-169.8	-55.8	-69	0	0	0	114	G242 P243 L248 L276 L277 K280	G242-F245 PolarHBondContact O-N 3.21Å; P243-F245 PolarHBondContact O-N 3.09Å; P243-F245 VanDerWaalsContact O-N 3.1Å; F245-L248 HydrophobicContact CB-CD1 4.49Å; F245-L248 VanDerWaalsContact O-CD1 3.24Å; F245-L248 WeakPolarHBondContact O-CD1 3.11Å; F245-L276 HydrophobicContact CE2-CD2 3.79Å; F245-L276 HydrophobicContact CE2-CG 4.26Å; F245-L276 HydrophobicContact CZ-CD2 3.64Å; F245-L276 HydrophobicContact CZ-CG 3.88Å; F245-L277 HydrophobicContact CD1-CD1 3.77Å; F245-L277 HydrophobicContact CE1-CB 3.94Å; F245-L277 HydrophobicContact CE1-CD1 3.42Å; F245-L277 VanDerWaalsContact CE1-CD1 3.42Å; F245-L277 HydrophobicContact CE1-CG 4.26Å; F245-K280 HydrophobicContact CD1-CB 3.9Å; F245-K280 HydrophobicContact CD1-CG 4.03Å; F245-K280 HydrophobicContact CE1-CB 4.45Å; F245-K280 HydrophobicContact CE1-CG 4.43Å; F245-K280 HydrophobicContact CG-CB 4.37Å; F245-K280 HydrophobicContact CG-CG 4.15Å
246	R	49.5	Very low	53.8	Low	103 Å²	103	62 Å²	62	39%	0.389	32%	0.32	S	S	.	.	H	α-helix	trans	-79.5	-20.9	172.5	-68.9	-171.8	-156	-174.7	5.4	112.7	P243 L248	P243-R246 PolarHBondContact O-N 3.26Å; R246-L248 PolarHBondContact O-N 2.84Å
247	I	50.2	Low	55.7	Low	5 Å²	5	61.9 Å²	61.9	3%	0.026	32%	0.32	C	S	.	.			trans	-71.3	-13.3	-175.8	-64.9	163	0	0	0	112.9	L200 Y203 L212 L216 E249	L200-I247 HydrophobicContact CD2-CD1 3.94Å; L200-I247 HydrophobicContact CD2-CG1 3.92Å; Y203-I247 HydrophobicContact CE1-CG1 4.16Å; L212-I247 HydrophobicContact CD2-CD1 3.54Å; L212-I247 HydrophobicContact CD2-CG1 3.9Å; L212-I247 HydrophobicContact CD2-CG2 4.37Å; L212-I247 HydrophobicContact CG-CD1 3.92Å; L216-I247 HydrophobicContact CD1-CD1 3.14Å; I247-E249 VanDerWaalsContact C-N 3.34Å; I247-E249 PolarHBondContact O-N 3.33Å
248	L	50.7	Low	57.6	Low	8 Å²	8	53.3 Å²	53.3	4%	0.042	29%	0.288	C	S	.	.			trans	-66.6	84.2	-175.9	-77	107.6	0	0	0	113.5	F245 R246 I258 F281 K284 Y285	F245-L248 HydrophobicContact CB-CD1 4.49Å; F245-L248 VanDerWaalsContact O-CD1 3.24Å; F245-L248 WeakPolarHBondContact O-CD1 3.11Å; R246-L248 PolarHBondContact O-N 2.84Å; L248-I258 HydrophobicContact CB-CD1 4.45Å; L248-I258 HydrophobicContact CD1-CD1 4.24Å; L248-I258 HydrophobicContact CD2-CD1 3.19Å; L248-I258 HydrophobicContact CD2-CG1 4.46Å; L248-I258 HydrophobicContact CD2-CG2 4.27Å; L248-I258 HydrophobicContact CG-CD1 3.34Å; L248-F281 HydrophobicContact CD2-CD2 3.62Å; L248-F281 HydrophobicContact CD2-CE2 4.07Å; L248-K284 HydrophobicContact CB-CD 4.37Å; L248-K284 WeakPolarHBondContact O-CE 3.46Å; L248-K284 PolarHBondContact O-NZ 3.46Å; L248-Y285 HydrophobicContact CD2-CE2 4.22Å
249	E	56.5	Low	59.7	Low	63 Å²	63	52.3 Å²	52.3	29%	0.294	28%	0.279	S	S	.	.			trans	-70.2	145.6	155.9	-74.5	179.6	173.4	0	0	110.3	R204 S209 I247 T251	R204-E249 IonicContact CZ-OE1 3.39Å; R204-E249 IonicContact NE-OE1 3.1Å; R204-E249 PolarHBondContact NE-OE1 2.85Å; R204-E249 IonicContact NH2-OE1 2.76Å; S209-E249 WeakPolarHBondContact CB-OE2 3.32Å; S209-E249 PolarHBondContact OG-OE1 3.42Å; S209-E249 PolarHBondContact OG-OE2 3.21Å; I247-E249 VanDerWaalsContact C-N 3.34Å; I247-E249 PolarHBondContact O-N 3.33Å; E249-T251 HydrophobicContact CB-CG2 4.31Å; E249-T251 PolarHBondContact O-N 3.4Å
250	T	60.5	Low	61.7	Low	101 Å²	101	56 Å²	56	62%	0.62	30%	0.295	S	S	*	.			trans	-76.5	31	179.5	-31.8	0	0	0	0	112.4	Y285	T250-Y285 HydrophobicContact CG2-CD1 4.29Å; T250-Y285 HydrophobicContact CG2-CE1 3.55Å
251	T	67.9	Low	64	Low	50 Å²	50	46.1 Å²	46.1	31%	0.307	25%	0.252	S	S	.	.			trans	-74.3	135.2	174.8	64	0	0	0	0	108.4	E249 Q253 A254 M255	E249-T251 HydrophobicContact CB-CG2 4.31Å; E249-T251 PolarHBondContact O-N 3.4Å; T251-Q253 PolarHBondContact O-N 3.38Å; T251-Q253 VanDerWaalsContact O-N 3.08Å; T251-A254 PolarHBondContact O-N 2.88Å; T251-A254 VanDerWaalsContact O-N 3.09Å; T251-A254 WeakPolarHBondContact OG1-CB 3.28Å; T251-A254 PolarHBondContact OG1-N 3.23Å; T251-M255 VanDerWaalsContact O-CG 3.25Å; T251-M255 WeakPolarHBondContact O-CG 3.45Å; T251-M255 PolarHBondContact O-N 3.03Å
252	P	70.4	Confident	66.1	Low	114 Å²	114	45.6 Å²	45.6	74%	0.74	24%	0.242	S	C	*	.	H	α-helix	trans	-53.1	-32.9	177.9	-27.9	34.6	0	0	0	112.9	S256	P252-S256 WeakPolarHBondContact O-CB 3.34Å; P252-S256 PolarHBondContact O-N 2.96Å
253	Q	75.8	Confident	68.1	Low	117 Å²	117	51.3 Å²	51.3	55%	0.547	27%	0.269	S	S	.	.	H	α-helix	trans	-67.7	-49.3	176.1	-171.6	177.3	3.9	0	0	112.6	V210 T251 M255 S256 I257	V210-Q253 HydrophobicContact CG1-CG 4.37Å; V210-Q253 HydrophobicContact CG2-CG 4.41Å; T251-Q253 PolarHBondContact O-N 3.38Å; T251-Q253 VanDerWaalsContact O-N 3.08Å; Q253-M255 VanDerWaalsContact C-N 3.28Å; Q253-M255 PolarHBondContact O-N 3.45Å; Q253-S256 WeakPolarHBondContact O-CB 3.41Å; Q253-S256 PolarHBondContact O-N 2.94Å; Q253-S256 VanDerWaalsContact O-N 3.17Å; Q253-I257 HydrophobicContact CG-CD1 4.17Å; Q253-I257 WeakPolarHBondContact O-CG1 3.34Å; Q253-I257 PolarHBondContact O-N 2.93Å
254	A	76.4	Confident	70.2	Confident	3 Å²	3	54 Å²	54	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-39.6	175.6	0	0	0	0	0	111	L213 T251 S256 I257 I258	L213-A254 HydrophobicContact CD2-CB 4.45Å; T251-A254 PolarHBondContact O-N 2.88Å; T251-A254 VanDerWaalsContact O-N 3.09Å; T251-A254 WeakPolarHBondContact OG1-CB 3.28Å; T251-A254 PolarHBondContact OG1-N 3.23Å; A254-S256 VanDerWaalsContact C-N 3.31Å; A254-S256 PolarHBondContact O-N 3.17Å; A254-I257 PolarHBondContact O-N 2.96Å; A254-I258 WeakPolarHBondContact O-CB 3.08Å; A254-I258 WeakPolarHBondContact O-CG1 3.3Å; A254-I258 PolarHBondContact O-N 3.42Å
255	M	77.9	Confident	72.3	Confident	41 Å²	41	53.3 Å²	53.3	20%	0.202	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-41.6	175.1	-63.9	-68.3	-82.9	0	0	111.8	T251 Q253 T259 F281 Y285	T251-M255 VanDerWaalsContact O-CG 3.25Å; T251-M255 WeakPolarHBondContact O-CG 3.45Å; T251-M255 PolarHBondContact O-N 3.03Å; Q253-M255 VanDerWaalsContact C-N 3.28Å; Q253-M255 PolarHBondContact O-N 3.45Å; M255-T259 VanDerWaalsContact O-CB 3.29Å; M255-T259 WeakPolarHBondContact O-CB 3.45Å; M255-T259 PolarHBondContact O-N 2.96Å; M255-T259 PolarHBondContact O-OG1 2.95Å; M255-F281 HydrophobicContact CE-CE1 3.82Å; M255-F281 HydrophobicContact CE-CE2 3.65Å; M255-F281 HydrophobicContact CE-CZ 3.1Å; M255-F281 HydrophobicContact SD-CD2 4.5Å; M255-F281 HydrophobicContact SD-CE2 3.39Å; M255-F281 WeakPolarHBondContact SD-CE2 3.48Å; M255-F281 HydrophobicContact SD-CZ 3.51Å; M255-F281 VanDerWaalsContact SD-CZ 3.51Å; M255-Y285 HydrophobicContact CE-CD1 4.2Å; M255-Y285 HydrophobicContact CE-CD2 3.74Å; M255-Y285 HydrophobicContact CE-CE1 4.16Å; M255-Y285 HydrophobicContact CE-CE2 3.71Å; M255-Y285 HydrophobicContact CE-CG 4.02Å; M255-Y285 HydrophobicContact SD-CD2 4.23Å; M255-Y285 HydrophobicContact SD-CE1 4.24Å; M255-Y285 HydrophobicContact SD-CE2 3.57Å; M255-Y285 VanDerWaalsContact SD-CE2 3.57Å; M255-Y285 VanDerWaalsContact SD-CZ 3.57Å
256	S	81.8	Confident	74.3	Confident	56 Å²	56	55.6 Å²	55.6	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-50.7	174.4	-172.4	0	0	0	0	111.5	P252 Q253 A254 I258 T259 Q260	P252-S256 WeakPolarHBondContact O-CB 3.34Å; P252-S256 PolarHBondContact O-N 2.96Å; Q253-S256 WeakPolarHBondContact O-CB 3.41Å; Q253-S256 PolarHBondContact O-N 2.94Å; Q253-S256 VanDerWaalsContact O-N 3.17Å; A254-S256 VanDerWaalsContact C-N 3.31Å; A254-S256 PolarHBondContact O-N 3.17Å; S256-I258 VanDerWaalsContact C-N 3.33Å; S256-I258 PolarHBondContact O-N 3.13Å; S256-T259 PolarHBondContact O-N 3.38Å; S256-Q260 WeakPolarHBondContact O-CB 3.4Å; S256-Q260 VanDerWaalsContact O-CG 3.28Å; S256-Q260 WeakPolarHBondContact O-CG 3.46Å; S256-Q260 PolarHBondContact O-N 3.31Å; S256-Q260 PolarHBondContact OG-NE2 2.91Å
257	I	83.6	Confident	76	Confident	24 Å²	24	55 Å²	55	12%	0.123	31%	0.307	C	S	.	.	H	α-helix	trans	-60.2	-43.2	-179.8	-65.9	166.9	0	0	0	111.1	V210 L213 E214 I217 Q253 A254 Q260 F261	V210-I257 HydrophobicContact CG1-CD1 3.72Å; L213-I257 HydrophobicContact CD2-CB 3.84Å; L213-I257 HydrophobicContact CD2-CG2 3.51Å; L213-I257 HydrophobicContact CG-CG2 4.02Å; E214-I257 HydrophobicContact CG-CD1 4.19Å; I217-I257 HydrophobicContact CD1-CG2 3.57Å; Q253-I257 HydrophobicContact CG-CD1 4.17Å; Q253-I257 WeakPolarHBondContact O-CG1 3.34Å; Q253-I257 PolarHBondContact O-N 2.93Å; A254-I257 PolarHBondContact O-N 2.96Å; I257-Q260 PolarHBondContact O-N 3.24Å; I257-F261 WeakPolarHBondContact O-CB 3.39Å; I257-F261 PolarHBondContact O-N 3.28Å
258	I	82.6	Confident	77.6	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-68.5	-40.2	179.6	-66.7	174.9	0	0	0	110.9	L213 L248 A254 S256 F261 I262 L277 F281	L213-I258 HydrophobicContact CD1-CD1 4.37Å; L213-I258 HydrophobicContact CD1-CG1 4.08Å; L213-I258 HydrophobicContact CD2-CD1 4.01Å; L213-I258 HydrophobicContact CD2-CG1 3.57Å; L213-I258 HydrophobicContact CG-CG1 4.45Å; L248-I258 HydrophobicContact CB-CD1 4.45Å; L248-I258 HydrophobicContact CD1-CD1 4.24Å; L248-I258 HydrophobicContact CD2-CD1 3.19Å; L248-I258 HydrophobicContact CD2-CG1 4.46Å; L248-I258 HydrophobicContact CD2-CG2 4.27Å; L248-I258 HydrophobicContact CG-CD1 3.34Å; A254-I258 WeakPolarHBondContact O-CB 3.08Å; A254-I258 WeakPolarHBondContact O-CG1 3.3Å; A254-I258 PolarHBondContact O-N 3.42Å; S256-I258 VanDerWaalsContact C-N 3.33Å; S256-I258 PolarHBondContact O-N 3.13Å; I258-F261 PolarHBondContact O-N 3.15Å; I258-I262 HydrophobicContact CG2-CD1 4.04Å; I258-I262 HydrophobicContact CG2-CG1 4.47Å; I258-I262 VanDerWaalsContact O-CG1 3.25Å; I258-I262 WeakPolarHBondContact O-CG1 3.46Å; I258-I262 PolarHBondContact O-N 3.39Å; I258-L277 HydrophobicContact CG2-CD1 4.1Å; I258-L277 HydrophobicContact CG2-CD2 4.28Å; I258-L277 HydrophobicContact CG2-CG 4.24Å; I258-F281 HydrophobicContact CB-CE2 4.43Å; I258-F281 HydrophobicContact CG2-CD2 3.88Å; I258-F281 HydrophobicContact CG2-CE2 3.99Å
259	T	83.6	Confident	79.1	Confident	56 Å²	56	60.5 Å²	60.5	34%	0.344	35%	0.346	S	S	.	.	H	α-helix	trans	-63.7	-43.8	175.9	-57.2	0	0	0	0	110.9	M255 S256 I262 Q263	M255-T259 VanDerWaalsContact O-CB 3.29Å; M255-T259 WeakPolarHBondContact O-CB 3.45Å; M255-T259 PolarHBondContact O-N 2.96Å; M255-T259 PolarHBondContact O-OG1 2.95Å; S256-T259 PolarHBondContact O-N 3.38Å; T259-I262 PolarHBondContact O-N 3.12Å; T259-Q263 WeakPolarHBondContact O-CG 3.48Å; T259-Q263 PolarHBondContact O-N 3.35Å
260	Q	86.2	Confident	80.2	Confident	113 Å²	113	58.6 Å²	58.6	53%	0.528	34%	0.337	S	S	.	.	H	α-helix	trans	-61.7	-43	174.6	-72.4	174.1	6	0	0	111.5	S256 I257 Q263 Q264	S256-Q260 WeakPolarHBondContact O-CB 3.4Å; S256-Q260 VanDerWaalsContact O-CG 3.28Å; S256-Q260 WeakPolarHBondContact O-CG 3.46Å; S256-Q260 PolarHBondContact O-N 3.31Å; S256-Q260 PolarHBondContact OG-NE2 2.91Å; I257-Q260 PolarHBondContact O-N 3.24Å; Q260-Q263 WeakPolarHBondContact O-CB 3.43Å; Q260-Q263 PolarHBondContact O-N 3.29Å; Q260-Q264 WeakPolarHBondContact O-CB 3.38Å; Q260-Q264 PolarHBondContact O-N 3.41Å
261	F	85.8	Confident	81.1	Confident	10 Å²	10	59 Å²	59	4%	0.044	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-39.6	176.9	-175.1	-125	0	0	0	112.3	I217 F220 H221 F244 I257 I258 Q263 Q264 L265 L277	I217-F261 HydrophobicContact CD1-CB 4Å; I217-F261 HydrophobicContact CD1-CD1 4.34Å; I217-F261 HydrophobicContact CD1-CD2 4.3Å; I217-F261 HydrophobicContact CD1-CG 3.97Å; I217-F261 HydrophobicContact CG1-CD1 4.14Å; I217-F261 HydrophobicContact CG1-CD2 4.07Å; I217-F261 HydrophobicContact CG1-CE1 4.32Å; I217-F261 HydrophobicContact CG1-CE2 4.27Å; I217-F261 HydrophobicContact CG1-CG 4.01Å; I217-F261 HydrophobicContact CG1-CZ 4.4Å; I217-F261 HydrophobicContact CG2-CD2 3.83Å; I217-F261 HydrophobicContact CG2-CE2 3.92Å; F220-F261 HydrophobicContact CD1-CE2 4Å; F220-F261 AromaticContact CD1-CZ 3.65Å; F220-F261 HydrophobicContact CD1-CZ 3.65Å; F220-F261 HydrophobicContact CE1-CE2 4.37Å; F220-F261 AromaticContact CE1-CZ 3.96Å; F220-F261 HydrophobicContact CE1-CZ 3.96Å; F220-F261 HydrophobicContact CG-CZ 4.11Å; H221-F261 AromaticContact NE2-CE2 3.74Å; F244-F261 HydrophobicContact CE1-CE1 4.17Å; I257-F261 WeakPolarHBondContact O-CB 3.39Å; I257-F261 PolarHBondContact O-N 3.28Å; I258-F261 PolarHBondContact O-N 3.15Å; F261-Q263 VanDerWaalsContact C-N 3.32Å; F261-Q263 PolarHBondContact O-N 2.94Å; F261-Q264 PolarHBondContact O-N 3.17Å; F261-L265 HydrophobicContact CD1-CD1 4.02Å; F261-L265 HydrophobicContact CD2-CG 4.42Å; F261-L265 HydrophobicContact CE1-CD1 3.71Å; F261-L265 HydrophobicContact CE1-CG 4.29Å; F261-L265 HydrophobicContact CE2-CD1 4.43Å; F261-L265 HydrophobicContact CE2-CD2 4.18Å; F261-L265 HydrophobicContact CE2-CG 4.12Å; F261-L265 HydrophobicContact CZ-CD1 3.93Å; F261-L265 HydrophobicContact CZ-CD2 4.01Å; F261-L265 HydrophobicContact CZ-CG 4.05Å; F261-L265 VanDerWaalsContact O-CG 3.29Å; F261-L265 WeakPolarHBondContact O-CG 3.47Å; F261-L265 PolarHBondContact O-N 3.09Å; F261-L277 HydrophobicContact CD1-CD2 3.64Å; F261-L277 HydrophobicContact CE1-CD2 4.13Å
262	I	84.2	Confident	81.6	Confident	18 Å²	18	59.1 Å²	59.1	9%	0.092	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-44.8	171.5	-68.8	166	0	0	0	110.3	I258 T259 Q264 L265 I266 L277 R278	I258-I262 HydrophobicContact CG2-CD1 4.04Å; I258-I262 HydrophobicContact CG2-CG1 4.47Å; I258-I262 VanDerWaalsContact O-CG1 3.25Å; I258-I262 WeakPolarHBondContact O-CG1 3.46Å; I258-I262 PolarHBondContact O-N 3.39Å; T259-I262 PolarHBondContact O-N 3.12Å; I262-Q264 VanDerWaalsContact C-N 3.35Å; I262-L265 PolarHBondContact O-N 2.97Å; I262-I266 HydrophobicContact CG2-CD1 3.9Å; I262-I266 VanDerWaalsContact O-CG1 3.25Å; I262-I266 WeakPolarHBondContact O-CG1 3.44Å; I262-I266 PolarHBondContact O-N 3.08Å; I262-L277 HydrophobicContact CD1-CD2 4.21Å; I262-L277 HydrophobicContact CD1-CG 3.94Å; I262-L277 HydrophobicContact CG1-CB 4.18Å; I262-L277 HydrophobicContact CG1-CD2 3.39Å; I262-L277 HydrophobicContact CG1-CG 3.62Å; I262-R278 HydrophobicContact CD1-CB 4.49Å
263	Q	84.3	Confident	81.8	Confident	120 Å²	120	55.8 Å²	55.8	56%	0.561	31%	0.313	S	S	*	.	H	α-helix	trans	-62.5	-42.3	177.7	-72.7	172.4	-14.2	0	0	111.7	T259 Q260 F261 I266 A267	T259-Q263 WeakPolarHBondContact O-CG 3.48Å; T259-Q263 PolarHBondContact O-N 3.35Å; Q260-Q263 WeakPolarHBondContact O-CB 3.43Å; Q260-Q263 PolarHBondContact O-N 3.29Å; F261-Q263 VanDerWaalsContact C-N 3.32Å; F261-Q263 PolarHBondContact O-N 2.94Å; Q263-I266 PolarHBondContact O-N 2.97Å; Q263-A267 PolarHBondContact O-N 3.49Å
264	Q	85.6	Confident	81.9	Confident	75 Å²	75	50.5 Å²	50.5	35%	0.35	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-45.4	176	-170.7	-177.7	-10	0	0	111.6	H221 Q260 F261 I262 I266 A267 E268	H221-Q264 PolarHBondContact CE1-NE2 3.4Å; H221-Q264 PolarHBondContact CE1-OE1 3.2Å; H221-Q264 PolarHBondContact NE2-NE2 2.95Å; Q260-Q264 WeakPolarHBondContact O-CB 3.38Å; Q260-Q264 PolarHBondContact O-N 3.41Å; F261-Q264 PolarHBondContact O-N 3.17Å; I262-Q264 VanDerWaalsContact C-N 3.35Å; Q264-I266 VanDerWaalsContact C-N 3.26Å; Q264-I266 PolarHBondContact O-N 3.16Å; Q264-A267 PolarHBondContact O-N 2.48Å; Q264-A267 VanDerWaalsContact O-N 3.13Å; Q264-E268 HydrophobicContact CG-CG 4.47Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.38Å; Q264-E268 PolarHBondContact NE2-OE1 3.1Å; Q264-E268 WeakPolarHBondContact O-CB 3.26Å; Q264-E268 WeakPolarHBondContact O-CG 3.49Å; Q264-E268 PolarHBondContact O-N 3.46Å
265	L	83.8	Confident	82	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-35.2	175.6	-71.5	171.8	0	0	0	112.5	F220 F261 I262 G269 K270 W273 A274 L277	F220-L265 HydrophobicContact CE1-CD2 3.68Å; F220-L265 HydrophobicContact CZ-CD2 4.01Å; F261-L265 HydrophobicContact CD1-CD1 4.02Å; F261-L265 HydrophobicContact CD2-CG 4.42Å; F261-L265 HydrophobicContact CE1-CD1 3.71Å; F261-L265 HydrophobicContact CE1-CG 4.29Å; F261-L265 HydrophobicContact CE2-CD1 4.43Å; F261-L265 HydrophobicContact CE2-CD2 4.18Å; F261-L265 HydrophobicContact CE2-CG 4.12Å; F261-L265 HydrophobicContact CZ-CD1 3.93Å; F261-L265 HydrophobicContact CZ-CD2 4.01Å; F261-L265 HydrophobicContact CZ-CG 4.05Å; F261-L265 VanDerWaalsContact O-CG 3.29Å; F261-L265 WeakPolarHBondContact O-CG 3.47Å; F261-L265 PolarHBondContact O-N 3.09Å; I262-L265 PolarHBondContact O-N 2.97Å; L265-G269 PolarHBondContact O-N 3.01Å; L265-K270 HydrophobicContact CB-CB 4.42Å; L265-K270 HydrophobicContact CD2-CB 4.02Å; L265-K270 HydrophobicContact CD2-CD 4.01Å; L265-K270 CarbonylContact O-C 3.6Å; L265-K270 WeakPolarHBondContact O-CA 3.17Å; L265-K270 WeakPolarHBondContact O-CB 3.16Å; L265-K270 PolarHBondContact O-N 2.93Å; L265-W273 HydrophobicContact CD1-CB 3.89Å; L265-W273 HydrophobicContact CD2-CB 4.12Å; L265-A274 HydrophobicContact CB-CB 3.98Å; L265-L277 HydrophobicContact CD1-CD2 4.22Å
266	I	83.6	Confident	81.9	Confident	83 Å²	83	58.5 Å²	58.5	43%	0.426	33%	0.325	S	S	.	.	H	α-helix	trans	-68.2	-45.8	174.5	-67.2	165.1	0	0	0	110.3	I262 Q263 Q264 E268 G269 L271 A274	I262-I266 HydrophobicContact CG2-CD1 3.9Å; I262-I266 VanDerWaalsContact O-CG1 3.25Å; I262-I266 WeakPolarHBondContact O-CG1 3.44Å; I262-I266 PolarHBondContact O-N 3.08Å; Q263-I266 PolarHBondContact O-N 2.97Å; Q264-I266 VanDerWaalsContact C-N 3.26Å; Q264-I266 PolarHBondContact O-N 3.16Å; I266-E268 VanDerWaalsContact C-N 3.3Å; I266-E268 PolarHBondContact O-N 3.15Å; I266-G269 PolarHBondContact O-N 2.81Å; I266-G269 VanDerWaalsContact O-N 3.09Å; I266-L271 HydrophobicContact CG2-CD2 4.43Å; I266-A274 HydrophobicContact CD1-CB 4.41Å; I266-A274 HydrophobicContact CG1-CB 3.61Å
267	A	84.5	Confident	81.7	Confident	89 Å²	89	56.2 Å²	56.2	74%	0.736	31%	0.308	S	S	*	.	H	α-helix	trans	-62.9	-35.6	178.9	0	0	0	0	0	112.5	Q263 Q264 G269	Q263-A267 PolarHBondContact O-N 3.49Å; Q264-A267 PolarHBondContact O-N 2.48Å; Q264-A267 VanDerWaalsContact O-N 3.13Å; A267-G269 PolarHBondContact O-N 3.16Å
268	E	85.1	Confident	81.5	Confident	77 Å²	77	62.6 Å²	62.6	36%	0.36	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	2.4	176	-68.3	175.6	-170.4	0	0	113.6	Q264 I266 K270	Q264-E268 HydrophobicContact CG-CG 4.47Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.38Å; Q264-E268 PolarHBondContact NE2-OE1 3.1Å; Q264-E268 WeakPolarHBondContact O-CB 3.26Å; Q264-E268 WeakPolarHBondContact O-CG 3.49Å; Q264-E268 PolarHBondContact O-N 3.46Å; I266-E268 VanDerWaalsContact C-N 3.3Å; I266-E268 PolarHBondContact O-N 3.15Å; E268-K270 HydrophobicContact CB-CG 4.47Å; E268-K270 PolarHBondContact O-N 3.35Å; E268-K270 IonicContact OE2-NZ 3.61Å; E268-K270 PolarHBondContact OE2-NZ 3.44Å
269	G	82	Confident	81.1	Confident	52 Å²	52	66.8 Å²	66.8	54%	0.536	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	7.1	-179.8	0	0	0	0	0	115	L265 I266 A267 L271	L265-G269 PolarHBondContact O-N 3.01Å; I266-G269 PolarHBondContact O-N 2.81Å; I266-G269 VanDerWaalsContact O-N 3.09Å; A267-G269 PolarHBondContact O-N 3.16Å; G269-L271 PolarHBondContact O-N 3.43Å
270	K	79.6	Confident	80.5	Confident	23 Å²	23	67.8 Å²	67.8	10%	0.1	35%	0.35	C	S	.	.			trans	-82.1	55.8	-179.9	-70.8	-176.6	-161.5	145.5	0	112.3	F220 L224 L265 E268 A272 W273 A274	F220-K270 HydrophobicContact CE1-CD 4.42Å; F220-K270 HydrophobicContact CZ-CD 4.4Å; L224-K270 HydrophobicContact CD1-CD 4.3Å; L224-K270 VanDerWaalsContact CD1-CE 3.43Å; L265-K270 HydrophobicContact CB-CB 4.42Å; L265-K270 HydrophobicContact CD2-CB 4.02Å; L265-K270 HydrophobicContact CD2-CD 4.01Å; L265-K270 CarbonylContact O-C 3.6Å; L265-K270 WeakPolarHBondContact O-CA 3.17Å; L265-K270 WeakPolarHBondContact O-CB 3.16Å; L265-K270 PolarHBondContact O-N 2.93Å; E268-K270 HydrophobicContact CB-CG 4.47Å; E268-K270 PolarHBondContact O-N 3.35Å; E268-K270 IonicContact OE2-NZ 3.61Å; E268-K270 PolarHBondContact OE2-NZ 3.44Å; K270-A272 VanDerWaalsContact C-N 3.25Å; K270-A272 PolarHBondContact O-N 3.03Å; K270-W273 PolarHBondContact O-N 3.24Å; K270-W273 VanDerWaalsContact O-N 3.14Å; K270-A274 PolarHBondContact O-N 2.86Å; K270-A274 VanDerWaalsContact O-N 3.1Å
271	L	79.3	Confident	79.7	Confident	111 Å²	111	64.1 Å²	64.1	58%	0.581	33%	0.332	S	S	*	.	H	α-helix	trans	-61.4	-30.4	-170.7	-58	178.9	0	0	0	113.5	I266 G269 K275	I266-L271 HydrophobicContact CG2-CD2 4.43Å; G269-L271 PolarHBondContact O-N 3.43Å; L271-K275 WeakPolarHBondContact O-CB 3.37Å; L271-K275 PolarHBondContact O-N 3.48Å
272	A	77.6	Confident	78.9	Confident	51 Å²	51	67.5 Å²	67.5	42%	0.421	35%	0.354	S	S	.	.	H	α-helix	trans	-67.2	-41.1	178.5	0	0	0	0	0	112.2	F233 K270 L276	F233-A272 HydrophobicContact CE2-CB 3.5Å; F233-A272 HydrophobicContact CZ-CB 3.92Å; K270-A272 VanDerWaalsContact C-N 3.25Å; K270-A272 PolarHBondContact O-N 3.03Å; A272-L276 WeakPolarHBondContact O-CB 3.44Å; A272-L276 PolarHBondContact O-N 3.05Å
273	W	73.9	Confident	78	Confident	45 Å²	45	71.4 Å²	71.4	17%	0.17	37%	0.372	C	S	.	.	H	α-helix	trans	-68	-46.3	174.7	-64.2	103	0	0	0	111.4	F220 F233 F236 L265 K270 K275 L276 L277	F220-W273 HydrophobicContact CE2-CD2 4.21Å; F220-W273 HydrophobicContact CE2-CE3 4.36Å; F220-W273 HydrophobicContact CE2-CH2 4.41Å; F220-W273 HydrophobicContact CE2-CZ2 4.31Å; F220-W273 HydrophobicContact CE2-CZ3 4.46Å; F220-W273 HydrophobicContact CZ-CD2 4.27Å; F220-W273 HydrophobicContact CZ-CG 4.34Å; F233-W273 HydrophobicContact CD2-CZ2 4.41Å; F236-W273 HydrophobicContact CB-CH2 3.39Å; F236-W273 HydrophobicContact CB-CZ3 3.63Å; F236-W273 HydrophobicContact CD1-CH2 4.01Å; F236-W273 AromaticContact CD1-CZ3 3.71Å; F236-W273 HydrophobicContact CD1-CZ3 3.71Å; F236-W273 AromaticContact CD2-CH2 3.61Å; F236-W273 HydrophobicContact CD2-CH2 3.61Å; F236-W273 HydrophobicContact CD2-CZ3 4.18Å; F236-W273 HydrophobicContact CE1-CZ3 4.38Å; F236-W273 HydrophobicContact CE2-CH2 4.34Å; F236-W273 AromaticContact CG-CH2 3.4Å; F236-W273 HydrophobicContact CG-CH2 3.4Å; F236-W273 VanDerWaalsContact CG-CH2 3.4Å; F236-W273 AromaticContact CG-CZ3 3.58Å; F236-W273 HydrophobicContact CG-CZ3 3.58Å; L265-W273 HydrophobicContact CD1-CB 3.89Å; L265-W273 HydrophobicContact CD2-CB 4.12Å; K270-W273 PolarHBondContact O-N 3.24Å; K270-W273 VanDerWaalsContact O-N 3.14Å; W273-K275 VanDerWaalsContact C-N 3.3Å; W273-K275 PolarHBondContact O-N 3.46Å; W273-L276 PolarHBondContact O-N 2.98Å; W273-L277 WeakPolarHBondContact O-CB 3.46Å; W273-L277 PolarHBondContact O-N 2.93Å
274	A	79.2	Confident	77	Confident	6 Å²	6	70.9 Å²	70.9	5%	0.05	37%	0.368	C	S	.	.	H	α-helix	trans	-58.5	-42.8	176.2	0	0	0	0	0	111.7	L265 I266 K270 R278	L265-A274 HydrophobicContact CB-CB 3.98Å; I266-A274 HydrophobicContact CD1-CB 4.41Å; I266-A274 HydrophobicContact CG1-CB 3.61Å; K270-A274 PolarHBondContact O-N 2.86Å; K270-A274 VanDerWaalsContact O-N 3.1Å; A274-R278 WeakPolarHBondContact O-CB 3.12Å; A274-R278 PolarHBondContact O-N 3.19Å
275	K	77.8	Confident	75.8	Confident	153 Å²	153	70.5 Å²	70.5	67%	0.665	36%	0.363	S	S	*	.	H	α-helix	trans	-65.4	-45.7	177.3	-174.8	176.5	179.4	178.6	0	111.8	L271 W273 R278 Q279	L271-K275 WeakPolarHBondContact O-CB 3.37Å; L271-K275 PolarHBondContact O-N 3.48Å; W273-K275 VanDerWaalsContact C-N 3.3Å; W273-K275 PolarHBondContact O-N 3.46Å; K275-R278 PolarHBondContact O-N 3.44Å; K275-Q279 VanDerWaalsContact O-CB 3.24Å; K275-Q279 WeakPolarHBondContact O-CB 3.45Å; K275-Q279 PolarHBondContact O-N 2.96Å
276	L	75.2	Confident	74.3	Confident	58 Å²	58	72.6 Å²	72.6	30%	0.304	39%	0.386	S	S	.	.	H	α-helix	trans	-61.6	-46.7	178.9	-173.2	73.2	0	0	0	111.2	F245 A272 W273 Q279 K280	F245-L276 HydrophobicContact CE2-CD2 3.79Å; F245-L276 HydrophobicContact CE2-CG 4.26Å; F245-L276 HydrophobicContact CZ-CD2 3.64Å; F245-L276 HydrophobicContact CZ-CG 3.88Å; A272-L276 WeakPolarHBondContact O-CB 3.44Å; A272-L276 PolarHBondContact O-N 3.05Å; W273-L276 PolarHBondContact O-N 2.98Å; L276-Q279 PolarHBondContact O-N 3.49Å; L276-K280 WeakPolarHBondContact O-CG 3.28Å; L276-K280 PolarHBondContact O-N 3.21Å
277	L	78.1	Confident	72.4	Confident	8 Å²	8	76 Å²	76	4%	0.042	41%	0.405	C	S	.	.	H	α-helix	trans	-66.7	-44.3	179.1	-176.3	60.9	0	0	0	111.6	F245 I258 F261 I262 L265 W273 K280 F281	F245-L277 HydrophobicContact CD1-CD1 3.77Å; F245-L277 HydrophobicContact CE1-CB 3.94Å; F245-L277 HydrophobicContact CE1-CD1 3.42Å; F245-L277 VanDerWaalsContact CE1-CD1 3.42Å; F245-L277 HydrophobicContact CE1-CG 4.26Å; I258-L277 HydrophobicContact CG2-CD1 4.1Å; I258-L277 HydrophobicContact CG2-CD2 4.28Å; I258-L277 HydrophobicContact CG2-CG 4.24Å; F261-L277 HydrophobicContact CD1-CD2 3.64Å; F261-L277 HydrophobicContact CE1-CD2 4.13Å; I262-L277 HydrophobicContact CD1-CD2 4.21Å; I262-L277 HydrophobicContact CD1-CG 3.94Å; I262-L277 HydrophobicContact CG1-CB 4.18Å; I262-L277 HydrophobicContact CG1-CD2 3.39Å; I262-L277 HydrophobicContact CG1-CG 3.62Å; L265-L277 HydrophobicContact CD1-CD2 4.22Å; W273-L277 WeakPolarHBondContact O-CB 3.46Å; W273-L277 PolarHBondContact O-N 2.93Å; L277-K280 PolarHBondContact O-N 3.36Å; L277-F281 VanDerWaalsContact O-CB 3.27Å; L277-F281 WeakPolarHBondContact O-CB 3.34Å; L277-F281 PolarHBondContact O-N 3.39Å
278	R	78.8	Confident	70	Confident	159 Å²	159	79.7 Å²	79.7	60%	0.6	41%	0.411	S	S	*	.	H	α-helix	trans	-63.2	-42.3	175.1	-173.8	175.9	-179.1	-176.6	0.8	112.3	I262 A274 K275 F281 V282	I262-R278 HydrophobicContact CD1-CB 4.49Å; A274-R278 WeakPolarHBondContact O-CB 3.12Å; A274-R278 PolarHBondContact O-N 3.19Å; K275-R278 PolarHBondContact O-N 3.44Å; R278-F281 WeakPolarHBondContact O-CB 3.31Å; R278-F281 PolarHBondContact O-N 3.41Å; R278-V282 HydrophobicContact CG-CG2 4.33Å; R278-V282 VanDerWaalsContact O-CG2 3.3Å; R278-V282 WeakPolarHBondContact O-CG2 3.47Å; R278-V282 PolarHBondContact O-N 3.26Å
279	Q	75.6	Confident	67.5	Low	93 Å²	93	84.5 Å²	84.5	44%	0.435	44%	0.438	S	S	.	.	H	α-helix	trans	-59.9	-48.6	177	178.2	-179.4	-6	0	0	110.7	K275 L276 F281 V282 E283	K275-Q279 VanDerWaalsContact O-CB 3.24Å; K275-Q279 WeakPolarHBondContact O-CB 3.45Å; K275-Q279 PolarHBondContact O-N 2.96Å; L276-Q279 PolarHBondContact O-N 3.49Å; Q279-F281 VanDerWaalsContact C-N 3.3Å; Q279-F281 PolarHBondContact O-N 3.5Å; Q279-V282 PolarHBondContact O-N 3.2Å; Q279-E283 HydrophobicContact CG-CG 4.39Å; Q279-E283 VanDerWaalsContact CG-OE1 3.3Å; Q279-E283 WeakPolarHBondContact CG-OE1 3.33Å; Q279-E283 PolarHBondContact NE2-OE1 3.01Å; Q279-E283 WeakPolarHBondContact O-CB 3.5Å; Q279-E283 WeakPolarHBondContact O-CG 3.36Å; Q279-E283 PolarHBondContact O-N 3Å
280	K	69.5	Low	65.2	Low	76 Å²	76	86.8 Å²	86.8	33%	0.33	45%	0.452	S	S	.	.	H	α-helix	trans	-64.2	-36.1	178.5	-71.9	-72.3	158.4	-149.6	0	112.7	F245 L276 L277 E283 K284	F245-K280 HydrophobicContact CD1-CB 3.9Å; F245-K280 HydrophobicContact CD1-CG 4.03Å; F245-K280 HydrophobicContact CE1-CB 4.45Å; F245-K280 HydrophobicContact CE1-CG 4.43Å; F245-K280 HydrophobicContact CG-CB 4.37Å; F245-K280 HydrophobicContact CG-CG 4.15Å; L276-K280 WeakPolarHBondContact O-CG 3.28Å; L276-K280 PolarHBondContact O-N 3.21Å; L277-K280 PolarHBondContact O-N 3.36Å; K280-E283 IonicContact NZ-OE2 3.26Å; K280-E283 PolarHBondContact NZ-OE2 3.31Å; K280-K284 WeakPolarHBondContact O-CB 3.47Å; K280-K284 PolarHBondContact O-N 3.44Å
281	F	71.1	Confident	62.9	Low	36 Å²	36	90.5 Å²	90.5	16%	0.158	48%	0.48	C	S	.	.	H	α-helix	trans	-64.2	-48.9	174.3	-165.4	-95	0	0	0	111.5	L248 M255 I258 L277 R278 Q279 K284 Y285	L248-F281 HydrophobicContact CD2-CD2 3.62Å; L248-F281 HydrophobicContact CD2-CE2 4.07Å; M255-F281 HydrophobicContact CE-CE1 3.82Å; M255-F281 HydrophobicContact CE-CE2 3.65Å; M255-F281 HydrophobicContact CE-CZ 3.1Å; M255-F281 HydrophobicContact SD-CD2 4.5Å; M255-F281 HydrophobicContact SD-CE2 3.39Å; M255-F281 WeakPolarHBondContact SD-CE2 3.48Å; M255-F281 HydrophobicContact SD-CZ 3.51Å; M255-F281 VanDerWaalsContact SD-CZ 3.51Å; I258-F281 HydrophobicContact CB-CE2 4.43Å; I258-F281 HydrophobicContact CG2-CD2 3.88Å; I258-F281 HydrophobicContact CG2-CE2 3.99Å; L277-F281 VanDerWaalsContact O-CB 3.27Å; L277-F281 WeakPolarHBondContact O-CB 3.34Å; L277-F281 PolarHBondContact O-N 3.39Å; R278-F281 WeakPolarHBondContact O-CB 3.31Å; R278-F281 PolarHBondContact O-N 3.41Å; Q279-F281 VanDerWaalsContact C-N 3.3Å; Q279-F281 PolarHBondContact O-N 3.5Å; F281-K284 PolarHBondContact O-N 3.14Å; F281-Y285 HydrophobicContact CD1-CD2 4.02Å; F281-Y285 AromaticContact CD2-CD2 4Å; F281-Y285 HydrophobicContact CD2-CD2 4Å; F281-Y285 AromaticContact CD2-CE2 3.83Å; F281-Y285 HydrophobicContact CD2-CE2 3.83Å; F281-Y285 HydrophobicContact CE1-CD2 4.11Å; F281-Y285 HydrophobicContact CE2-CD2 4.09Å; F281-Y285 AromaticContact CE2-CE2 3.84Å; F281-Y285 HydrophobicContact CE2-CE2 3.84Å; F281-Y285 AromaticContact CG-CD2 3.99Å; F281-Y285 HydrophobicContact CG-CD2 3.99Å; F281-Y285 HydrophobicContact CG-CE2 4.28Å; F281-Y285 HydrophobicContact CZ-CD2 4.17Å; F281-Y285 HydrophobicContact CZ-CE2 4.31Å; F281-Y285 WeakPolarHBondContact O-CD2 3.29Å; F281-Y285 PolarHBondContact O-N 3.18Å
282	V	68.2	Low	61.1	Low	82 Å²	82	91.5 Å²	91.5	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-42.2	179.5	174	0	0	0	0	111.9	R278 Q279 K284 Y285 G286	R278-V282 HydrophobicContact CG-CG2 4.33Å; R278-V282 VanDerWaalsContact O-CG2 3.3Å; R278-V282 WeakPolarHBondContact O-CG2 3.47Å; R278-V282 PolarHBondContact O-N 3.26Å; Q279-V282 PolarHBondContact O-N 3.2Å; V282-K284 PolarHBondContact O-N 3.44Å; V282-Y285 PolarHBondContact O-N 3.28Å; V282-G286 WeakPolarHBondContact O-CA 3.47Å; V282-G286 PolarHBondContact O-N 3.01Å
283	E	66	Low	59.1	Low	100 Å²	100	91.3 Å²	91.3	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-55.4	-35.2	174.5	-77.9	171.8	-172.1	0	0	111.9	Q279 K280	Q279-E283 HydrophobicContact CG-CG 4.39Å; Q279-E283 VanDerWaalsContact CG-OE1 3.3Å; Q279-E283 WeakPolarHBondContact CG-OE1 3.33Å; Q279-E283 PolarHBondContact NE2-OE1 3.01Å; Q279-E283 WeakPolarHBondContact O-CB 3.5Å; Q279-E283 WeakPolarHBondContact O-CG 3.36Å; Q279-E283 PolarHBondContact O-N 3Å; K280-E283 IonicContact NZ-OE2 3.26Å; K280-E283 PolarHBondContact NZ-OE2 3.31Å
284	K	62	Low	57.6	Low	109 Å²	109	99.4 Å²	99.4	47%	0.474	54%	0.536	S	S	.	.	H	α-helix	trans	-81.7	-33.1	-178.8	-169.8	166.8	-173.8	169.9	0	113.7	L248 K280 F281 V282	L248-K284 HydrophobicContact CB-CD 4.37Å; L248-K284 WeakPolarHBondContact O-CE 3.46Å; L248-K284 PolarHBondContact O-NZ 3.46Å; K280-K284 WeakPolarHBondContact O-CB 3.47Å; K280-K284 PolarHBondContact O-N 3.44Å; F281-K284 PolarHBondContact O-N 3.14Å; V282-K284 PolarHBondContact O-N 3.44Å
285	Y	61.2	Low	56.5	Low	67 Å²	67	103.9 Å²	103.9	26%	0.263	56%	0.558	S	S	.	*	H	α-helix	trans	-117.1	-7.9	-170	-59.8	-65.6	0	0	0	115.6	L248 T250 M255 F281 V282 N287	L248-Y285 HydrophobicContact CD2-CE2 4.22Å; T250-Y285 HydrophobicContact CG2-CD1 4.29Å; T250-Y285 HydrophobicContact CG2-CE1 3.55Å; M255-Y285 HydrophobicContact CE-CD1 4.2Å; M255-Y285 HydrophobicContact CE-CD2 3.74Å; M255-Y285 HydrophobicContact CE-CE1 4.16Å; M255-Y285 HydrophobicContact CE-CE2 3.71Å; M255-Y285 HydrophobicContact CE-CG 4.02Å; M255-Y285 HydrophobicContact SD-CD2 4.23Å; M255-Y285 HydrophobicContact SD-CE1 4.24Å; M255-Y285 HydrophobicContact SD-CE2 3.57Å; M255-Y285 VanDerWaalsContact SD-CE2 3.57Å; M255-Y285 VanDerWaalsContact SD-CZ 3.57Å; F281-Y285 HydrophobicContact CD1-CD2 4.02Å; F281-Y285 AromaticContact CD2-CD2 4Å; F281-Y285 HydrophobicContact CD2-CD2 4Å; F281-Y285 AromaticContact CD2-CE2 3.83Å; F281-Y285 HydrophobicContact CD2-CE2 3.83Å; F281-Y285 HydrophobicContact CE1-CD2 4.11Å; F281-Y285 HydrophobicContact CE2-CD2 4.09Å; F281-Y285 AromaticContact CE2-CE2 3.84Å; F281-Y285 HydrophobicContact CE2-CE2 3.84Å; F281-Y285 AromaticContact CG-CD2 3.99Å; F281-Y285 HydrophobicContact CG-CD2 3.99Å; F281-Y285 HydrophobicContact CG-CE2 4.28Å; F281-Y285 HydrophobicContact CZ-CD2 4.17Å; F281-Y285 HydrophobicContact CZ-CE2 4.31Å; F281-Y285 WeakPolarHBondContact O-CD2 3.29Å; F281-Y285 PolarHBondContact O-N 3.18Å; V282-Y285 PolarHBondContact O-N 3.28Å; Y285-N287 PolarHBondContact O-N 3.33Å
286	G	51.1	Low	55.9	Low	47 Å²	47	99.6 Å²	99.6	49%	0.485	55%	0.546	S	S	.	.			trans	-80.8	-6.7	-168.3	0	0	0	0	0	117.6	V282	V282-G286 WeakPolarHBondContact O-CA 3.47Å; V282-G286 PolarHBondContact O-N 3.01Å
287	N	44.1	Very low	56.1	Low	154 Å²	154	99.2 Å²	99.2	82%	0.824	55%	0.549	S	S	*	.			trans	-113.2	89.2	-171.7	-67.9	-23.9	0	0	0	112.2	Y285	Y285-N287 PolarHBondContact O-N 3.33Å
288	L	34.4	Very low	56.3	Low	167 Å²	167	99 Å²	99	87%	0.874	55%	0.547	S	S	*	.			trans	-142.9	92.5	165.7	-148.3	88.8	0	0	0	109.2
289	L	32.1	Very low	56.7	Low	177 Å²	177	93.5 Å²	93.5	93%	0.927	53%	0.53	S	S	*	.			trans	-136.5	132.9	176.2	-72.9	175.4	0	0	0	111.8
290	A	34.4	Very low	57.3	Low	101 Å²	101	94.4 Å²	94.4	84%	0.835	54%	0.538	S	S	*	.			trans	-105.6	152.6	-177.5	0	0	0	0	0	111.5
291	C	31.1	Very low	58.4	Low	100 Å²	100	95 Å²	95	68%	0.676	54%	0.54	S	S	*	.			trans	-132.7	144.2	177.7	-68.7	0	0	0	0	111.8	K3	K3-C291 WeakPolarHBondContact CE-O 3.49Å; K3-C291 PolarHBondContact NZ-O 3.2Å
292	S	42.4	Very low	59.5	Low	133 Å²	133	101.1 Å²	101.1	93%	0.93	57%	0.567	S	S	*	*			trans	-104.2	137.8	-179.9	-74.4	0	0	0	0	112.6
293	G	34.2	Very low	60.9	Low	47 Å²	47	97.9 Å²	97.9	49%	0.485	55%	0.548	S	S	.	.			trans	173.4	152.8	174.2	0	0	0	0	0	112	L295	G293-L295 PolarHBondContact O-N 2.96Å
294	K	44	Very low	62.4	Low	215 Å²	215	95.4 Å²	95.4	94%	0.935	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-56.9	129.6	179.8	-71.2	-177.4	178.1	179.7	0	110.5
295	L	54.8	Low	64	Low	99 Å²	99	92.2 Å²	92.2	52%	0.518	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-83.5	129.5	-167.2	-80.3	93.2	0	0	0	112.3	K3 G293	K3-L295 HydrophobicContact CB-CD2 4.01Å; G293-L295 PolarHBondContact O-N 2.96Å
296	P	66.3	Low	65.6	Low	63 Å²	63	89.4 Å²	89.4	41%	0.409	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-71.4	152.6	170.3	26.4	-30.6	0	0	0	112.4	F301	P296-F301 HydrophobicContact CB-CE2 3.7Å; P296-F301 HydrophobicContact CB-CZ 3.86Å; P296-F301 HydrophobicContact CG-CE2 3.58Å; P296-F301 HydrophobicContact CG-CZ 3.46Å; P296-F301 VanDerWaalsContact CG-CZ 3.46Å
297	S	78.6	Confident	67.9	Low	51 Å²	51	87.1 Å²	87.1	36%	0.357	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-75.2	154.8	177.4	178.6	0	0	0	0	111.6	L299 D300 F301	S297-L299 PolarHBondContact O-N 3.32Å; S297-L299 PolarHBondContact OG-N 3.47Å; S297-D300 WeakPolarHBondContact CB-OD2 3.48Å; S297-D300 PolarHBondContact N-OD2 3.28Å; S297-D300 WeakPolarHBondContact O-CB 3.19Å; S297-D300 PolarHBondContact O-N 2.9Å; S297-D300 VanDerWaalsContact O-N 3.15Å; S297-F301 WeakPolarHBondContact O-CD2 3.42Å
298	V	82.1	Confident	70.4	Confident	3 Å²	3	85.1 Å²	85.1	2%	0.018	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-59.8	-26.6	173	69.4	0	0	0	0	112.2	D300 I306 W354 F375	V298-D300 VanDerWaalsContact C-N 3.3Å; V298-D300 PolarHBondContact O-N 2.85Å; V298-I306 HydrophobicContact CG2-CD1 3.73Å; V298-W354 HydrophobicContact CG2-CH2 4.16Å; V298-W354 HydrophobicContact CG2-CZ2 4Å; V298-F375 HydrophobicContact CG2-CE1 4.36Å; V298-F375 HydrophobicContact CG2-CZ 3.99Å
299	L	87	Confident	73.3	Confident	44 Å²	44	81 Å²	81	23%	0.23	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-71.6	-26.9	179.7	-64.1	-176.3	0	0	0	112.8	S297 F301 E367 K374	S297-L299 PolarHBondContact O-N 3.32Å; S297-L299 PolarHBondContact OG-N 3.47Å; L299-F301 PolarHBondContact O-N 2.89Å; L299-E367 WeakPolarHBondContact CD1-OE1 3.41Å; L299-K374 HydrophobicContact CD2-CB 4.08Å; L299-K374 HydrophobicContact CD2-CD 4.25Å; L299-K374 HydrophobicContact CD2-CG 4.17Å; L299-K374 PolarHBondContact O-NZ 3.1Å; L299-K374 VanDerWaalsContact O-NZ 3.09Å
300	D	88.7	Confident	76.4	Confident	112 Å²	112	72.5 Å²	72.5	60%	0.599	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-69.6	-21.5	-175.7	-57.8	-26	0	0	0	112.8	S297 V298	S297-D300 WeakPolarHBondContact CB-OD2 3.48Å; S297-D300 PolarHBondContact N-OD2 3.28Å; S297-D300 WeakPolarHBondContact O-CB 3.19Å; S297-D300 PolarHBondContact O-N 2.9Å; S297-D300 VanDerWaalsContact O-N 3.15Å; V298-D300 VanDerWaalsContact C-N 3.3Å; V298-D300 PolarHBondContact O-N 2.85Å
301	F	92	Very high	79.4	Confident	87 Å²	87	68.6 Å²	68.6	38%	0.382	38%	0.383	S	S	.	.	S	Bend	trans	-100.9	146.3	-178	-61.1	-80.4	0	0	0	112.4	P296 S297 L299 S303 I306 K374	P296-F301 HydrophobicContact CB-CE2 3.7Å; P296-F301 HydrophobicContact CB-CZ 3.86Å; P296-F301 HydrophobicContact CG-CE2 3.58Å; P296-F301 HydrophobicContact CG-CZ 3.46Å; P296-F301 VanDerWaalsContact CG-CZ 3.46Å; S297-F301 WeakPolarHBondContact O-CD2 3.42Å; L299-F301 PolarHBondContact O-N 2.89Å; F301-S303 PolarHBondContact O-N 3.32Å; F301-I306 HydrophobicContact CB-CD1 3.96Å; F301-I306 HydrophobicContact CB-CG1 3.87Å; F301-K374 WeakPolarHBondContact O-CE 3.46Å; F301-K374 PolarHBondContact O-NZ 2.87Å
302	K	94.5	Very high	82.6	Confident	166 Å²	166	69.8 Å²	69.8	72%	0.722	37%	0.374	S	S	*	.			trans	-61.5	137.9	171.7	-64.3	-179.6	-178.9	172.7	0	110.3	V304 A305 I306	K302-V304 HydrophobicContact CB-CG1 4.13Å; K302-V304 PolarHBondContact O-N 3.01Å; K302-A305 HydrophobicContact CB-CB 4.35Å; K302-A305 WeakPolarHBondContact O-CB 3.24Å; K302-A305 PolarHBondContact O-N 3.45Å; K302-I306 PolarHBondContact O-N 3.09Å
303	S	98	Very high	85.1	Confident	13 Å²	13	64.1 Å²	64.1	9%	0.091	33%	0.333	C	S	.	.	H	α-helix	trans	-55.7	-36.8	179.5	-62.9	0	0	0	0	112.9	F301 A307 K374	F301-S303 PolarHBondContact O-N 3.32Å; S303-A307 WeakPolarHBondContact O-CB 3.35Å; S303-A307 PolarHBondContact O-N 3.47Å; S303-K374 WeakPolarHBondContact OG-CD 3.47Å; S303-K374 WeakPolarHBondContact OG-CE 3.33Å
304	V	97.6	Very high	88.2	Confident	48 Å²	48	61.9 Å²	61.9	29%	0.291	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-38.5	176	66.7	0	0	0	0	112.7	K302 A307 Q308 M385	K302-V304 HydrophobicContact CB-CG1 4.13Å; K302-V304 PolarHBondContact O-N 3.01Å; V304-A307 PolarHBondContact O-N 3.15Å; V304-Q308 WeakPolarHBondContact O-CG 3.3Å; V304-Q308 PolarHBondContact O-N 3.32Å; V304-M385 HydrophobicContact CG2-CE 3.9Å
305	A	95.3	Very high	90.7	Very high	43 Å²	43	55.3 Å²	55.3	36%	0.355	28%	0.28	S	S	.	.	H	α-helix	trans	-68.7	-39.7	-179.3	0	0	0	0	0	111.1	K302 Q308 Q309	K302-A305 HydrophobicContact CB-CB 4.35Å; K302-A305 WeakPolarHBondContact O-CB 3.24Å; K302-A305 PolarHBondContact O-N 3.45Å; A305-Q308 PolarHBondContact O-N 2.9Å; A305-Q309 PolarHBondContact O-N 3.25Å; A305-Q309 VanDerWaalsContact O-N 3.16Å
306	I	95.4	Very high	92.7	Very high	7 Å²	7	54.3 Å²	54.3	4%	0.036	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-49.9	171.9	-61.8	168.3	0	0	0	109.6	M1 V298 F301 K302 Q308 Q309 L310 W354 I378	M1-I306 HydrophobicContact CE-CG2 4.35Å; V298-I306 HydrophobicContact CG2-CD1 3.73Å; F301-I306 HydrophobicContact CB-CD1 3.96Å; F301-I306 HydrophobicContact CB-CG1 3.87Å; K302-I306 PolarHBondContact O-N 3.09Å; I306-Q308 VanDerWaalsContact C-N 3.33Å; I306-Q308 PolarHBondContact O-N 3Å; I306-Q309 PolarHBondContact O-N 3.5Å; I306-Q309 VanDerWaalsContact O-N 3.16Å; I306-L310 HydrophobicContact CG2-CD1 3.9Å; I306-L310 HydrophobicContact CG2-CG 4.17Å; I306-L310 VanDerWaalsContact O-CG 3.24Å; I306-L310 WeakPolarHBondContact O-CG 3.38Å; I306-L310 PolarHBondContact O-N 3Å; I306-W354 HydrophobicContact CG2-CH2 4.09Å; I306-I378 HydrophobicContact CB-CD1 4.17Å; I306-I378 HydrophobicContact CB-CG1 4.39Å; I306-I378 HydrophobicContact CD1-CD1 3.86Å; I306-I378 HydrophobicContact CG2-CD1 3.92Å; I306-I378 HydrophobicContact CG2-CG1 4.44Å; I306-I378 HydrophobicContact CG2-CG2 4.47Å
307	A	98.3	Very high	94.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.5	-40.3	179.2	0	0	0	0	0	113.1	S303 V304 L310 T311 I378 H381 L382 M385	S303-A307 WeakPolarHBondContact O-CB 3.35Å; S303-A307 PolarHBondContact O-N 3.47Å; V304-A307 PolarHBondContact O-N 3.15Å; A307-L310 WeakPolarHBondContact O-CB 3.37Å; A307-L310 PolarHBondContact O-N 3.1Å; A307-T311 WeakPolarHBondContact O-CB 3.4Å; A307-T311 PolarHBondContact O-N 3.24Å; A307-T311 PolarHBondContact O-OG1 3.37Å; A307-I378 HydrophobicContact CB-CG2 4.28Å; A307-H381 HydrophobicContact CB-CB 3.49Å; A307-H381 VanDerWaalsContact CB-CB 3.49Å; A307-L382 HydrophobicContact CB-CD2 4.07Å; A307-L382 HydrophobicContact CB-CG 4.16Å; A307-M385 HydrophobicContact CB-CE 4.26Å; A307-M385 HydrophobicContact CB-SD 4.24Å
308	Q	97.6	Very high	95	Very high	112 Å²	112	51 Å²	51	52%	0.523	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-45	175.3	-75.3	170.7	-38.4	0	0	111.9	V304 A305 I306 T311 Y312 M385	V304-Q308 WeakPolarHBondContact O-CG 3.3Å; V304-Q308 PolarHBondContact O-N 3.32Å; A305-Q308 PolarHBondContact O-N 2.9Å; I306-Q308 VanDerWaalsContact C-N 3.33Å; I306-Q308 PolarHBondContact O-N 3Å; Q308-T311 PolarHBondContact O-N 3.33Å; Q308-Y312 PolarHBondContact O-N 3.29Å; Q308-M385 HydrophobicContact CG-CE 3.55Å; Q308-M385 HydrophobicContact CG-SD 4.26Å
309	Q	95.2	Very high	95.6	Very high	79 Å²	79	53.5 Å²	53.5	37%	0.369	25%	0.254	S	S	.	.	H	α-helix	trans	-70.8	-33.7	-179.5	-168.6	61.8	57.7	0	0	112.5	M1 A305 I306 L313	M1-Q309 HydrophobicContact CB-CG 3.73Å; M1-Q309 HydrophobicContact CG-CB 3.91Å; M1-Q309 HydrophobicContact CG-CG 3.29Å; A305-Q309 PolarHBondContact O-N 3.25Å; A305-Q309 VanDerWaalsContact O-N 3.16Å; I306-Q309 PolarHBondContact O-N 3.5Å; I306-Q309 VanDerWaalsContact O-N 3.16Å; Q309-L313 WeakPolarHBondContact O-CG 3.43Å; Q309-L313 PolarHBondContact O-N 3.17Å; Q309-L313 VanDerWaalsContact O-N 3.13Å
310	L	97	Very high	96	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-52.1	169.8	-72.1	177	0	0	0	111.1	M1 F5 I306 A307 Y312 L313 D314 M351 I378 L382	M1-L310 HydrophobicContact CE-CB 4.39Å; M1-L310 HydrophobicContact CE-CD2 3.1Å; M1-L310 HydrophobicContact CE-CG 3.42Å; M1-L310 VanDerWaalsContact CE-CG 3.42Å; F5-L310 HydrophobicContact CZ-CD2 3.95Å; I306-L310 HydrophobicContact CG2-CD1 3.9Å; I306-L310 HydrophobicContact CG2-CG 4.17Å; I306-L310 VanDerWaalsContact O-CG 3.24Å; I306-L310 WeakPolarHBondContact O-CG 3.38Å; I306-L310 PolarHBondContact O-N 3Å; A307-L310 WeakPolarHBondContact O-CB 3.37Å; A307-L310 PolarHBondContact O-N 3.1Å; L310-Y312 VanDerWaalsContact C-N 3.31Å; L310-Y312 PolarHBondContact O-N 3.49Å; L310-L313 PolarHBondContact O-N 2.85Å; L310-L313 VanDerWaalsContact O-N 3.17Å; L310-D314 PolarHBondContact O-N 3.07Å; L310-M351 HydrophobicContact CD1-SD 4.47Å; L310-M351 HydrophobicContact CD2-CE 3.21Å; L310-M351 HydrophobicContact CD2-SD 3.04Å; L310-M351 WeakPolarHBondContact CD2-SD 3.28Å; L310-M351 HydrophobicContact CG-SD 4.36Å; L310-I378 HydrophobicContact CD1-CG2 3.75Å; L310-L382 HydrophobicContact CB-CD2 3.91Å; L310-L382 HydrophobicContact CD1-CD1 4.12Å; L310-L382 HydrophobicContact CD1-CD2 4.16Å
311	T	98.2	Very high	96.3	Very high	18 Å²	18	50.4 Å²	50.4	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-40.3	177.3	-61.2	0	0	0	0	112.4	A307 Q308 W315 N387 L444	A307-T311 WeakPolarHBondContact O-CB 3.4Å; A307-T311 PolarHBondContact O-N 3.24Å; A307-T311 PolarHBondContact O-OG1 3.37Å; Q308-T311 PolarHBondContact O-N 3.33Å; T311-W315 WeakPolarHBondContact O-CB 3.24Å; T311-W315 PolarHBondContact O-N 3.31Å; T311-N387 VanDerWaalsContact CA-ND2 3.3Å; T311-N387 WeakPolarHBondContact CA-ND2 3.49Å; T311-N387 HydrophobicContact CG2-CB 4.29Å; T311-N387 PolarHBondContact OG1-ND2 3.37Å; T311-L444 HydrophobicContact CG2-CD1 3.95Å
312	Y	96.7	Very high	96.3	Very high	125 Å²	125	49.5 Å²	49.5	49%	0.49	23%	0.23	S	C	.	.	H	α-helix	trans	-62.1	-43	175.4	176.3	-97.3	0	0	0	112.8	Q308 L310 W315 F316	Q308-Y312 PolarHBondContact O-N 3.29Å; L310-Y312 VanDerWaalsContact C-N 3.31Å; L310-Y312 PolarHBondContact O-N 3.49Å; Y312-W315 HydrophobicContact CD2-CE3 4.21Å; Y312-W315 HydrophobicContact CD2-CZ3 4.48Å; Y312-W315 HydrophobicContact CE2-CE3 4.19Å; Y312-W315 HydrophobicContact CE2-CZ3 4.01Å; Y312-F316 WeakPolarHBondContact O-CB 3.48Å; Y312-F316 PolarHBondContact O-N 2.91Å
313	L	96.5	Very high	96.3	Very high	14 Å²	14	43.3 Å²	43.3	7%	0.073	21%	0.205	C	C	.	.	H	α-helix	trans	-68.5	-47	179.5	-70.3	172.2	0	0	0	111.8	M1 F5 Q309 L310 W315 F316 Y317	M1-L313 HydrophobicContact CB-CD1 3.92Å; F5-L313 HydrophobicContact CD2-CD1 4.3Å; F5-L313 HydrophobicContact CE2-CD1 3.64Å; F5-L313 HydrophobicContact CZ-CD1 4.43Å; Q309-L313 WeakPolarHBondContact O-CG 3.43Å; Q309-L313 PolarHBondContact O-N 3.17Å; Q309-L313 VanDerWaalsContact O-N 3.13Å; L310-L313 PolarHBondContact O-N 2.85Å; L310-L313 VanDerWaalsContact O-N 3.17Å; L313-W315 VanDerWaalsContact C-N 3.32Å; L313-W315 PolarHBondContact O-N 3.36Å; L313-F316 PolarHBondContact O-N 3.31Å; L313-Y317 HydrophobicContact CB-CE2 4.46Å; L313-Y317 WeakPolarHBondContact O-CD2 3.29Å; L313-Y317 PolarHBondContact O-N 2.86Å
314	D	97.5	Very high	96.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.5	-45.9	174.6	-80.4	-33.5	0	0	0	111.1	L310 F316 Y317 F318 F344 H347 N387 N389 S390 L444	L310-D314 PolarHBondContact O-N 3.07Å; D314-F316 VanDerWaalsContact C-N 3.33Å; D314-F316 PolarHBondContact O-N 2.86Å; D314-Y317 PolarHBondContact O-N 2.92Å; D314-F318 WeakPolarHBondContact O-CB 3.1Å; D314-F318 PolarHBondContact O-N 3.48Å; D314-F344 HydrophobicContact CB-CE2 4.42Å; D314-H347 IonicContact OD1-CD2 3.95Å; D314-H347 PolarHBondContact OD1-CD2 3.48Å; D314-H347 IonicContact OD1-NE2 2.84Å; D314-N387 PolarHBondContact OD2-ND2 2.88Å; D314-N387 PolarHBondContact OD2-OD1 3.14Å; D314-N389 PolarHBondContact OD1-ND2 3.42Å; D314-N389 VanDerWaalsContact OD1-ND2 3.16Å; D314-S390 WeakPolarHBondContact OD2-CB 3.2Å; D314-S390 PolarHBondContact OD2-N 3.1Å; D314-S390 PolarHBondContact OD2-OG 3.03Å; D314-L444 HydrophobicContact CB-CD1 3.7Å
315	W	97.1	Very high	95.9	Very high	78 Å²	78	42.1 Å²	42.1	30%	0.295	20%	0.198	S	C	.	.	H	α-helix	trans	-55.5	-48.6	175.6	168.9	88.8	0	0	0	111.4	T311 Y312 L313 Y317 F318 H319 L444 W497	T311-W315 WeakPolarHBondContact O-CB 3.24Å; T311-W315 PolarHBondContact O-N 3.31Å; Y312-W315 HydrophobicContact CD2-CE3 4.21Å; Y312-W315 HydrophobicContact CD2-CZ3 4.48Å; Y312-W315 HydrophobicContact CE2-CE3 4.19Å; Y312-W315 HydrophobicContact CE2-CZ3 4.01Å; L313-W315 VanDerWaalsContact C-N 3.32Å; L313-W315 PolarHBondContact O-N 3.36Å; W315-Y317 PolarHBondContact O-N 3.26Å; W315-F318 PolarHBondContact O-N 3.28Å; W315-H319 AromaticContact CD1-CE1 3.03Å; W315-H319 AromaticContact CD1-ND1 3.23Å; W315-H319 AromaticContact CD1-NE2 3.98Å; W315-H319 AromaticContact CE2-ND1 3.8Å; W315-H319 AromaticContact CG-CE1 3.93Å; W315-H319 AromaticContact CG-ND1 3.69Å; W315-H319 AromaticContact NE1-CE1 3.08Å; W315-H319 PolarHBondContact NE1-CE1 2.82Å; W315-H319 AromaticContact NE1-CG 3.96Å; W315-H319 AromaticContact NE1-ND1 3.3Å; W315-H319 PolarHBondContact NE1-ND1 2.75Å; W315-H319 AromaticContact NE1-NE2 3.62Å; W315-H319 PolarHBondContact O-N 3Å; W315-H319 PolarHBondContact O-ND1 3.38Å; W315-L444 HydrophobicContact CB-CD1 4.22Å; W315-L444 HydrophobicContact CB-CD2 4.23Å; W315-W497 HydrophobicContact CB-CH2 4.35Å; W315-W497 AromaticContact CD1-CH2 3.27Å; W315-W497 AromaticContact CD1-CZ2 3.55Å; W315-W497 AromaticContact CD1-CZ3 3.52Å; W315-W497 HydrophobicContact CG-CH2 4.08Å; W315-W497 HydrophobicContact CG-CZ3 4.41Å; W315-W497 AromaticContact NE1-CZ3 3.9Å
316	F	96.2	Very high	95.8	Very high	77 Å²	77	40.1 Å²	40.1	34%	0.338	18%	0.181	S	C	.	.	H	α-helix	trans	-61.1	-43.3	-178.7	175.9	-102	0	0	0	112.4	Y312 L313 D314 K320	Y312-F316 WeakPolarHBondContact O-CB 3.48Å; Y312-F316 PolarHBondContact O-N 2.91Å; L313-F316 PolarHBondContact O-N 3.31Å; D314-F316 VanDerWaalsContact C-N 3.33Å; D314-F316 PolarHBondContact O-N 2.86Å; F316-K320 HydrophobicContact CE1-CD 4.36Å; F316-K320 VanDerWaalsContact CE1-CE 3.47Å; F316-K320 WeakPolarHBondContact O-CG 3.45Å
317	Y	96.1	Very high	95.8	Very high	46 Å²	46	42.4 Å²	42.4	18%	0.18	19%	0.193	C	C	.	.	H	α-helix	trans	-73.6	-39.6	177.6	-67.4	-56.1	0	0	0	112.2	L313 D314 W315 H319 K320 V343 H347	L313-Y317 HydrophobicContact CB-CE2 4.46Å; L313-Y317 WeakPolarHBondContact O-CD2 3.29Å; L313-Y317 PolarHBondContact O-N 2.86Å; D314-Y317 PolarHBondContact O-N 2.92Å; W315-Y317 PolarHBondContact O-N 3.26Å; Y317-H319 PolarHBondContact O-N 3.06Å; Y317-K320 WeakPolarHBondContact O-CB 3.47Å; Y317-K320 PolarHBondContact O-N 2.89Å; Y317-V343 HydrophobicContact CD1-CG1 3.41Å; Y317-V343 VanDerWaalsContact CD1-CG1 3.41Å; Y317-V343 HydrophobicContact CE1-CG1 3.47Å; Y317-V343 VanDerWaalsContact CE1-CG1 3.47Å; Y317-V343 HydrophobicContact CG-CG1 4.17Å; Y317-H347 HydrophobicContact CD2-CB 4.08Å; Y317-H347 AromaticContact CD2-CD2 3.87Å; Y317-H347 AromaticContact CD2-CG 3.81Å; Y317-H347 HydrophobicContact CE2-CB 4.24Å; Y317-H347 AromaticContact CE2-CG 3.84Å; Y317-H347 AromaticContact CE2-ND1 3.85Å
318	F	97.2	Very high	95.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-42.3	179.4	177.4	-115	0	0	0	112.5	D314 W315 K320 I321 F344 L444 P445 L447 V491 F494 K495	D314-F318 WeakPolarHBondContact O-CB 3.1Å; D314-F318 PolarHBondContact O-N 3.48Å; W315-F318 PolarHBondContact O-N 3.28Å; F318-K320 PolarHBondContact O-N 3.39Å; F318-I321 HydrophobicContact CD2-CD1 4.28Å; F318-I321 WeakPolarHBondContact O-CB 3.3Å; F318-I321 PolarHBondContact O-N 3.36Å; F318-F344 HydrophobicContact CB-CD2 4.13Å; F318-F344 HydrophobicContact CB-CE2 3.69Å; F318-F344 HydrophobicContact CB-CZ 4.38Å; F318-F344 HydrophobicContact CD2-CE2 4.5Å; F318-F344 HydrophobicContact CD2-CZ 4.44Å; F318-L444 HydrophobicContact CB-CD2 3.88Å; F318-L444 HydrophobicContact CD1-CD2 3.59Å; F318-L444 HydrophobicContact CE1-CD2 4.4Å; F318-L444 HydrophobicContact CG-CD2 3.91Å; F318-P445 HydrophobicContact CE2-CG 4.2Å; F318-P445 HydrophobicContact CZ-CG 4.16Å; F318-L447 HydrophobicContact CD2-CD1 4.3Å; F318-L447 HydrophobicContact CE2-CD1 4.42Å; F318-L447 HydrophobicContact CE2-CD2 4Å; F318-V491 HydrophobicContact CE2-CG1 3.97Å; F318-V491 HydrophobicContact CZ-CG1 3.87Å; F318-F494 HydrophobicContact CE1-CB 4.35Å; F318-F494 HydrophobicContact CZ-CB 4.34Å; F318-K495 HydrophobicContact CD1-CG 4.48Å; F318-K495 HydrophobicContact CE1-CG 3.66Å; F318-K495 HydrophobicContact CZ-CG 3.84Å
319	H	95.3	Very high	95.3	Very high	54 Å²	54	39.9 Å²	39.9	25%	0.25	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-13.8	179.8	-74.4	76.1	0	0	0	113.6	W315 Y317 K495	W315-H319 AromaticContact CD1-CE1 3.03Å; W315-H319 AromaticContact CD1-ND1 3.23Å; W315-H319 AromaticContact CD1-NE2 3.98Å; W315-H319 AromaticContact CE2-ND1 3.8Å; W315-H319 AromaticContact CG-CE1 3.93Å; W315-H319 AromaticContact CG-ND1 3.69Å; W315-H319 AromaticContact NE1-CE1 3.08Å; W315-H319 PolarHBondContact NE1-CE1 2.82Å; W315-H319 AromaticContact NE1-CG 3.96Å; W315-H319 AromaticContact NE1-ND1 3.3Å; W315-H319 PolarHBondContact NE1-ND1 2.75Å; W315-H319 AromaticContact NE1-NE2 3.62Å; W315-H319 PolarHBondContact O-N 3Å; W315-H319 PolarHBondContact O-ND1 3.38Å; Y317-H319 PolarHBondContact O-N 3.06Å; H319-K495 PolarHBondContact NE2-O 2.83Å
320	K	94.9	Very high	95.1	Very high	91 Å²	91	36.3 Å²	36.3	40%	0.396	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-20.8	172.4	-71.5	179.9	175.8	-170.9	0	113.6	F316 Y317 F318 E322 N340	F316-K320 HydrophobicContact CE1-CD 4.36Å; F316-K320 VanDerWaalsContact CE1-CE 3.47Å; F316-K320 WeakPolarHBondContact O-CG 3.45Å; Y317-K320 WeakPolarHBondContact O-CB 3.47Å; Y317-K320 PolarHBondContact O-N 2.89Å; F318-K320 PolarHBondContact O-N 3.39Å; K320-E322 PolarHBondContact O-N 3.46Å; K320-N340 HydrophobicContact CB-CB 4.24Å; K320-N340 VanDerWaalsContact O-CG 3.3Å; K320-N340 PolarHBondContact O-ND2 3.09Å; K320-N340 VanDerWaalsContact O-ND2 3.15Å
321	I	94.9	Very high	94.8	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	19%	0.188	C	C	.	.			trans	-67.5	132.9	179.6	-59.3	171.3	0	0	0	107.8	F318 M326 N340 L341 F344 L447 K495	F318-I321 HydrophobicContact CD2-CD1 4.28Å; F318-I321 WeakPolarHBondContact O-CB 3.3Å; F318-I321 PolarHBondContact O-N 3.36Å; I321-M326 HydrophobicContact CG2-CG 3.8Å; I321-M326 HydrophobicContact CG2-SD 4.24Å; I321-N340 HydrophobicContact CG1-CB 4.14Å; I321-L341 HydrophobicContact CD1-CD1 4.05Å; I321-L341 HydrophobicContact CG2-CD1 4.41Å; I321-F344 HydrophobicContact CD1-CB 3.68Å; I321-F344 HydrophobicContact CD1-CD1 4.02Å; I321-F344 HydrophobicContact CD1-CD2 4.23Å; I321-F344 HydrophobicContact CD1-CG 3.72Å; I321-F344 HydrophobicContact CG1-CB 4.37Å; I321-L447 HydrophobicContact CD1-CD1 3.55Å; I321-K495 PolarHBondContact O-NZ 3.06Å
322	E	92.7	Very high	94.4	Very high	67 Å²	67	41.6 Å²	41.6	31%	0.313	20%	0.195	S	C	.	.			trans	-90.8	147.9	168.5	-68.5	-65.2	155.8	0	0	110.6	K320 S324 E325 M326	K320-E322 PolarHBondContact O-N 3.46Å; E322-S324 PolarHBondContact O-N 2.65Å; E322-E325 HydrophobicContact CB-CG 4.29Å; E322-E325 PolarHBondContact N-OE1 2.87Å; E322-E325 WeakPolarHBondContact O-CB 3.47Å; E322-E325 PolarHBondContact O-N 3.42Å; E322-M326 PolarHBondContact O-N 2.82Å
323	L	94.1	Very high	94	Very high	36 Å²	36	36.9 Å²	36.9	19%	0.188	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-29.3	176.1	-64.3	179.2	0	0	0	111.6	E325 M326 L327 L488 V491 R492	L323-E325 VanDerWaalsContact C-N 3.34Å; L323-M326 HydrophobicContact CD2-SD 4.31Å; L323-M326 PolarHBondContact O-N 3.01Å; L323-L327 PolarHBondContact O-N 3.22Å; L323-L488 HydrophobicContact CB-CD2 4.41Å; L323-L488 HydrophobicContact CD2-CB 4.46Å; L323-L488 HydrophobicContact CD2-CD2 4.2Å; L323-V491 HydrophobicContact CD2-CB 4.12Å; L323-V491 HydrophobicContact CD2-CG1 4.2Å; L323-R492 HydrophobicContact CD1-CB 4Å; L323-R492 HydrophobicContact CD1-CG 4.07Å
324	S	93.3	Very high	93.5	Very high	24 Å²	24	37.5 Å²	37.5	17%	0.168	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-32.8	173.8	52.1	0	0	0	0	113	T201 E322 M326 L327 L328	T201-S324 WeakPolarHBondContact O-CB 3.46Å; T201-S324 PolarHBondContact O-OG 3.33Å; E322-S324 PolarHBondContact O-N 2.65Å; S324-M326 VanDerWaalsContact C-N 3.34Å; S324-L327 PolarHBondContact O-N 3Å; S324-L328 VanDerWaalsContact O-CB 3.22Å; S324-L328 WeakPolarHBondContact O-CB 3.37Å; S324-L328 PolarHBondContact O-N 3.18Å
325	E	93.6	Very high	93	Very high	13 Å²	13	40.8 Å²	40.8	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-40.9	171.8	-73.2	-177.9	-116.1	0	0	111	E322 L323 L328 W329 C338 P339 N340 L341	E322-E325 HydrophobicContact CB-CG 4.29Å; E322-E325 PolarHBondContact N-OE1 2.87Å; E322-E325 WeakPolarHBondContact O-CB 3.47Å; E322-E325 PolarHBondContact O-N 3.42Å; L323-E325 VanDerWaalsContact C-N 3.34Å; E325-L328 PolarHBondContact O-N 3.49Å; E325-W329 WeakPolarHBondContact O-CB 3.17Å; E325-W329 PolarHBondContact O-N 3.43Å; E325-C338 HydrophobicContact CB-CB 4.26Å; E325-C338 PolarHBondContact O-SG 2.68Å; E325-C338 VanDerWaalsContact O-SG 3.41Å; E325-C338 WeakPolarHBondContact OE2-CA 3.14Å; E325-P339 WeakPolarHBondContact OE2-CD 3.38Å; E325-N340 WeakPolarHBondContact OE1-CB 3.5Å; E325-N340 PolarHBondContact OE1-ND2 2.76Å; E325-N340 WeakPolarHBondContact OE2-CB 3.23Å; E325-N340 PolarHBondContact OE2-N 3.19Å; E325-L341 PolarHBondContact OE2-N 3.19Å
326	M	94.5	Very high	92.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-40.9	177.6	-63	-177.5	64.3	0	0	112	I321 E322 L323 S324 W329 S330 L447 I450 L451 L454 L488 V491	I321-M326 HydrophobicContact CG2-CG 3.8Å; I321-M326 HydrophobicContact CG2-SD 4.24Å; E322-M326 PolarHBondContact O-N 2.82Å; L323-M326 HydrophobicContact CD2-SD 4.31Å; L323-M326 PolarHBondContact O-N 3.01Å; S324-M326 VanDerWaalsContact C-N 3.34Å; M326-W329 WeakPolarHBondContact O-CB 3.24Å; M326-W329 PolarHBondContact O-N 3.44Å; M326-S330 PolarHBondContact O-N 3.09Å; M326-L447 HydrophobicContact CE-CD2 4.01Å; M326-I450 HydrophobicContact CE-CB 4.39Å; M326-I450 HydrophobicContact CE-CG2 3.6Å; M326-L451 HydrophobicContact CB-CD2 4.14Å; M326-L451 HydrophobicContact CE-CD2 4.17Å; M326-L451 HydrophobicContact CG-CD2 4.41Å; M326-L454 HydrophobicContact CB-CD1 4.18Å; M326-L488 HydrophobicContact CB-CD2 3.8Å; M326-L488 HydrophobicContact CE-CD2 4.4Å; M326-L488 HydrophobicContact SD-CD2 4.33Å; M326-V491 HydrophobicContact CE-CG1 4.33Å; M326-V491 HydrophobicContact CE-CG2 4Å; M326-V491 HydrophobicContact SD-CG1 3.99Å
327	L	94.9	Very high	92.2	Very high	55 Å²	55	48.9 Å²	48.9	29%	0.288	23%	0.228	S	C	.	.	H	α-helix	trans	-66	-42.8	174.7	-174.7	63.1	0	0	0	112	L323 S324 W329 S330 Q484 L488	L323-L327 PolarHBondContact O-N 3.22Å; S324-L327 PolarHBondContact O-N 3Å; L327-W329 VanDerWaalsContact C-N 3.29Å; L327-W329 PolarHBondContact O-N 3.15Å; L327-S330 PolarHBondContact O-N 3.38Å; L327-S330 PolarHBondContact O-OG 3.36Å; L327-Q484 HydrophobicContact CD1-CB 3.93Å; L327-Q484 HydrophobicContact CD1-CG 4.12Å; L327-L488 HydrophobicContact CB-CD1 4.19Å; L327-L488 HydrophobicContact CD1-CD1 4.49Å
328	L	93.7	Very high	92	Very high	51 Å²	51	46.7 Å²	46.7	27%	0.267	22%	0.219	S	C	.	.	H	α-helix	trans	-67.5	-33.2	179	-177	56.6	0	0	0	112	S324 E325 S330 I331 S332 K337	S324-L328 VanDerWaalsContact O-CB 3.22Å; S324-L328 WeakPolarHBondContact O-CB 3.37Å; S324-L328 PolarHBondContact O-N 3.18Å; E325-L328 PolarHBondContact O-N 3.49Å; L328-S330 VanDerWaalsContact C-N 3.32Å; L328-S330 PolarHBondContact O-N 2.86Å; L328-I331 PolarHBondContact O-N 2.75Å; L328-S332 PolarHBondContact O-N 3.25Å; L328-S332 PolarHBondContact O-OG 3.19Å; L328-K337 HydrophobicContact CD2-CB 3.74Å; L328-K337 HydrophobicContact CD2-CD 4.29Å; L328-K337 HydrophobicContact CG-CB 4.3Å
329	W	92.6	Very high	91.7	Very high	9 Å²	9	49.9 Å²	49.9	3%	0.034	24%	0.24	C	C	.	.	H	α-helix	trans	-59.3	-43.1	173.5	-175.2	-90.5	0	0	0	111.6	F114 E325 M326 L327 I331 Q333 E335 C338 L341 L451	F114-W329 HydrophobicContact CB-CH2 4.45Å; F114-W329 HydrophobicContact CB-CZ2 3.32Å; F114-W329 HydrophobicContact CD2-CZ2 4.16Å; F114-W329 HydrophobicContact CG-CZ2 4.19Å; F114-W329 AromaticContact CG-NE1 3.89Å; E325-W329 WeakPolarHBondContact O-CB 3.17Å; E325-W329 PolarHBondContact O-N 3.43Å; M326-W329 WeakPolarHBondContact O-CB 3.24Å; M326-W329 PolarHBondContact O-N 3.44Å; L327-W329 VanDerWaalsContact C-N 3.29Å; L327-W329 PolarHBondContact O-N 3.15Å; W329-I331 PolarHBondContact O-N 3.19Å; W329-I331 VanDerWaalsContact O-N 3.12Å; W329-Q333 HydrophobicContact CH2-CB 4.49Å; W329-Q333 HydrophobicContact CZ2-CB 4.02Å; W329-Q333 HydrophobicContact CZ2-CG 4.4Å; W329-Q333 WeakPolarHBondContact O-CA 3.49Å; W329-Q333 WeakPolarHBondContact O-CG 3.33Å; W329-Q333 PolarHBondContact O-N 3.29Å; W329-E335 HydrophobicContact CH2-CG 3.99Å; W329-E335 HydrophobicContact CZ3-CG 4.03Å; W329-C338 HydrophobicContact CE3-CB 3.8Å; W329-C338 HydrophobicContact CZ3-CB 4.48Å; W329-L341 HydrophobicContact CB-CD2 3.56Å; W329-L341 HydrophobicContact CD2-CD2 3.79Å; W329-L341 HydrophobicContact CE3-CD2 4.02Å; W329-L341 HydrophobicContact CG-CD2 3.54Å; W329-L451 HydrophobicContact CB-CD2 4.32Å; W329-L451 HydrophobicContact CG-CD2 4.28Å
330	S	90.9	Very high	91.7	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-14.5	179.8	78.1	0	0	0	0	114.1	M326 L327 L328 H458	M326-S330 PolarHBondContact O-N 3.09Å; L327-S330 PolarHBondContact O-N 3.38Å; L327-S330 PolarHBondContact O-OG 3.36Å; L328-S330 VanDerWaalsContact C-N 3.32Å; L328-S330 PolarHBondContact O-N 2.86Å; S330-H458 PolarHBondContact O-CD2 3.48Å
331	I	90.8	Very high	91.6	Very high	91 Å²	91	45.4 Å²	45.4	47%	0.467	22%	0.222	S	C	.	.	H	α-helix	trans	-99.4	-48.1	179.7	-56.4	165.8	0	0	0	111	L328 W329	L328-I331 PolarHBondContact O-N 2.75Å; W329-I331 PolarHBondContact O-N 3.19Å; W329-I331 VanDerWaalsContact O-N 3.12Å
332	S	89	Confident	91.4	Very high	38 Å²	38	46.2 Å²	46.2	27%	0.266	23%	0.227	S	C	.	.	H	α-helix	trans	-107.4	-25.9	-166.7	64.5	0	0	0	0	114.6	L328 D334	L328-S332 PolarHBondContact O-N 3.25Å; L328-S332 PolarHBondContact O-OG 3.19Å; S332-D334 PolarHBondContact O-N 3.34Å
333	Q	88.7	Confident	91.4	Very high	26 Å²	26	46.1 Å²	46.1	12%	0.121	23%	0.231	C	C	.	.			trans	44.5	33.5	-170.2	-59.8	-175.5	-8.1	0	0	113.2	F114 W329	F114-Q333 PolarHBondContact O-NE2 3.45Å; F114-Q333 PolarHBondContact O-OE1 2.8Å; W329-Q333 HydrophobicContact CH2-CB 4.49Å; W329-Q333 HydrophobicContact CZ2-CB 4.02Å; W329-Q333 HydrophobicContact CZ2-CG 4.4Å; W329-Q333 WeakPolarHBondContact O-CA 3.49Å; W329-Q333 WeakPolarHBondContact O-CG 3.33Å; W329-Q333 PolarHBondContact O-N 3.29Å
334	D	85.7	Confident	91.5	Very high	28 Å²	28	44.6 Å²	44.6	15%	0.15	22%	0.223	C	C	.	.			trans	-100.3	112.4	-179.9	-168	-16.9	0	0	0	110.1	S332 R336 K337 C338	S332-D334 PolarHBondContact O-N 3.34Å; D334-R336 PolarHBondContact O-N 2.98Å; D334-R336 WeakPolarHBondContact OD1-CB 3.47Å; D334-R336 IonicContact OD1-CZ 3.46Å; D334-R336 PolarHBondContact OD1-N 3.23Å; D334-R336 IonicContact OD1-NE 3.41Å; D334-R336 PolarHBondContact OD1-NE 2.94Å; D334-R336 VanDerWaalsContact OD1-NE 3.15Å; D334-R336 IonicContact OD1-NH2 3.94Å; D334-R336 IonicContact OD2-CZ 2.77Å; D334-R336 IonicContact OD2-NE 3.1Å; D334-R336 PolarHBondContact OD2-NE 2.9Å; D334-R336 IonicContact OD2-NH2 3.71Å; D334-R336 PolarHBondContact OD2-NH2 3.28Å; D334-K337 HydrophobicContact CB-CB 4.34Å; D334-K337 HydrophobicContact CB-CD 4.17Å; D334-K337 HydrophobicContact CB-CG 4.09Å; D334-K337 PolarHBondContact O-N 3.12Å; D334-C338 PolarHBondContact O-N 3.3Å
335	E	87.4	Confident	91.5	Very high	68 Å²	68	44 Å²	44	32%	0.318	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-33.3	176.3	-68.6	172.8	-131.9	0	0	113	R115 W329 K337 C338 T342	R115-E335 IonicContact CZ-OE1 3.36Å; R115-E335 IonicContact NH1-OE1 2.66Å; R115-E335 PolarHBondContact NH1-OE1 3.39Å; R115-E335 IonicContact NH2-OE1 2.69Å; W329-E335 HydrophobicContact CH2-CG 3.99Å; W329-E335 HydrophobicContact CZ3-CG 4.03Å; E335-K337 PolarHBondContact O-N 3.44Å; E335-C338 CarbonylContact O-C 3.53Å; E335-C338 PolarHBondContact O-N 3.05Å; E335-T342 WeakPolarHBondContact CA-OG1 3.29Å; E335-T342 HydrophobicContact CB-CG2 4.02Å; E335-T342 WeakPolarHBondContact CB-OG1 3.5Å; E335-T342 HydrophobicContact CG-CG2 4.01Å; E335-T342 PolarHBondContact O-OG1 3.1Å
336	R	87.8	Confident	91.3	Very high	212 Å²	212	46.8 Å²	46.8	80%	0.8	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-26.1	179.9	-63.7	172.7	-67.9	-177.3	2.3	112.2	D334	D334-R336 PolarHBondContact O-N 2.98Å; D334-R336 WeakPolarHBondContact OD1-CB 3.47Å; D334-R336 IonicContact OD1-CZ 3.46Å; D334-R336 PolarHBondContact OD1-N 3.23Å; D334-R336 IonicContact OD1-NE 3.41Å; D334-R336 PolarHBondContact OD1-NE 2.94Å; D334-R336 VanDerWaalsContact OD1-NE 3.15Å; D334-R336 IonicContact OD1-NH2 3.94Å; D334-R336 IonicContact OD2-CZ 2.77Å; D334-R336 IonicContact OD2-NE 3.1Å; D334-R336 PolarHBondContact OD2-NE 2.9Å; D334-R336 IonicContact OD2-NH2 3.71Å; D334-R336 PolarHBondContact OD2-NH2 3.28Å
337	K	87.6	Confident	91.3	Very high	114 Å²	114	47.3 Å²	47.3	50%	0.496	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-17.8	179.8	-64.5	-173.6	-178.6	-179	0	113.1	L328 D334 E335 P339	L328-K337 HydrophobicContact CD2-CB 3.74Å; L328-K337 HydrophobicContact CD2-CD 4.29Å; L328-K337 HydrophobicContact CG-CB 4.3Å; D334-K337 HydrophobicContact CB-CB 4.34Å; D334-K337 HydrophobicContact CB-CD 4.17Å; D334-K337 HydrophobicContact CB-CG 4.09Å; D334-K337 PolarHBondContact O-N 3.12Å; E335-K337 PolarHBondContact O-N 3.44Å; K337-P339 VanDerWaalsContact C-CD 3.4Å; K337-P339 WeakPolarHBondContact O-CD 3.47Å
338	C	91.8	Very high	91.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.224	C	C	.	.			trans	-127.2	57.2	-175.6	-47.2	0	0	0	0	111	E325 W329 D334 E335 N340 L341 T342	E325-C338 HydrophobicContact CB-CB 4.26Å; E325-C338 PolarHBondContact O-SG 2.68Å; E325-C338 VanDerWaalsContact O-SG 3.41Å; E325-C338 WeakPolarHBondContact OE2-CA 3.14Å; W329-C338 HydrophobicContact CE3-CB 3.8Å; W329-C338 HydrophobicContact CZ3-CB 4.48Å; D334-C338 PolarHBondContact O-N 3.3Å; E335-C338 CarbonylContact O-C 3.53Å; E335-C338 PolarHBondContact O-N 3.05Å; C338-N340 PolarHBondContact O-N 2.8Å; C338-L341 HydrophobicContact CB-CB 4.06Å; C338-L341 HydrophobicContact CB-CD2 4.35Å; C338-L341 PolarHBondContact O-N 2.92Å; C338-T342 PolarHBondContact O-N 3.27Å; C338-T342 PolarHBondContact O-OG1 3.33Å; C338-T342 VanDerWaalsContact O-OG1 3.1Å
339	P	91.9	Very high	91	Very high	66 Å²	66	43.1 Å²	43.1	43%	0.429	21%	0.214	S	C	.	.	H	α-helix	trans	-63.3	-37.7	-167.4	26.3	-36	0	0	0	113.7	E325 K337 T342 V343	E325-P339 WeakPolarHBondContact OE2-CD 3.38Å; K337-P339 VanDerWaalsContact C-CD 3.4Å; K337-P339 WeakPolarHBondContact O-CD 3.47Å; P339-T342 PolarHBondContact O-N 3.05Å; P339-V343 VanDerWaalsContact O-CG2 3.26Å; P339-V343 WeakPolarHBondContact O-CG2 3.4Å; P339-V343 PolarHBondContact O-N 3.33Å
340	N	93.7	Very high	90.7	Very high	51 Å²	51	47.2 Å²	47.2	27%	0.273	23%	0.232	S	C	.	.	H	α-helix	trans	-73.1	-38.6	-179.3	-63.5	-59.8	0	0	0	110.5	K320 I321 E325 C338 V343 F344	K320-N340 HydrophobicContact CB-CB 4.24Å; K320-N340 VanDerWaalsContact O-CG 3.3Å; K320-N340 PolarHBondContact O-ND2 3.09Å; K320-N340 VanDerWaalsContact O-ND2 3.15Å; I321-N340 HydrophobicContact CG1-CB 4.14Å; E325-N340 WeakPolarHBondContact OE1-CB 3.5Å; E325-N340 PolarHBondContact OE1-ND2 2.76Å; E325-N340 WeakPolarHBondContact OE2-CB 3.23Å; E325-N340 PolarHBondContact OE2-N 3.19Å; C338-N340 PolarHBondContact O-N 2.8Å; N340-V343 PolarHBondContact O-N 3.43Å; N340-F344 WeakPolarHBondContact O-CB 3.46Å; N340-F344 PolarHBondContact O-N 3.18Å
341	L	93.3	Very high	90.8	Very high	1 Å²	1	47 Å²	47	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-47.2	172.9	-174.8	62.7	0	0	0	110.7	I321 E325 W329 C338 V343 F344 T345 L447 L451	I321-L341 HydrophobicContact CD1-CD1 4.05Å; I321-L341 HydrophobicContact CG2-CD1 4.41Å; E325-L341 PolarHBondContact OE2-N 3.19Å; W329-L341 HydrophobicContact CB-CD2 3.56Å; W329-L341 HydrophobicContact CD2-CD2 3.79Å; W329-L341 HydrophobicContact CE3-CD2 4.02Å; W329-L341 HydrophobicContact CG-CD2 3.54Å; C338-L341 HydrophobicContact CB-CB 4.06Å; C338-L341 HydrophobicContact CB-CD2 4.35Å; C338-L341 PolarHBondContact O-N 2.92Å; L341-V343 PolarHBondContact O-N 2.93Å; L341-F344 WeakPolarHBondContact O-CB 3.47Å; L341-F344 PolarHBondContact O-N 3.35Å; L341-T345 PolarHBondContact O-N 3.29Å; L341-T345 PolarHBondContact O-OG1 3.45Å; L341-L447 HydrophobicContact CD1-CD1 3.8Å; L341-L451 HydrophobicContact CD1-CD1 4.2Å; L341-L451 HydrophobicContact CD2-CD1 4Å; L341-L451 HydrophobicContact CD2-CD2 3.99Å; L341-L451 HydrophobicContact CG-CD1 4.48Å
342	T	91.3	Very high	90.7	Very high	18 Å²	18	42.8 Å²	42.8	11%	0.11	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-43.1	176.5	-63.9	0	0	0	0	112.1	E335 C338 P339 F344 T345 N346	E335-T342 WeakPolarHBondContact CA-OG1 3.29Å; E335-T342 HydrophobicContact CB-CG2 4.02Å; E335-T342 WeakPolarHBondContact CB-OG1 3.5Å; E335-T342 HydrophobicContact CG-CG2 4.01Å; E335-T342 PolarHBondContact O-OG1 3.1Å; C338-T342 PolarHBondContact O-N 3.27Å; C338-T342 PolarHBondContact O-OG1 3.33Å; C338-T342 VanDerWaalsContact O-OG1 3.1Å; P339-T342 PolarHBondContact O-N 3.05Å; T342-F344 VanDerWaalsContact C-N 3.34Å; T342-F344 PolarHBondContact O-N 2.99Å; T342-T345 PolarHBondContact O-N 2.96Å; T342-N346 WeakPolarHBondContact CG2-ND2 3.42Å; T342-N346 VanDerWaalsContact O-CB 3.23Å; T342-N346 WeakPolarHBondContact O-CB 3.45Å; T342-N346 PolarHBondContact O-N 3.31Å; T342-N346 PolarHBondContact O-ND2 3.41Å
343	V	93.2	Very high	90.6	Very high	65 Å²	65	45.1 Å²	45.1	39%	0.394	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-43.3	175.8	169	0	0	0	0	111.2	Y317 P339 N340 L341 N346 H347	Y317-V343 HydrophobicContact CD1-CG1 3.41Å; Y317-V343 VanDerWaalsContact CD1-CG1 3.41Å; Y317-V343 HydrophobicContact CE1-CG1 3.47Å; Y317-V343 VanDerWaalsContact CE1-CG1 3.47Å; Y317-V343 HydrophobicContact CG-CG1 4.17Å; P339-V343 VanDerWaalsContact O-CG2 3.26Å; P339-V343 WeakPolarHBondContact O-CG2 3.4Å; P339-V343 PolarHBondContact O-N 3.33Å; N340-V343 PolarHBondContact O-N 3.43Å; L341-V343 PolarHBondContact O-N 2.93Å; V343-N346 PolarHBondContact O-N 3.2Å; V343-H347 WeakPolarHBondContact O-CB 3.4Å; V343-H347 PolarHBondContact O-N 3.01Å
344	F	95.6	Very high	90.7	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-44.9	178.1	-177.7	-97.7	0	0	0	112.4	D314 F318 I321 N340 L341 T342 H347 F348 N389 L447	D314-F344 HydrophobicContact CB-CE2 4.42Å; F318-F344 HydrophobicContact CB-CD2 4.13Å; F318-F344 HydrophobicContact CB-CE2 3.69Å; F318-F344 HydrophobicContact CB-CZ 4.38Å; F318-F344 HydrophobicContact CD2-CE2 4.5Å; F318-F344 HydrophobicContact CD2-CZ 4.44Å; I321-F344 HydrophobicContact CD1-CB 3.68Å; I321-F344 HydrophobicContact CD1-CD1 4.02Å; I321-F344 HydrophobicContact CD1-CD2 4.23Å; I321-F344 HydrophobicContact CD1-CG 3.72Å; I321-F344 HydrophobicContact CG1-CB 4.37Å; N340-F344 WeakPolarHBondContact O-CB 3.46Å; N340-F344 PolarHBondContact O-N 3.18Å; L341-F344 WeakPolarHBondContact O-CB 3.47Å; L341-F344 PolarHBondContact O-N 3.35Å; T342-F344 VanDerWaalsContact C-N 3.34Å; T342-F344 PolarHBondContact O-N 2.99Å; F344-H347 WeakPolarHBondContact O-CB 3.37Å; F344-H347 PolarHBondContact O-N 2.95Å; F344-F348 PolarHBondContact O-N 3.09Å; F344-N389 WeakPolarHBondContact CE1-OD1 3.47Å; F344-N389 HydrophobicContact CZ-CB 4.08Å; F344-N389 VanDerWaalsContact CZ-ND2 3.29Å; F344-N389 WeakPolarHBondContact CZ-ND2 3.16Å; F344-L447 HydrophobicContact CD1-CD1 3.72Å; F344-L447 HydrophobicContact CD1-CG 4.3Å; F344-L447 HydrophobicContact CE1-CB 4.43Å; F344-L447 HydrophobicContact CE1-CD1 3.65Å; F344-L447 HydrophobicContact CE1-CG 3.77Å; F344-L447 HydrophobicContact CZ-CD1 4.48Å
345	T	92.8	Very high	91.1	Very high	13 Å²	13	43 Å²	43	8%	0.08	20%	0.202	C	C	.	.	H	α-helix	trans	-66.9	-39.6	176.5	-52.1	0	0	0	0	112.3	V112 F114 L341 T342 H347 F348 N349	V112-T345 HydrophobicContact CB-CG2 4.05Å; V112-T345 HydrophobicContact CG1-CG2 3.67Å; F114-T345 HydrophobicContact CD2-CG2 3.94Å; F114-T345 HydrophobicContact CE2-CG2 3.44Å; F114-T345 VanDerWaalsContact CE2-CG2 3.44Å; F114-T345 VanDerWaalsContact CE2-OG1 3.31Å; F114-T345 WeakPolarHBondContact CE2-OG1 3.24Å; F114-T345 HydrophobicContact CZ-CG2 4.18Å; L341-T345 PolarHBondContact O-N 3.29Å; L341-T345 PolarHBondContact O-OG1 3.45Å; T342-T345 PolarHBondContact O-N 2.96Å; T345-H347 VanDerWaalsContact C-N 3.27Å; T345-H347 PolarHBondContact O-N 2.89Å; T345-F348 WeakPolarHBondContact O-CB 3.45Å; T345-F348 PolarHBondContact O-N 3.36Å; T345-N349 PolarHBondContact O-N 3.19Å
346	N	89.9	Confident	91.1	Very high	71 Å²	71	40.4 Å²	40.4	38%	0.38	19%	0.189	S	C	.	.	H	α-helix	trans	-63.8	-35.6	173.6	-76.7	-25.3	0	0	0	111.6	T342 V343 N349 K350	T342-N346 WeakPolarHBondContact CG2-ND2 3.42Å; T342-N346 VanDerWaalsContact O-CB 3.23Å; T342-N346 WeakPolarHBondContact O-CB 3.45Å; T342-N346 PolarHBondContact O-N 3.31Å; T342-N346 PolarHBondContact O-ND2 3.41Å; V343-N346 PolarHBondContact O-N 3.2Å; N346-N349 PolarHBondContact O-N 3.17Å; N346-K350 WeakPolarHBondContact O-CB 3.35Å; N346-K350 VanDerWaalsContact O-CG 3.26Å; N346-K350 WeakPolarHBondContact O-CG 3.38Å; N346-K350 PolarHBondContact O-N 3.11Å
347	H	93.8	Very high	91	Very high	11 Å²	11	32.3 Å²	32.3	5%	0.051	16%	0.163	C	C	.	.	H	α-helix	trans	-62.9	-44.4	173.1	-175.4	60.6	0	0	0	111.7	F5 D314 Y317 V343 F344 T345 N349 K350 M351	F5-H347 AromaticContact CE1-CE1 3.66Å; F5-H347 AromaticContact CE2-CE1 3.8Å; F5-H347 AromaticContact CZ-CE1 3.4Å; F5-H347 WeakPolarHBondContact CZ-CE1 3.46Å; D314-H347 IonicContact OD1-CD2 3.95Å; D314-H347 PolarHBondContact OD1-CD2 3.48Å; D314-H347 IonicContact OD1-NE2 2.84Å; Y317-H347 HydrophobicContact CD2-CB 4.08Å; Y317-H347 AromaticContact CD2-CD2 3.87Å; Y317-H347 AromaticContact CD2-CG 3.81Å; Y317-H347 HydrophobicContact CE2-CB 4.24Å; Y317-H347 AromaticContact CE2-CG 3.84Å; Y317-H347 AromaticContact CE2-ND1 3.85Å; V343-H347 WeakPolarHBondContact O-CB 3.4Å; V343-H347 PolarHBondContact O-N 3.01Å; F344-H347 WeakPolarHBondContact O-CB 3.37Å; F344-H347 PolarHBondContact O-N 2.95Å; T345-H347 VanDerWaalsContact C-N 3.27Å; T345-H347 PolarHBondContact O-N 2.89Å; H347-N349 PolarHBondContact O-N 3.45Å; H347-K350 PolarHBondContact O-N 2.96Å; H347-M351 WeakPolarHBondContact NE2-CE 3.25Å; H347-M351 WeakPolarHBondContact O-CB 3.47Å; H347-M351 PolarHBondContact O-N 3.38Å
348	F	95.7	Very high	91	Very high	6 Å²	6	28.3 Å²	28.3	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-56.2	-49.4	172.7	178	-78.3	0	0	0	112	V112 F344 T345 M351 S352 N389 L392 A393 Y446	V112-F348 HydrophobicContact CB-CD1 4.39Å; V112-F348 HydrophobicContact CG2-CD1 3.62Å; V112-F348 HydrophobicContact CG2-CE1 3.35Å; V112-F348 HydrophobicContact CG2-CZ 4.16Å; F344-F348 PolarHBondContact O-N 3.09Å; T345-F348 WeakPolarHBondContact O-CB 3.45Å; T345-F348 PolarHBondContact O-N 3.36Å; F348-M351 WeakPolarHBondContact O-CB 3.49Å; F348-M351 PolarHBondContact O-N 3.3Å; F348-S352 PolarHBondContact O-N 3.49Å; F348-S352 VanDerWaalsContact O-N 3.15Å; F348-N389 WeakPolarHBondContact CD2-OD1 3.27Å; F348-N389 VanDerWaalsContact CE2-O 3.28Å; F348-N389 WeakPolarHBondContact CE2-O 3.33Å; F348-L392 HydrophobicContact CE2-CB 4.26Å; F348-A393 HydrophobicContact CD1-CB 4.37Å; F348-A393 HydrophobicContact CD2-CB 3.61Å; F348-A393 HydrophobicContact CE1-CB 4.28Å; F348-A393 HydrophobicContact CE2-CB 3.56Å; F348-A393 VanDerWaalsContact CE2-N 3.34Å; F348-A393 HydrophobicContact CG-CB 4.03Å; F348-A393 HydrophobicContact CZ-CB 3.91Å; F348-Y446 HydrophobicContact CD2-CD2 4.31Å; F348-Y446 HydrophobicContact CD2-CE2 4.37Å; F348-Y446 AromaticContact CE2-CD2 3.77Å; F348-Y446 HydrophobicContact CE2-CD2 3.77Å; F348-Y446 AromaticContact CE2-CE2 3.78Å; F348-Y446 HydrophobicContact CE2-CE2 3.78Å; F348-Y446 HydrophobicContact CZ-CD2 4.3Å; F348-Y446 AromaticContact CZ-CE2 3.88Å; F348-Y446 HydrophobicContact CZ-CE2 3.88Å
349	N	86.6	Confident	91	Very high	11 Å²	11	28.3 Å²	28.3	6%	0.059	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-46.1	-179.9	-71.6	-30.7	0	0	0	111.4	V112 T345 N346 H347 M351 S352 Y353	V112-N349 WeakPolarHBondContact CB-OD1 3.18Å; V112-N349 PolarHBondContact N-OD1 3.35Å; V112-N349 PolarHBondContact O-ND2 2.91Å; T345-N349 PolarHBondContact O-N 3.19Å; N346-N349 PolarHBondContact O-N 3.17Å; H347-N349 PolarHBondContact O-N 3.45Å; N349-M351 PolarHBondContact O-N 2.94Å; N349-S352 PolarHBondContact O-N 3.5Å; N349-S352 VanDerWaalsContact O-N 3.11Å; N349-Y353 WeakPolarHBondContact O-CD2 3.4Å; N349-Y353 PolarHBondContact O-N 3.28Å
350	K	87.3	Confident	90.8	Very high	95 Å²	95	29.6 Å²	29.6	41%	0.413	15%	0.146	S	C	.	.	H	α-helix	trans	-58.4	-36.4	176.1	-76.6	177.2	178	179.9	0	112.2	F5 N346 H347 W354	F5-K350 HydrophobicContact CD1-CB 4.1Å; N346-K350 WeakPolarHBondContact O-CB 3.35Å; N346-K350 VanDerWaalsContact O-CG 3.26Å; N346-K350 WeakPolarHBondContact O-CG 3.38Å; N346-K350 PolarHBondContact O-N 3.11Å; H347-K350 PolarHBondContact O-N 2.96Å; K350-W354 VanDerWaalsContact O-CB 3.28Å; K350-W354 WeakPolarHBondContact O-CB 3.33Å; K350-W354 PolarHBondContact O-N 3.44Å
351	M	91.9	Very high	90.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58	-53	172.8	-166.4	72.1	67.1	0	0	112	F5 L310 H347 F348 N349 Y353 W354 V355 S390 A393	F5-M351 HydrophobicContact CE1-CB 4.12Å; F5-M351 HydrophobicContact CE1-CE 3.49Å; F5-M351 VanDerWaalsContact CE1-CE 3.49Å; F5-M351 HydrophobicContact CE1-CG 4.45Å; F5-M351 HydrophobicContact CE1-SD 3.37Å; F5-M351 WeakPolarHBondContact CE1-SD 3.41Å; F5-M351 HydrophobicContact CE2-CE 4.49Å; F5-M351 HydrophobicContact CZ-CE 3.25Å; F5-M351 HydrophobicContact CZ-SD 3.31Å; F5-M351 WeakPolarHBondContact CZ-SD 3.38Å; L310-M351 HydrophobicContact CD1-SD 4.47Å; L310-M351 HydrophobicContact CD2-CE 3.21Å; L310-M351 HydrophobicContact CD2-SD 3.04Å; L310-M351 WeakPolarHBondContact CD2-SD 3.28Å; L310-M351 HydrophobicContact CG-SD 4.36Å; H347-M351 WeakPolarHBondContact NE2-CE 3.25Å; H347-M351 WeakPolarHBondContact O-CB 3.47Å; H347-M351 PolarHBondContact O-N 3.38Å; F348-M351 WeakPolarHBondContact O-CB 3.49Å; F348-M351 PolarHBondContact O-N 3.3Å; N349-M351 PolarHBondContact O-N 2.94Å; M351-Y353 VanDerWaalsContact C-N 3.34Å; M351-Y353 PolarHBondContact O-N 2.66Å; M351-W354 WeakPolarHBondContact O-CB 3.31Å; M351-W354 PolarHBondContact O-N 2.96Å; M351-W354 HydrophobicContact SD-CE3 4.09Å; M351-W354 HydrophobicContact SD-CZ3 4.35Å; M351-V355 WeakPolarHBondContact O-CG2 3.39Å; M351-V355 PolarHBondContact O-N 2.88Å; M351-S390 WeakPolarHBondContact CE-OG 3.46Å; M351-A393 HydrophobicContact CB-CB 3.91Å; M351-A393 HydrophobicContact CG-CB 3.88Å
352	S	90.1	Very high	90	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-60.7	-46.7	-177.1	-179.2	0	0	0	0	110.6	F348 N349 W354 V355 R356 A393 A397	F348-S352 PolarHBondContact O-N 3.49Å; F348-S352 VanDerWaalsContact O-N 3.15Å; N349-S352 PolarHBondContact O-N 3.5Å; N349-S352 VanDerWaalsContact O-N 3.11Å; S352-W354 PolarHBondContact O-N 3.25Å; S352-V355 PolarHBondContact O-N 3.35Å; S352-R356 WeakPolarHBondContact O-CG 3.35Å; S352-R356 PolarHBondContact O-N 2.99Å; S352-R356 VanDerWaalsContact O-N 3.09Å; S352-R356 PolarHBondContact OG-NH2 2.77Å; S352-A393 WeakPolarHBondContact CB-O 3.32Å; S352-A393 PolarHBondContact OG-O 3.44Å; S352-A397 VanDerWaalsContact O-CB 3.28Å; S352-A397 WeakPolarHBondContact O-CB 3.39Å; S352-A397 PolarHBondContact OG-N 3.44Å
353	Y	86.8	Confident	89.7	Confident	88 Å²	88	41 Å²	41	35%	0.345	20%	0.195	S	C	.	.	H	α-helix	trans	-62.2	-41.6	175	-73.4	-64.4	0	0	0	113.1	H111 N349 M351 V355 R356 T357	H111-Y353 PolarHBondContact CD2-OH 3.32Å; N349-Y353 WeakPolarHBondContact O-CD2 3.4Å; N349-Y353 PolarHBondContact O-N 3.28Å; M351-Y353 VanDerWaalsContact C-N 3.34Å; M351-Y353 PolarHBondContact O-N 2.66Å; Y353-V355 VanDerWaalsContact C-N 3.34Å; Y353-V355 PolarHBondContact O-N 3.1Å; Y353-R356 PolarHBondContact O-N 3.26Å; Y353-T357 WeakPolarHBondContact O-CB 3.22Å; Y353-T357 PolarHBondContact O-N 3.31Å; Y353-T357 PolarHBondContact O-OG1 3.15Å; Y353-T357 VanDerWaalsContact O-OG1 3.07Å
354	W	89.5	Confident	89.6	Confident	9 Å²	9	44.4 Å²	44.4	3%	0.034	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-46.8	176.6	166.7	67.6	0	0	0	111.7	L4 V298 I306 K350 M351 S352 R356 T357 R358 F375	L4-W354 HydrophobicContact CB-CZ2 4.15Å; L4-W354 HydrophobicContact CD1-CZ2 4.05Å; L4-W354 HydrophobicContact CD2-CZ2 3.91Å; L4-W354 HydrophobicContact CG-CZ2 4.25Å; L4-W354 PolarHBondContact O-NE1 3.19Å; V298-W354 HydrophobicContact CG2-CH2 4.16Å; V298-W354 HydrophobicContact CG2-CZ2 4Å; I306-W354 HydrophobicContact CG2-CH2 4.09Å; K350-W354 VanDerWaalsContact O-CB 3.28Å; K350-W354 WeakPolarHBondContact O-CB 3.33Å; K350-W354 PolarHBondContact O-N 3.44Å; M351-W354 WeakPolarHBondContact O-CB 3.31Å; M351-W354 PolarHBondContact O-N 2.96Å; M351-W354 HydrophobicContact SD-CE3 4.09Å; M351-W354 HydrophobicContact SD-CZ3 4.35Å; S352-W354 PolarHBondContact O-N 3.25Å; W354-R356 PolarHBondContact O-N 3.35Å; W354-T357 PolarHBondContact O-N 3.31Å; W354-R358 HydrophobicContact CZ2-CG 4.47Å; W354-R358 WeakPolarHBondContact O-CG 3.49Å; W354-R358 PolarHBondContact O-N 3.46Å; W354-F375 HydrophobicContact CE3-CE1 4.27Å; W354-F375 AromaticContact CH2-CE1 3.63Å; W354-F375 HydrophobicContact CH2-CE1 3.63Å; W354-F375 AromaticContact CH2-CZ 3.99Å; W354-F375 HydrophobicContact CH2-CZ 3.99Å; W354-F375 HydrophobicContact CZ2-CE1 4.37Å; W354-F375 HydrophobicContact CZ2-CZ 4.28Å; W354-F375 AromaticContact CZ3-CE1 3.57Å; W354-F375 HydrophobicContact CZ3-CE1 3.57Å; W354-F375 HydrophobicContact CZ3-CZ 4.14Å
355	V	94.1	Very high	89.5	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-48.7	177.3	174.4	0	0	0	0	110.8	M351 S352 Y353 T357 R358 I359 F375 V394 A397 L398	M351-V355 WeakPolarHBondContact O-CG2 3.39Å; M351-V355 PolarHBondContact O-N 2.88Å; S352-V355 PolarHBondContact O-N 3.35Å; Y353-V355 VanDerWaalsContact C-N 3.34Å; Y353-V355 PolarHBondContact O-N 3.1Å; V355-T357 PolarHBondContact O-N 2.95Å; V355-R358 PolarHBondContact O-N 2.88Å; V355-I359 HydrophobicContact CG1-CD1 3.97Å; V355-I359 WeakPolarHBondContact O-CG1 3.33Å; V355-I359 PolarHBondContact O-N 3.34Å; V355-I359 VanDerWaalsContact O-N 3.16Å; V355-F375 HydrophobicContact CB-CD1 4.43Å; V355-F375 HydrophobicContact CB-CE1 4.22Å; V355-F375 HydrophobicContact CB-CE2 4.49Å; V355-F375 HydrophobicContact CB-CZ 4.23Å; V355-F375 HydrophobicContact CG1-CB 4.37Å; V355-F375 HydrophobicContact CG1-CD1 3.91Å; V355-F375 HydrophobicContact CG1-CD2 3.76Å; V355-F375 HydrophobicContact CG1-CE1 4.1Å; V355-F375 HydrophobicContact CG1-CE2 3.93Å; V355-F375 HydrophobicContact CG1-CG 3.74Å; V355-F375 HydrophobicContact CG1-CZ 4.09Å; V355-F375 HydrophobicContact CG2-CD1 3.86Å; V355-F375 HydrophobicContact CG2-CE1 3.62Å; V355-F375 HydrophobicContact CG2-CZ 4.08Å; V355-V394 HydrophobicContact CG1-CG1 4.28Å; V355-V394 HydrophobicContact CG2-CG1 4.29Å; V355-V394 HydrophobicContact CG2-CG2 4.09Å; V355-A397 HydrophobicContact CB-CB 3.5Å; V355-A397 VanDerWaalsContact CB-CB 3.5Å; V355-A397 HydrophobicContact CG1-CB 3.49Å; V355-A397 VanDerWaalsContact CG1-CB 3.49Å; V355-A397 HydrophobicContact CG2-CB 4.31Å; V355-L398 HydrophobicContact CG1-CD2 3.99Å
356	R	89	Confident	89.5	Confident	14 Å²	14	54.8 Å²	54.8	5%	0.053	25%	0.247	C	C	.	.	H	α-helix	trans	-56.3	-51.3	177.9	-68	175.6	-173.4	150.5	10.5	111	N110 S352 Y353 W354 R358 I359 M360 A396 A397	N110-R356 VanDerWaalsContact CB-NH2 3.34Å; N110-R356 VanDerWaalsContact CG-NH2 3.31Å; N110-R356 PolarHBondContact O-NH1 3.39Å; N110-R356 PolarHBondContact O-NH2 3.08Å; N110-R356 PolarHBondContact OD1-NH2 3.3Å; S352-R356 WeakPolarHBondContact O-CG 3.35Å; S352-R356 PolarHBondContact O-N 2.99Å; S352-R356 VanDerWaalsContact O-N 3.09Å; S352-R356 PolarHBondContact OG-NH2 2.77Å; Y353-R356 PolarHBondContact O-N 3.26Å; W354-R356 PolarHBondContact O-N 3.35Å; R356-R358 VanDerWaalsContact C-N 3.35Å; R356-R358 PolarHBondContact O-N 3.46Å; R356-I359 PolarHBondContact O-N 2.82Å; R356-M360 HydrophobicContact CB-CE 4.07Å; R356-M360 WeakPolarHBondContact O-CB 3.42Å; R356-M360 VanDerWaalsContact O-CG 3.31Å; R356-M360 WeakPolarHBondContact O-CG 3.38Å; R356-M360 PolarHBondContact O-N 2.91Å; R356-A396 PolarHBondContact NH2-O 3.25Å; R356-A397 HydrophobicContact CG-CB 3.88Å
357	T	85.5	Confident	89.6	Confident	42 Å²	42	54.1 Å²	54.1	26%	0.258	24%	0.241	S	C	.	.	H	α-helix	trans	-58.1	-45.8	-179.9	-63.2	0	0	0	0	111.3	Y353 W354 V355 I359 M360 E361	Y353-T357 WeakPolarHBondContact O-CB 3.22Å; Y353-T357 PolarHBondContact O-N 3.31Å; Y353-T357 PolarHBondContact O-OG1 3.15Å; Y353-T357 VanDerWaalsContact O-OG1 3.07Å; W354-T357 PolarHBondContact O-N 3.31Å; V355-T357 PolarHBondContact O-N 2.95Å; T357-I359 VanDerWaalsContact C-N 3.3Å; T357-I359 PolarHBondContact O-N 3.4Å; T357-M360 PolarHBondContact O-N 3.23Å; T357-E361 HydrophobicContact CG2-CG 4.05Å; T357-E361 WeakPolarHBondContact CG2-OE1 3.36Å; T357-E361 WeakPolarHBondContact O-CB 3.33Å; T357-E361 VanDerWaalsContact O-CG 3.23Å; T357-E361 WeakPolarHBondContact O-CG 3.24Å; T357-E361 PolarHBondContact O-N 2.95Å
358	R	87.7	Confident	89.6	Confident	30 Å²	30	55.6 Å²	55.6	11%	0.113	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-35.6	179.3	-67.9	-49.2	177.3	-179.8	3.1	114.2	M7 W354 V355 R356 E361 F375	M7-R358 PolarHBondContact SD-NH1 2.79Å; M7-R358 VanDerWaalsContact SD-NH1 3.38Å; M7-R358 PolarHBondContact SD-NH2 3.21Å; W354-R358 HydrophobicContact CZ2-CG 4.47Å; W354-R358 WeakPolarHBondContact O-CG 3.49Å; W354-R358 PolarHBondContact O-N 3.46Å; V355-R358 PolarHBondContact O-N 2.88Å; R356-R358 VanDerWaalsContact C-N 3.35Å; R356-R358 PolarHBondContact O-N 3.46Å; R358-E361 WeakPolarHBondContact CD-OE2 3.32Å; R358-E361 IonicContact CZ-OE2 2.69Å; R358-E361 IonicContact NE-OE2 3.54Å; R358-E361 IonicContact NH1-OE1 3.53Å; R358-E361 IonicContact NH1-OE2 2.84Å; R358-E361 PolarHBondContact NH1-OE2 2.56Å; R358-F375 HydrophobicContact CB-CE2 4.04Å; R358-F375 HydrophobicContact CB-CZ 4.13Å; R358-F375 HydrophobicContact CG-CZ 4.47Å
359	I	91.7	Very high	89.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-72.7	-44.2	176.7	-65.9	171.7	0	0	0	109.8	V355 R356 T357 S362 R368 C371 F372 F375 L398 L403 W408	V355-I359 HydrophobicContact CG1-CD1 3.97Å; V355-I359 WeakPolarHBondContact O-CG1 3.33Å; V355-I359 PolarHBondContact O-N 3.34Å; V355-I359 VanDerWaalsContact O-N 3.16Å; R356-I359 PolarHBondContact O-N 2.82Å; T357-I359 VanDerWaalsContact C-N 3.3Å; T357-I359 PolarHBondContact O-N 3.4Å; I359-S362 WeakPolarHBondContact O-CB 3.38Å; I359-S362 PolarHBondContact O-N 2.86Å; I359-R368 HydrophobicContact CG2-CG 3.49Å; I359-R368 VanDerWaalsContact CG2-CG 3.49Å; I359-C371 HydrophobicContact CG1-CB 4.13Å; I359-F372 HydrophobicContact CD1-CD2 4.19Å; I359-F375 HydrophobicContact CD1-CD2 3.84Å; I359-F375 HydrophobicContact CD1-CE2 4.31Å; I359-F375 HydrophobicContact CG1-CD2 3.91Å; I359-F375 HydrophobicContact CG1-CE2 3.99Å; I359-L398 HydrophobicContact CD1-CD2 3.36Å; I359-L403 HydrophobicContact CB-CD1 4.3Å; I359-L403 HydrophobicContact CB-CD2 4.19Å; I359-L403 HydrophobicContact CD1-CD1 3.67Å; I359-L403 HydrophobicContact CG2-CD1 4.16Å; I359-L403 HydrophobicContact CG2-CD2 3.59Å; I359-W408 HydrophobicContact CG2-CH2 3.62Å; I359-W408 HydrophobicContact CG2-CZ2 4.37Å
360	M	86.6	Confident	90	Very high	92 Å²	92	63.7 Å²	63.7	45%	0.453	28%	0.279	S	S	.	.	H	α-helix	trans	-73.9	-26.4	-177.1	-65.7	-174.2	-55	0	0	114	R356 T357 S362 P402 L403	R356-M360 HydrophobicContact CB-CE 4.07Å; R356-M360 WeakPolarHBondContact O-CB 3.42Å; R356-M360 VanDerWaalsContact O-CG 3.31Å; R356-M360 WeakPolarHBondContact O-CG 3.38Å; R356-M360 PolarHBondContact O-N 2.91Å; T357-M360 PolarHBondContact O-N 3.23Å; M360-S362 PolarHBondContact O-N 3Å; M360-P402 HydrophobicContact SD-CB 4.28Å; M360-L403 HydrophobicContact CG-CD2 3.88Å
361	E	84.8	Confident	90.4	Very high	89 Å²	89	59.3 Å²	59.3	42%	0.416	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.5	173.1	-81.9	173.6	173.9	0	0	112.5	M7 T357 R358 K363	M7-E361 WeakPolarHBondContact CE-OE1 2.82Å; T357-E361 HydrophobicContact CG2-CG 4.05Å; T357-E361 WeakPolarHBondContact CG2-OE1 3.36Å; T357-E361 WeakPolarHBondContact O-CB 3.33Å; T357-E361 VanDerWaalsContact O-CG 3.23Å; T357-E361 WeakPolarHBondContact O-CG 3.24Å; T357-E361 PolarHBondContact O-N 2.95Å; R358-E361 WeakPolarHBondContact CD-OE2 3.32Å; R358-E361 IonicContact CZ-OE2 2.69Å; R358-E361 IonicContact NE-OE2 3.54Å; R358-E361 IonicContact NH1-OE1 3.53Å; R358-E361 IonicContact NH1-OE2 2.84Å; R358-E361 PolarHBondContact NH1-OE2 2.56Å; E361-K363 PolarHBondContact O-N 3.36Å
362	S	85.6	Confident	90.6	Very high	16 Å²	16	59.4 Å²	59.4	11%	0.112	26%	0.26	C	S	.	.			trans	-73.6	113.7	178.8	-58.3	0	0	0	0	110.7	I359 M360 R368	I359-S362 WeakPolarHBondContact O-CB 3.38Å; I359-S362 PolarHBondContact O-N 2.86Å; M360-S362 PolarHBondContact O-N 3Å; S362-R368 PolarHBondContact O-NH2 2.86Å; S362-R368 VanDerWaalsContact O-NH2 3.14Å
363	K	84.7	Confident	90.9	Very high	205 Å²	205	61.7 Å²	61.7	89%	0.891	28%	0.275	S	S	*	.			trans	-70.5	-36.9	178.2	-64.5	-174.5	179.5	-177	0	112.7	E361	E361-K363 PolarHBondContact O-N 3.36Å
364	E	91.2	Very high	91.4	Very high	137 Å²	137	59.1 Å²	59.1	64%	0.64	27%	0.265	S	S	*	.	S	Bend	trans	-91.1	134.4	-179.5	-63.3	-172.6	174	0	0	111.5	R366 E367 R368	E364-R366 VanDerWaalsContact C-N 3.28Å; E364-R366 PolarHBondContact O-N 3.37Å; E364-E367 HydrophobicContact CB-CB 4.3Å; E364-E367 PolarHBondContact O-N 3.25Å; E364-E367 VanDerWaalsContact O-N 3.13Å; E364-R368 PolarHBondContact O-N 2.87Å
365	Q	93.6	Very high	91.8	Very high	58 Å²	58	58.7 Å²	58.7	27%	0.271	26%	0.263	S	S	.	.	H	α-helix	trans	-57	-40.7	178.2	177.7	56.6	26	0	0	112.3	E367 R368 E369 D407	Q365-E367 VanDerWaalsContact C-N 3.3Å; Q365-E367 PolarHBondContact O-N 3.06Å; Q365-R368 WeakPolarHBondContact O-CB 3.5Å; Q365-R368 PolarHBondContact O-N 3.37Å; Q365-E369 PolarHBondContact NE2-OE1 2.85Å; Q365-E369 WeakPolarHBondContact O-CG 3.33Å; Q365-E369 PolarHBondContact O-N 3.44Å; Q365-D407 PolarHBondContact NE2-O 2.84Å
366	R	93.1	Very high	92	Very high	176 Å²	176	58.8 Å²	58.8	66%	0.664	26%	0.264	S	S	*	.	H	α-helix	trans	-61.8	-37.6	178.4	-169.3	179.1	-171.8	-179.7	2.6	112.8	E364 R370	E364-R366 VanDerWaalsContact C-N 3.28Å; E364-R366 PolarHBondContact O-N 3.37Å; R366-R370 WeakPolarHBondContact O-CG 2.98Å; R366-R370 PolarHBondContact O-N 3.04Å
367	E	92	Very high	92.4	Very high	56 Å²	56	63 Å²	63	26%	0.262	28%	0.282	S	S	.	.	H	α-helix	trans	-74.1	-39	177.8	-171.3	67.3	175.4	0	0	111.1	L299 E364 Q365 E369 R370 C371	L299-E367 WeakPolarHBondContact CD1-OE1 3.41Å; E364-E367 HydrophobicContact CB-CB 4.3Å; E364-E367 PolarHBondContact O-N 3.25Å; E364-E367 VanDerWaalsContact O-N 3.13Å; Q365-E367 VanDerWaalsContact C-N 3.3Å; Q365-E367 PolarHBondContact O-N 3.06Å; E367-E369 VanDerWaalsContact C-N 3.32Å; E367-E369 PolarHBondContact O-N 2.85Å; E367-R370 WeakPolarHBondContact O-CB 3.44Å; E367-R370 PolarHBondContact O-N 3.24Å; E367-R370 VanDerWaalsContact O-N 3.14Å; E367-R370 VanDerWaalsContact OE2-CD 3.26Å; E367-R370 WeakPolarHBondContact OE2-CD 3.44Å; E367-R370 IonicContact OE2-CZ 2.83Å; E367-R370 IonicContact OE2-NE 2.79Å; E367-R370 IonicContact OE2-NH1 3.7Å; E367-R370 PolarHBondContact OE2-NH1 3.5Å; E367-C371 PolarHBondContact O-N 2.98Å
368	R	94.3	Very high	93	Very high	42 Å²	42	61 Å²	61	16%	0.158	27%	0.27	C	S	.	.	H	α-helix	trans	-57.2	-45.2	173.4	-169.2	-176.3	-62.9	140	0.4	112	I359 S362 E364 Q365 R370 C371 F372 L406 W408	I359-R368 HydrophobicContact CG2-CG 3.49Å; I359-R368 VanDerWaalsContact CG2-CG 3.49Å; S362-R368 PolarHBondContact O-NH2 2.86Å; S362-R368 VanDerWaalsContact O-NH2 3.14Å; E364-R368 PolarHBondContact O-N 2.87Å; Q365-R368 WeakPolarHBondContact O-CB 3.5Å; Q365-R368 PolarHBondContact O-N 3.37Å; R368-R370 PolarHBondContact O-N 3.36Å; R368-C371 WeakPolarHBondContact O-CB 3.29Å; R368-C371 PolarHBondContact O-N 3.25Å; R368-F372 PolarHBondContact O-N 3.31Å; R368-L406 VanDerWaalsContact CD-CD1 3.46Å; R368-W408 HydrophobicContact CG-CH2 3.54Å; R368-W408 HydrophobicContact CG-CZ3 3.8Å
369	E	95.7	Very high	93.5	Very high	60 Å²	60	59.5 Å²	59.5	28%	0.28	27%	0.265	S	S	.	.	H	α-helix	trans	-61.4	-41.4	175.1	-74.1	173	-162.2	0	0	112.4	Q365 E367 C371 F372 V373 W408 P409	Q365-E369 PolarHBondContact NE2-OE1 2.85Å; Q365-E369 WeakPolarHBondContact O-CG 3.33Å; Q365-E369 PolarHBondContact O-N 3.44Å; E367-E369 VanDerWaalsContact C-N 3.32Å; E367-E369 PolarHBondContact O-N 2.85Å; E369-C371 VanDerWaalsContact C-N 3.33Å; E369-C371 PolarHBondContact O-N 2.86Å; E369-F372 PolarHBondContact O-N 2.89Å; E369-V373 WeakPolarHBondContact O-CB 3.48Å; E369-V373 WeakPolarHBondContact O-CG2 3.11Å; E369-V373 PolarHBondContact O-N 3.01Å; E369-W408 HydrophobicContact CG-CE3 4.18Å; E369-W408 HydrophobicContact CG-CZ3 4.42Å; E369-P409 HydrophobicContact CG-CG 4.43Å
370	R	94.8	Very high	93.8	Very high	127 Å²	127	64.6 Å²	64.6	48%	0.479	28%	0.284	S	S	.	.	H	α-helix	trans	-60.9	-43.1	175	-71.4	168.2	179.8	170.5	-1.5	111.4	R366 E367 R368 K374	R366-R370 WeakPolarHBondContact O-CG 2.98Å; R366-R370 PolarHBondContact O-N 3.04Å; E367-R370 WeakPolarHBondContact O-CB 3.44Å; E367-R370 PolarHBondContact O-N 3.24Å; E367-R370 VanDerWaalsContact O-N 3.14Å; E367-R370 VanDerWaalsContact OE2-CD 3.26Å; E367-R370 WeakPolarHBondContact OE2-CD 3.44Å; E367-R370 IonicContact OE2-CZ 2.83Å; E367-R370 IonicContact OE2-NE 2.79Å; E367-R370 IonicContact OE2-NH1 3.7Å; E367-R370 PolarHBondContact OE2-NH1 3.5Å; R368-R370 PolarHBondContact O-N 3.36Å; R370-K374 VanDerWaalsContact O-CB 3.32Å; R370-K374 WeakPolarHBondContact O-CB 3.27Å; R370-K374 PolarHBondContact O-N 3.47Å
371	C	94.9	Very high	94.4	Very high	4 Å²	4	62.1 Å²	62.1	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-62.5	-46.6	174.7	-74	0	0	0	0	111.7	I359 E367 R368 E369 V373 K374 F375	I359-C371 HydrophobicContact CG1-CB 4.13Å; E367-C371 PolarHBondContact O-N 2.98Å; R368-C371 WeakPolarHBondContact O-CB 3.29Å; R368-C371 PolarHBondContact O-N 3.25Å; E369-C371 VanDerWaalsContact C-N 3.33Å; E369-C371 PolarHBondContact O-N 2.86Å; C371-V373 PolarHBondContact O-N 3.24Å; C371-K374 VanDerWaalsContact O-CB 3.23Å; C371-K374 WeakPolarHBondContact O-CB 3.28Å; C371-K374 PolarHBondContact O-N 2.94Å; C371-K374 VanDerWaalsContact O-N 3.14Å; C371-F375 WeakPolarHBondContact O-CD2 3.24Å; C371-F375 PolarHBondContact O-N 3.11Å
372	F	96.7	Very high	95	Very high	1 Å²	1	57.9 Å²	57.9	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-59.2	-49.4	177.6	-169.4	-83	0	0	0	112	I359 R368 E369 K374 F375 L376 L398 W408 A412 L416	I359-F372 HydrophobicContact CD1-CD2 4.19Å; R368-F372 PolarHBondContact O-N 3.31Å; E369-F372 PolarHBondContact O-N 2.89Å; F372-K374 VanDerWaalsContact C-N 3.27Å; F372-K374 PolarHBondContact O-N 3.2Å; F372-F375 PolarHBondContact O-N 3.48Å; F372-F375 VanDerWaalsContact O-N 3.11Å; F372-L376 HydrophobicContact CD1-CD1 3.95Å; F372-L376 HydrophobicContact CD1-CG 4.25Å; F372-L376 HydrophobicContact CE1-CD1 3.81Å; F372-L376 HydrophobicContact CE1-CD2 4.49Å; F372-L376 HydrophobicContact CE1-CG 4.13Å; F372-L376 PolarHBondContact O-N 3.29Å; F372-L398 HydrophobicContact CD2-CD2 3.75Å; F372-L398 HydrophobicContact CE2-CB 3.98Å; F372-L398 HydrophobicContact CE2-CD2 3.78Å; F372-L398 HydrophobicContact CE2-CG 4.29Å; F372-L398 HydrophobicContact CG-CD2 4.38Å; F372-L398 HydrophobicContact CZ-CB 4.18Å; F372-L398 HydrophobicContact CZ-CD1 4.39Å; F372-L398 HydrophobicContact CZ-CD2 4.44Å; F372-W408 HydrophobicContact CB-CE3 3.77Å; F372-W408 HydrophobicContact CB-CH2 3.95Å; F372-W408 HydrophobicContact CB-CZ3 3.37Å; F372-W408 HydrophobicContact CD1-CD2 4.48Å; F372-W408 HydrophobicContact CD1-CE3 4.21Å; F372-W408 AromaticContact CD2-CD2 3.81Å; F372-W408 HydrophobicContact CD2-CD2 3.81Å; F372-W408 AromaticContact CD2-CE2 3.72Å; F372-W408 AromaticContact CD2-CE3 3.75Å; F372-W408 HydrophobicContact CD2-CE3 3.75Å; F372-W408 AromaticContact CD2-CH2 3.49Å; F372-W408 HydrophobicContact CD2-CH2 3.49Å; F372-W408 VanDerWaalsContact CD2-CH2 3.49Å; F372-W408 AromaticContact CD2-CZ2 3.57Å; F372-W408 HydrophobicContact CD2-CZ2 3.57Å; F372-W408 AromaticContact CD2-CZ3 3.6Å; F372-W408 HydrophobicContact CD2-CZ3 3.6Å; F372-W408 AromaticContact CE2-CD2 3.97Å; F372-W408 HydrophobicContact CE2-CD2 3.97Å; F372-W408 AromaticContact CE2-CE2 3.74Å; F372-W408 HydrophobicContact CE2-CE3 4.36Å; F372-W408 HydrophobicContact CE2-CG 4.46Å; F372-W408 HydrophobicContact CE2-CH2 4.3Å; F372-W408 AromaticContact CE2-CZ2 3.93Å; F372-W408 HydrophobicContact CE2-CZ2 3.93Å; F372-W408 HydrophobicContact CG-CD2 4.08Å; F372-W408 AromaticContact CG-CE3 3.66Å; F372-W408 HydrophobicContact CG-CE3 3.66Å; F372-W408 HydrophobicContact CG-CH2 4.02Å; F372-W408 HydrophobicContact CG-CZ2 4.43Å; F372-W408 AromaticContact CG-CZ3 3.63Å; F372-W408 HydrophobicContact CG-CZ3 3.63Å; F372-W408 HydrophobicContact CZ-CD2 4.36Å; F372-W408 HydrophobicContact CZ-CG 4.46Å; F372-A412 HydrophobicContact CD1-CB 4.07Å; F372-A412 HydrophobicContact CE1-CB 3.96Å; F372-L416 HydrophobicContact CZ-CD2 4.14Å
373	V	96.5	Very high	95.5	Very high	50 Å²	50	61.8 Å²	61.8	30%	0.303	26%	0.264	S	S	.	.	H	α-helix	trans	-63.7	-32.9	176.3	173	0	0	0	0	111.7	E369 C371 F375 L376 K377 A412	E369-V373 WeakPolarHBondContact O-CB 3.48Å; E369-V373 WeakPolarHBondContact O-CG2 3.11Å; E369-V373 PolarHBondContact O-N 3.01Å; C371-V373 PolarHBondContact O-N 3.24Å; V373-F375 VanDerWaalsContact C-N 3.34Å; V373-L376 PolarHBondContact O-N 3.12Å; V373-K377 WeakPolarHBondContact O-CG 3.23Å; V373-K377 PolarHBondContact O-N 3.49Å; V373-A412 HydrophobicContact CG2-CB 4.4Å
374	K	96.7	Very high	96.1	Very high	34 Å²	34	59.2 Å²	59.2	15%	0.148	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-44.9	173	-171.6	77.9	171.9	-151.6	0	111.1	L299 F301 S303 R370 C371 F372 K377 I378	L299-K374 HydrophobicContact CD2-CB 4.08Å; L299-K374 HydrophobicContact CD2-CD 4.25Å; L299-K374 HydrophobicContact CD2-CG 4.17Å; L299-K374 PolarHBondContact O-NZ 3.1Å; L299-K374 VanDerWaalsContact O-NZ 3.09Å; F301-K374 WeakPolarHBondContact O-CE 3.46Å; F301-K374 PolarHBondContact O-NZ 2.87Å; S303-K374 WeakPolarHBondContact OG-CD 3.47Å; S303-K374 WeakPolarHBondContact OG-CE 3.33Å; R370-K374 VanDerWaalsContact O-CB 3.32Å; R370-K374 WeakPolarHBondContact O-CB 3.27Å; R370-K374 PolarHBondContact O-N 3.47Å; C371-K374 VanDerWaalsContact O-CB 3.23Å; C371-K374 WeakPolarHBondContact O-CB 3.28Å; C371-K374 PolarHBondContact O-N 2.94Å; C371-K374 VanDerWaalsContact O-N 3.14Å; F372-K374 VanDerWaalsContact C-N 3.27Å; F372-K374 PolarHBondContact O-N 3.2Å; K374-K377 WeakPolarHBondContact O-CB 3.11Å; K374-K377 PolarHBondContact O-N 3.39Å; K374-I378 HydrophobicContact CG-CD1 4.19Å; K374-I378 WeakPolarHBondContact O-CG1 3.34Å; K374-I378 PolarHBondContact O-N 3.45Å
375	F	98.1	Very high	96.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.9	-36.7	178.9	-76.7	-64.7	0	0	0	112.9	V298 W354 V355 R358 I359 C371 F372 V373 K377 I378 M379 V394 L398	V298-F375 HydrophobicContact CG2-CE1 4.36Å; V298-F375 HydrophobicContact CG2-CZ 3.99Å; W354-F375 HydrophobicContact CE3-CE1 4.27Å; W354-F375 AromaticContact CH2-CE1 3.63Å; W354-F375 HydrophobicContact CH2-CE1 3.63Å; W354-F375 AromaticContact CH2-CZ 3.99Å; W354-F375 HydrophobicContact CH2-CZ 3.99Å; W354-F375 HydrophobicContact CZ2-CE1 4.37Å; W354-F375 HydrophobicContact CZ2-CZ 4.28Å; W354-F375 AromaticContact CZ3-CE1 3.57Å; W354-F375 HydrophobicContact CZ3-CE1 3.57Å; W354-F375 HydrophobicContact CZ3-CZ 4.14Å; V355-F375 HydrophobicContact CB-CD1 4.43Å; V355-F375 HydrophobicContact CB-CE1 4.22Å; V355-F375 HydrophobicContact CB-CE2 4.49Å; V355-F375 HydrophobicContact CB-CZ 4.23Å; V355-F375 HydrophobicContact CG1-CB 4.37Å; V355-F375 HydrophobicContact CG1-CD1 3.91Å; V355-F375 HydrophobicContact CG1-CD2 3.76Å; V355-F375 HydrophobicContact CG1-CE1 4.1Å; V355-F375 HydrophobicContact CG1-CE2 3.93Å; V355-F375 HydrophobicContact CG1-CG 3.74Å; V355-F375 HydrophobicContact CG1-CZ 4.09Å; V355-F375 HydrophobicContact CG2-CD1 3.86Å; V355-F375 HydrophobicContact CG2-CE1 3.62Å; V355-F375 HydrophobicContact CG2-CZ 4.08Å; R358-F375 HydrophobicContact CB-CE2 4.04Å; R358-F375 HydrophobicContact CB-CZ 4.13Å; R358-F375 HydrophobicContact CG-CZ 4.47Å; I359-F375 HydrophobicContact CD1-CD2 3.84Å; I359-F375 HydrophobicContact CD1-CE2 4.31Å; I359-F375 HydrophobicContact CG1-CD2 3.91Å; I359-F375 HydrophobicContact CG1-CE2 3.99Å; C371-F375 WeakPolarHBondContact O-CD2 3.24Å; C371-F375 PolarHBondContact O-N 3.11Å; F372-F375 PolarHBondContact O-N 3.48Å; F372-F375 VanDerWaalsContact O-N 3.11Å; V373-F375 VanDerWaalsContact C-N 3.34Å; F375-K377 VanDerWaalsContact C-N 3.3Å; F375-K377 PolarHBondContact O-N 2.99Å; F375-I378 HydrophobicContact CD1-CD1 3.76Å; F375-I378 HydrophobicContact CE1-CD1 4.02Å; F375-I378 WeakPolarHBondContact O-CB 3.33Å; F375-I378 PolarHBondContact O-N 2.75Å; F375-I378 VanDerWaalsContact O-N 3.12Å; F375-M379 WeakPolarHBondContact O-CG 3.24Å; F375-M379 PolarHBondContact O-N 2.87Å; F375-V394 HydrophobicContact CB-CG1 3.95Å; F375-V394 HydrophobicContact CD1-CG1 4.24Å; F375-V394 HydrophobicContact CG-CG1 4.44Å; F375-L398 HydrophobicContact CB-CD1 4.25Å; F375-L398 HydrophobicContact CB-CD2 4.11Å
376	L	97.9	Very high	96.4	Very high	1 Å²	1	53 Å²	53	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-41.1	168.9	-70.8	175.8	0	0	0	112.3	F372 V373 M379 R380 L398 A412 Q415 L416	F372-L376 HydrophobicContact CD1-CD1 3.95Å; F372-L376 HydrophobicContact CD1-CG 4.25Å; F372-L376 HydrophobicContact CE1-CD1 3.81Å; F372-L376 HydrophobicContact CE1-CD2 4.49Å; F372-L376 HydrophobicContact CE1-CG 4.13Å; F372-L376 PolarHBondContact O-N 3.29Å; V373-L376 PolarHBondContact O-N 3.12Å; L376-M379 HydrophobicContact CD2-SD 4.46Å; L376-M379 PolarHBondContact O-N 3.37Å; L376-R380 PolarHBondContact O-N 2.52Å; L376-R380 VanDerWaalsContact O-N 3.1Å; L376-L398 HydrophobicContact CD2-CD1 3.82Å; L376-L398 HydrophobicContact CG-CD1 4.17Å; L376-A412 HydrophobicContact CD1-CB 3.81Å; L376-Q415 HydrophobicContact CD1-CB 4.2Å; L376-Q415 HydrophobicContact CD2-CB 4.49Å; L376-L416 HydrophobicContact CD2-CB 4.3Å; L376-L416 HydrophobicContact CD2-CD1 4.11Å
377	K	98.1	Very high	96.6	Very high	102 Å²	102	44.7 Å²	44.7	44%	0.443	19%	0.192	S	C	.	.	H	α-helix	trans	-64.4	-41.1	174.2	-70.8	174.1	-178	177.1	0	111.6	V373 K374 F375 R380 H381	V373-K377 WeakPolarHBondContact O-CG 3.23Å; V373-K377 PolarHBondContact O-N 3.49Å; K374-K377 WeakPolarHBondContact O-CB 3.11Å; K374-K377 PolarHBondContact O-N 3.39Å; F375-K377 VanDerWaalsContact C-N 3.3Å; F375-K377 PolarHBondContact O-N 2.99Å; K377-R380 WeakPolarHBondContact O-CB 3.2Å; K377-R380 PolarHBondContact O-N 2.94Å; K377-H381 PolarHBondContact O-CD2 3.18Å; K377-H381 PolarHBondContact O-N 2.98Å
378	I	98.5	Very high	96.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-48.4	176.1	-68.3	162.6	0	0	0	110.2	I306 A307 L310 K374 F375 R380 H381 L382	I306-I378 HydrophobicContact CB-CD1 4.17Å; I306-I378 HydrophobicContact CB-CG1 4.39Å; I306-I378 HydrophobicContact CD1-CD1 3.86Å; I306-I378 HydrophobicContact CG2-CD1 3.92Å; I306-I378 HydrophobicContact CG2-CG1 4.44Å; I306-I378 HydrophobicContact CG2-CG2 4.47Å; A307-I378 HydrophobicContact CB-CG2 4.28Å; L310-I378 HydrophobicContact CD1-CG2 3.75Å; K374-I378 HydrophobicContact CG-CD1 4.19Å; K374-I378 WeakPolarHBondContact O-CG1 3.34Å; K374-I378 PolarHBondContact O-N 3.45Å; F375-I378 HydrophobicContact CD1-CD1 3.76Å; F375-I378 HydrophobicContact CE1-CD1 4.02Å; F375-I378 WeakPolarHBondContact O-CB 3.33Å; F375-I378 PolarHBondContact O-N 2.75Å; F375-I378 VanDerWaalsContact O-N 3.12Å; I378-R380 VanDerWaalsContact C-N 3.27Å; I378-R380 PolarHBondContact O-N 3.04Å; I378-H381 WeakPolarHBondContact O-CA 3.32Å; I378-H381 WeakPolarHBondContact O-CB 3.43Å; I378-H381 PolarHBondContact O-N 3.16Å; I378-L382 HydrophobicContact CG2-CD1 3.88Å; I378-L382 HydrophobicContact CG2-CG 4.22Å; I378-L382 WeakPolarHBondContact O-CG 3.07Å; I378-L382 PolarHBondContact O-N 3.2Å
379	M	97.9	Very high	97	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-53.1	-43.6	174.9	-74.6	176.3	67.5	0	0	112.5	F375 L376 H381 L382 R383 V394 L395 L398 Y419	F375-M379 WeakPolarHBondContact O-CG 3.24Å; F375-M379 PolarHBondContact O-N 2.87Å; L376-M379 HydrophobicContact CD2-SD 4.46Å; L376-M379 PolarHBondContact O-N 3.37Å; M379-H381 VanDerWaalsContact C-N 3.27Å; M379-H381 PolarHBondContact O-N 2.86Å; M379-L382 PolarHBondContact O-N 3.23Å; M379-R383 PolarHBondContact O-N 3.46Å; M379-V394 HydrophobicContact CG-CB 3.56Å; M379-V394 HydrophobicContact CG-CG1 3.42Å; M379-V394 VanDerWaalsContact CG-CG1 3.42Å; M379-V394 HydrophobicContact CG-CG2 4.37Å; M379-V394 HydrophobicContact SD-CB 3.95Å; M379-V394 HydrophobicContact SD-CG1 3.57Å; M379-V394 VanDerWaalsContact SD-CG1 3.57Å; M379-L395 HydrophobicContact CE-CB 3.7Å; M379-L395 HydrophobicContact CE-CD1 4.2Å; M379-L395 HydrophobicContact CE-CG 4.48Å; M379-L398 HydrophobicContact SD-CD1 3.73Å; M379-Y419 HydrophobicContact CB-CE1 4.49Å; M379-Y419 HydrophobicContact CE-CD1 3.89Å; M379-Y419 HydrophobicContact CE-CD2 3.9Å; M379-Y419 HydrophobicContact CE-CE1 4.48Å; M379-Y419 HydrophobicContact CE-CG 3.58Å
380	R	97.8	Very high	97.1	Very high	107 Å²	107	37.6 Å²	37.6	40%	0.404	16%	0.16	S	C	.	.	H	α-helix	trans	-61	-35.4	176.4	-162.8	-171.5	-57.8	160.6	0.2	112.9	L376 K377 I378 R384 Y419	L376-R380 PolarHBondContact O-N 2.52Å; L376-R380 VanDerWaalsContact O-N 3.1Å; K377-R380 WeakPolarHBondContact O-CB 3.2Å; K377-R380 PolarHBondContact O-N 2.94Å; I378-R380 VanDerWaalsContact C-N 3.27Å; I378-R380 PolarHBondContact O-N 3.04Å; R380-R384 WeakPolarHBondContact O-CG 3.44Å; R380-R384 PolarHBondContact O-N 3.25Å; R380-R384 PolarHBondContact O-NE 2.7Å; R380-Y419 VanDerWaalsContact CA-OH 3.24Å; R380-Y419 WeakPolarHBondContact CA-OH 3.26Å; R380-Y419 WeakPolarHBondContact CB-OH 3.23Å
381	H	98.5	Very high	97.2	Very high	39 Å²	39	31.6 Å²	31.6	18%	0.181	14%	0.138	C	C	.	.	H	α-helix	trans	-73.8	-41	174.7	-76	-76.2	0	0	0	111.5	A307 K377 I378 M379 R383 R384 M385	A307-H381 HydrophobicContact CB-CB 3.49Å; A307-H381 VanDerWaalsContact CB-CB 3.49Å; K377-H381 PolarHBondContact O-CD2 3.18Å; K377-H381 PolarHBondContact O-N 2.98Å; I378-H381 WeakPolarHBondContact O-CA 3.32Å; I378-H381 WeakPolarHBondContact O-CB 3.43Å; I378-H381 PolarHBondContact O-N 3.16Å; M379-H381 VanDerWaalsContact C-N 3.27Å; M379-H381 PolarHBondContact O-N 2.86Å; H381-R383 PolarHBondContact O-N 3.28Å; H381-R384 PolarHBondContact CD2-NH2 2.76Å; H381-R384 PolarHBondContact CE1-NH1 3.21Å; H381-R384 VanDerWaalsContact CE1-NH1 3.26Å; H381-R384 PolarHBondContact CE1-NH2 3.23Å; H381-R384 VanDerWaalsContact ND1-CZ 3.35Å; H381-R384 PolarHBondContact ND1-NH1 3.44Å; H381-R384 PolarHBondContact ND1-NH2 3Å; H381-R384 PolarHBondContact NE2-NH2 3.13Å; H381-R384 PolarHBondContact O-N 3.42Å; H381-M385 HydrophobicContact CB-CE 4.34Å; H381-M385 VanDerWaalsContact O-CG 3.3Å; H381-M385 WeakPolarHBondContact O-CG 3.19Å; H381-M385 PolarHBondContact O-N 3.45Å
382	L	98.3	Very high	97.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.3	-48.2	176.1	-67.6	168.7	0	0	0	111.6	A307 L310 I378 M379 R384 M385 G386 N387 C391 V394	A307-L382 HydrophobicContact CB-CD2 4.07Å; A307-L382 HydrophobicContact CB-CG 4.16Å; L310-L382 HydrophobicContact CB-CD2 3.91Å; L310-L382 HydrophobicContact CD1-CD1 4.12Å; L310-L382 HydrophobicContact CD1-CD2 4.16Å; I378-L382 HydrophobicContact CG2-CD1 3.88Å; I378-L382 HydrophobicContact CG2-CG 4.22Å; I378-L382 WeakPolarHBondContact O-CG 3.07Å; I378-L382 PolarHBondContact O-N 3.2Å; M379-L382 PolarHBondContact O-N 3.23Å; L382-R384 VanDerWaalsContact C-N 3.33Å; L382-R384 PolarHBondContact O-N 3.22Å; L382-M385 PolarHBondContact O-N 3.06Å; L382-M385 VanDerWaalsContact O-N 3.09Å; L382-G386 PolarHBondContact O-N 3.29Å; L382-N387 HydrophobicContact CB-CB 4.44Å; L382-N387 HydrophobicContact CD2-CB 4.17Å; L382-N387 PolarHBondContact O-N 3.38Å; L382-C391 HydrophobicContact CB-CB 4.11Å; L382-V394 HydrophobicContact CD1-CG2 4.12Å
383	R	96.3	Very high	97.3	Very high	99 Å²	99	31.5 Å²	31.5	37%	0.374	14%	0.137	S	C	.	.	H	α-helix	trans	-59.8	-40.4	176.2	-173.7	168	179.8	177.9	1	112.5	M379 H381 M385 G386 Y419	M379-R383 PolarHBondContact O-N 3.46Å; H381-R383 PolarHBondContact O-N 3.28Å; R383-M385 VanDerWaalsContact C-N 3.29Å; R383-M385 PolarHBondContact O-N 3.38Å; R383-G386 PolarHBondContact O-N 3.46Å; R383-Y419 HydrophobicContact CB-CE1 4.29Å
384	R	96.2	Very high	97.4	Very high	151 Å²	151	29.1 Å²	29.1	57%	0.57	12%	0.123	S	C	*	.	H	α-helix	trans	-67.3	-27.3	175.9	-82.8	177.9	-77.7	150.3	-6.7	113.7	R380 H381 L382 G386	R380-R384 WeakPolarHBondContact O-CG 3.44Å; R380-R384 PolarHBondContact O-N 3.25Å; R380-R384 PolarHBondContact O-NE 2.7Å; H381-R384 PolarHBondContact CD2-NH2 2.76Å; H381-R384 PolarHBondContact CE1-NH1 3.21Å; H381-R384 VanDerWaalsContact CE1-NH1 3.26Å; H381-R384 PolarHBondContact CE1-NH2 3.23Å; H381-R384 VanDerWaalsContact ND1-CZ 3.35Å; H381-R384 PolarHBondContact ND1-NH1 3.44Å; H381-R384 PolarHBondContact ND1-NH2 3Å; H381-R384 PolarHBondContact NE2-NH2 3.13Å; H381-R384 PolarHBondContact O-N 3.42Å; L382-R384 VanDerWaalsContact C-N 3.33Å; L382-R384 PolarHBondContact O-N 3.22Å; R384-G386 VanDerWaalsContact C-N 3.29Å
385	M	96.3	Very high	97.4	Very high	53 Å²	53	27.6 Å²	27.6	26%	0.261	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	3.8	176.9	-67.1	170.2	-172.9	0	0	112.9	V304 A307 Q308 H381 L382 R383 N387	V304-M385 HydrophobicContact CG2-CE 3.9Å; A307-M385 HydrophobicContact CB-CE 4.26Å; A307-M385 HydrophobicContact CB-SD 4.24Å; Q308-M385 HydrophobicContact CG-CE 3.55Å; Q308-M385 HydrophobicContact CG-SD 4.26Å; H381-M385 HydrophobicContact CB-CE 4.34Å; H381-M385 VanDerWaalsContact O-CG 3.3Å; H381-M385 WeakPolarHBondContact O-CG 3.19Å; H381-M385 PolarHBondContact O-N 3.45Å; L382-M385 PolarHBondContact O-N 3.06Å; L382-M385 VanDerWaalsContact O-N 3.09Å; R383-M385 VanDerWaalsContact C-N 3.29Å; R383-M385 PolarHBondContact O-N 3.38Å; M385-N387 PolarHBondContact O-N 2.88Å
386	G	95.7	Very high	97.1	Very high	12 Å²	12	27.6 Å²	27.6	12%	0.124	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	11.1	-174.1	0	0	0	0	0	113.9	L382 R383 R384 L388 C443 L444	L382-G386 PolarHBondContact O-N 3.29Å; R383-G386 PolarHBondContact O-N 3.46Å; R384-G386 VanDerWaalsContact C-N 3.29Å; G386-L388 PolarHBondContact O-N 3.36Å; G386-L388 VanDerWaalsContact O-N 3.1Å; G386-C443 CarbonylContact O-C 3.56Å; G386-C443 WeakPolarHBondContact O-CA 3.47Å; G386-L444 PolarHBondContact O-N 3.28Å
387	N	97.7	Very high	96.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-86.3	78.5	177.5	-171.9	-5.8	0	0	0	111.1	T311 D314 L382 M385 N389 S390 C391 L444	T311-N387 VanDerWaalsContact CA-ND2 3.3Å; T311-N387 WeakPolarHBondContact CA-ND2 3.49Å; T311-N387 HydrophobicContact CG2-CB 4.29Å; T311-N387 PolarHBondContact OG1-ND2 3.37Å; D314-N387 PolarHBondContact OD2-ND2 2.88Å; D314-N387 PolarHBondContact OD2-OD1 3.14Å; L382-N387 HydrophobicContact CB-CB 4.44Å; L382-N387 HydrophobicContact CD2-CB 4.17Å; L382-N387 PolarHBondContact O-N 3.38Å; M385-N387 PolarHBondContact O-N 2.88Å; N387-N389 VanDerWaalsContact C-N 3.32Å; N387-N389 PolarHBondContact OD1-N 2.96Å; N387-S390 WeakPolarHBondContact ND2-CB 3.39Å; N387-S390 PolarHBondContact OD1-N 3.3Å; N387-C391 VanDerWaalsContact O-CB 3.23Å; N387-C391 WeakPolarHBondContact O-CB 3.5Å; N387-C391 PolarHBondContact O-N 2.82Å; N387-L444 HydrophobicContact CB-CD1 4.12Å
388	L	97	Very high	96.8	Very high	6 Å²	6	22.8 Å²	22.8	3%	0.031	10%	0.096	C	C	.	.	H	α-helix	trans	-70.4	-31.3	178.2	-58.6	-179.4	0	0	0	111.6	G386 C391 L392 Y432 V435 L436 L444	G386-L388 PolarHBondContact O-N 3.36Å; G386-L388 VanDerWaalsContact O-N 3.1Å; L388-C391 PolarHBondContact O-N 3.01Å; L388-L392 WeakPolarHBondContact O-CG 3.2Å; L388-L392 PolarHBondContact O-N 3.15Å; L388-Y432 HydrophobicContact CB-CE2 4.23Å; L388-Y432 HydrophobicContact CD1-CE2 4.01Å; L388-V435 HydrophobicContact CD1-CG1 4.49Å; L388-L436 HydrophobicContact CD1-CD1 4.25Å; L388-L444 PolarHBondContact N-O 3.47Å
389	N	97.4	Very high	96.5	Very high	3 Å²	3	25 Å²	25	2%	0.016	11%	0.108	C	C	.	.	H	α-helix	trans	-59.1	-62	178.3	-170.8	65.9	0	0	0	112.5	D314 F344 F348 N387 C391 L392 A393 L444	D314-N389 PolarHBondContact OD1-ND2 3.42Å; D314-N389 VanDerWaalsContact OD1-ND2 3.16Å; F344-N389 WeakPolarHBondContact CE1-OD1 3.47Å; F344-N389 HydrophobicContact CZ-CB 4.08Å; F344-N389 VanDerWaalsContact CZ-ND2 3.29Å; F344-N389 WeakPolarHBondContact CZ-ND2 3.16Å; F348-N389 WeakPolarHBondContact CD2-OD1 3.27Å; F348-N389 VanDerWaalsContact CE2-O 3.28Å; F348-N389 WeakPolarHBondContact CE2-O 3.33Å; N387-N389 VanDerWaalsContact C-N 3.32Å; N387-N389 PolarHBondContact OD1-N 2.96Å; N389-C391 VanDerWaalsContact C-N 3.27Å; N389-C391 PolarHBondContact O-N 3.46Å; N389-L392 PolarHBondContact O-N 3.01Å; N389-A393 PolarHBondContact O-N 3.36Å; N389-L444 PolarHBondContact N-O 2.79Å
390	S	97.9	Very high	96.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.3	-31.4	176.6	-89	0	0	0	0	112.5	D314 M351 N387 L392 A393 V394	D314-S390 WeakPolarHBondContact OD2-CB 3.2Å; D314-S390 PolarHBondContact OD2-N 3.1Å; D314-S390 PolarHBondContact OD2-OG 3.03Å; M351-S390 WeakPolarHBondContact CE-OG 3.46Å; N387-S390 WeakPolarHBondContact ND2-CB 3.39Å; N387-S390 PolarHBondContact OD1-N 3.3Å; S390-L392 VanDerWaalsContact C-N 3.28Å; S390-L392 PolarHBondContact O-N 2.64Å; S390-A393 PolarHBondContact O-N 3.44Å; S390-V394 WeakPolarHBondContact O-CG2 3.3Å; S390-V394 PolarHBondContact O-N 2.61Å
391	C	97.7	Very high	95.6	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-58	-45.3	176.4	-172.9	0	0	0	0	110.7	L382 N387 L388 N389 V394 L395	L382-C391 HydrophobicContact CB-CB 4.11Å; N387-C391 VanDerWaalsContact O-CB 3.23Å; N387-C391 WeakPolarHBondContact O-CB 3.5Å; N387-C391 PolarHBondContact O-N 2.82Å; L388-C391 PolarHBondContact O-N 3.01Å; N389-C391 VanDerWaalsContact C-N 3.27Å; N389-C391 PolarHBondContact O-N 3.46Å; C391-V394 PolarHBondContact O-N 2.69Å; C391-L395 PolarHBondContact O-N 3.08Å
392	L	96.9	Very high	94.9	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-73	-30.6	176.3	-66.6	-177	0	0	0	112.8	F348 L388 N389 S390 V394 L395 A396 I423 Y432 Y446	F348-L392 HydrophobicContact CE2-CB 4.26Å; L388-L392 WeakPolarHBondContact O-CG 3.2Å; L388-L392 PolarHBondContact O-N 3.15Å; N389-L392 PolarHBondContact O-N 3.01Å; S390-L392 VanDerWaalsContact C-N 3.28Å; S390-L392 PolarHBondContact O-N 2.64Å; L392-V394 VanDerWaalsContact C-N 3.34Å; L392-V394 PolarHBondContact O-N 2.83Å; L392-L395 HydrophobicContact CD2-CD2 3.74Å; L392-L395 PolarHBondContact O-N 2.96Å; L392-A396 VanDerWaalsContact O-CB 3.29Å; L392-A396 WeakPolarHBondContact O-CB 3.46Å; L392-A396 PolarHBondContact O-N 3Å; L392-I423 HydrophobicContact CD1-CD1 3.73Å; L392-I423 HydrophobicContact CD1-CG1 4Å; L392-I423 HydrophobicContact CD2-CB 3.87Å; L392-I423 HydrophobicContact CD2-CG1 4.09Å; L392-I423 HydrophobicContact CD2-CG2 4.14Å; L392-Y432 HydrophobicContact CD1-CD2 4.2Å; L392-Y432 HydrophobicContact CD1-CE2 3.89Å; L392-Y446 HydrophobicContact CD1-CD1 3.98Å; L392-Y446 HydrophobicContact CD1-CG 3.82Å
393	A	96.3	Very high	94.6	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.6	-41.4	173.2	0	0	0	0	0	112.1	F348 M351 S352 N389 S390 A397	F348-A393 HydrophobicContact CD1-CB 4.37Å; F348-A393 HydrophobicContact CD2-CB 3.61Å; F348-A393 HydrophobicContact CE1-CB 4.28Å; F348-A393 HydrophobicContact CE2-CB 3.56Å; F348-A393 VanDerWaalsContact CE2-N 3.34Å; F348-A393 HydrophobicContact CG-CB 4.03Å; F348-A393 HydrophobicContact CZ-CB 3.91Å; M351-A393 HydrophobicContact CB-CB 3.91Å; M351-A393 HydrophobicContact CG-CB 3.88Å; S352-A393 WeakPolarHBondContact CB-O 3.32Å; S352-A393 PolarHBondContact OG-O 3.44Å; N389-A393 PolarHBondContact O-N 3.36Å; S390-A393 PolarHBondContact O-N 3.44Å; A393-A397 PolarHBondContact O-N 2.99Å
394	V	97.7	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-71.2	-39.6	175.1	-176.6	0	0	0	0	110.6	V355 F375 M379 L382 S390 C391 L392 A396 A397 L398	V355-V394 HydrophobicContact CG1-CG1 4.28Å; V355-V394 HydrophobicContact CG2-CG1 4.29Å; V355-V394 HydrophobicContact CG2-CG2 4.09Å; F375-V394 HydrophobicContact CB-CG1 3.95Å; F375-V394 HydrophobicContact CD1-CG1 4.24Å; F375-V394 HydrophobicContact CG-CG1 4.44Å; M379-V394 HydrophobicContact CG-CB 3.56Å; M379-V394 HydrophobicContact CG-CG1 3.42Å; M379-V394 VanDerWaalsContact CG-CG1 3.42Å; M379-V394 HydrophobicContact CG-CG2 4.37Å; M379-V394 HydrophobicContact SD-CB 3.95Å; M379-V394 HydrophobicContact SD-CG1 3.57Å; M379-V394 VanDerWaalsContact SD-CG1 3.57Å; L382-V394 HydrophobicContact CD1-CG2 4.12Å; S390-V394 WeakPolarHBondContact O-CG2 3.3Å; S390-V394 PolarHBondContact O-N 2.61Å; C391-V394 PolarHBondContact O-N 2.69Å; L392-V394 VanDerWaalsContact C-N 3.34Å; L392-V394 PolarHBondContact O-N 2.83Å; V394-A396 PolarHBondContact O-N 3.26Å; V394-A397 WeakPolarHBondContact O-CB 3.44Å; V394-A397 PolarHBondContact O-N 3Å; V394-A397 VanDerWaalsContact O-N 3.09Å; V394-L398 HydrophobicContact CG1-CD1 4.2Å; V394-L398 HydrophobicContact CG1-CG 4.23Å; V394-L398 WeakPolarHBondContact O-CG 3.43Å; V394-L398 PolarHBondContact O-N 2.89Å
395	L	97	Very high	94.1	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-56.5	-49.3	173.6	178.8	58.7	0	0	0	111.5	M379 C391 L392 A397 L398 D399 L416 Y419 I423	M379-L395 HydrophobicContact CE-CB 3.7Å; M379-L395 HydrophobicContact CE-CD1 4.2Å; M379-L395 HydrophobicContact CE-CG 4.48Å; C391-L395 PolarHBondContact O-N 3.08Å; L392-L395 HydrophobicContact CD2-CD2 3.74Å; L392-L395 PolarHBondContact O-N 2.96Å; L395-A397 PolarHBondContact O-N 3.42Å; L395-L398 PolarHBondContact O-N 3.22Å; L395-L398 VanDerWaalsContact O-N 3.12Å; L395-D399 WeakPolarHBondContact O-CB 3.33Å; L395-D399 PolarHBondContact O-N 3.49Å; L395-L416 HydrophobicContact CD1-CD1 3.52Å; L395-L416 HydrophobicContact CD1-CG 4.17Å; L395-Y419 WeakPolarHBondContact CD2-O 3.4Å; L395-I423 HydrophobicContact CD2-CG2 3.68Å
396	A	92.9	Very high	93.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.8	-30.7	176.1	0	0	0	0	0	112.9	F109 N110 R356 L392 V394	F109-A396 HydrophobicContact CD1-CB 3.65Å; F109-A396 HydrophobicContact CE1-CB 4.18Å; N110-A396 PolarHBondContact OD1-O 3.23Å; R356-A396 PolarHBondContact NH2-O 3.25Å; L392-A396 VanDerWaalsContact O-CB 3.29Å; L392-A396 WeakPolarHBondContact O-CB 3.46Å; L392-A396 PolarHBondContact O-N 3Å; V394-A396 PolarHBondContact O-N 3.26Å
397	A	93.7	Very high	93.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-72.4	-51	174.1	0	0	0	0	0	111.5	S352 V355 R356 A393 V394 L395 D399 C400 L403	S352-A397 VanDerWaalsContact O-CB 3.28Å; S352-A397 WeakPolarHBondContact O-CB 3.39Å; S352-A397 PolarHBondContact OG-N 3.44Å; V355-A397 HydrophobicContact CB-CB 3.5Å; V355-A397 VanDerWaalsContact CB-CB 3.5Å; V355-A397 HydrophobicContact CG1-CB 3.49Å; V355-A397 VanDerWaalsContact CG1-CB 3.49Å; V355-A397 HydrophobicContact CG2-CB 4.31Å; R356-A397 HydrophobicContact CG-CB 3.88Å; A393-A397 PolarHBondContact O-N 2.99Å; V394-A397 WeakPolarHBondContact O-CB 3.44Å; V394-A397 PolarHBondContact O-N 3Å; V394-A397 VanDerWaalsContact O-N 3.09Å; L395-A397 PolarHBondContact O-N 3.42Å; A397-D399 VanDerWaalsContact C-N 3.33Å; A397-D399 PolarHBondContact O-N 2.8Å; A397-C400 WeakPolarHBondContact O-CB 3.39Å; A397-C400 PolarHBondContact O-N 2.89Å; A397-C400 PolarHBondContact O-SG 3.28Å; A397-L403 WeakPolarHBondContact O-CD1 3.47Å
398	L	95.8	Very high	93.6	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-30.4	-175.4	-61.9	-174.1	0	0	0	113	V355 I359 F372 F375 L376 M379 V394 L395 L403 L416	V355-L398 HydrophobicContact CG1-CD2 3.99Å; I359-L398 HydrophobicContact CD1-CD2 3.36Å; F372-L398 HydrophobicContact CD2-CD2 3.75Å; F372-L398 HydrophobicContact CE2-CB 3.98Å; F372-L398 HydrophobicContact CE2-CD2 3.78Å; F372-L398 HydrophobicContact CE2-CG 4.29Å; F372-L398 HydrophobicContact CG-CD2 4.38Å; F372-L398 HydrophobicContact CZ-CB 4.18Å; F372-L398 HydrophobicContact CZ-CD1 4.39Å; F372-L398 HydrophobicContact CZ-CD2 4.44Å; F375-L398 HydrophobicContact CB-CD1 4.25Å; F375-L398 HydrophobicContact CB-CD2 4.11Å; L376-L398 HydrophobicContact CD2-CD1 3.82Å; L376-L398 HydrophobicContact CG-CD1 4.17Å; M379-L398 HydrophobicContact SD-CD1 3.73Å; V394-L398 HydrophobicContact CG1-CD1 4.2Å; V394-L398 HydrophobicContact CG1-CG 4.23Å; V394-L398 WeakPolarHBondContact O-CG 3.43Å; V394-L398 PolarHBondContact O-N 2.89Å; L395-L398 PolarHBondContact O-N 3.22Å; L395-L398 VanDerWaalsContact O-N 3.12Å; L398-L403 HydrophobicContact CD2-CD1 4.4Å; L398-L416 HydrophobicContact CB-CD1 3.72Å; L398-L416 HydrophobicContact CB-CD2 4.24Å; L398-L416 HydrophobicContact CD1-CD1 3.95Å; L398-L416 HydrophobicContact CG-CD1 4.48Å
399	D	92.6	Very high	93.5	Very high	47 Å²	47	33.5 Å²	33.5	25%	0.251	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	10.4	178.1	-168.6	35.5	0	0	0	113.5	L395 A397 R404	L395-D399 WeakPolarHBondContact O-CB 3.33Å; L395-D399 PolarHBondContact O-N 3.49Å; A397-D399 VanDerWaalsContact C-N 3.33Å; A397-D399 PolarHBondContact O-N 2.8Å; D399-R404 PolarHBondContact O-NE 3.38Å; D399-R404 PolarHBondContact O-NH1 3.38Å; D399-R404 VanDerWaalsContact OD1-CD 3.32Å; D399-R404 WeakPolarHBondContact OD1-CD 3.49Å; D399-R404 IonicContact OD1-CZ 3.92Å; D399-R404 IonicContact OD1-NH1 3.68Å; D399-R404 PolarHBondContact OD1-NH1 2.94Å; D399-R404 VanDerWaalsContact OD1-NH1 3.1Å; D399-R404 IonicContact OD2-NH1 3.78Å; D399-R404 PolarHBondContact OD2-NH1 3.45Å
400	C	88.6	Confident	93.4	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.007	19%	0.19	C	C	.	.	S	Bend	trans	-72	152.8	178.4	74.5	0	0	0	0	112.4	N110 A397 L403 R404	N110-C400 WeakPolarHBondContact OD1-CA 3.31Å; N110-C400 WeakPolarHBondContact OD1-CB 3.4Å; A397-C400 WeakPolarHBondContact O-CB 3.39Å; A397-C400 PolarHBondContact O-N 2.89Å; A397-C400 PolarHBondContact O-SG 3.28Å; C400-L403 PolarHBondContact O-N 2.83Å; C400-L403 VanDerWaalsContact O-N 3.08Å; C400-R404 PolarHBondContact O-N 3.46Å
401	G	86.2	Confident	93.3	Very high	9 Å²	9	43 Å²	43	9%	0.093	22%	0.216	C	C	.	.	H	α-helix	trans	-47.5	-50	180	0	0	0	0	0	114.8	L403 R404 R405	G401-L403 PolarHBondContact O-N 2.84Å; G401-R404 PolarHBondContact O-N 2.71Å; G401-R405 WeakPolarHBondContact O-CG 3.49Å; G401-R405 PolarHBondContact O-N 3.42Å; G401-R405 PolarHBondContact O-NH1 3.11Å
402	P	85.6	Confident	93.2	Very high	49 Å²	49	42.9 Å²	42.9	32%	0.318	22%	0.216	S	C	.	.	H	α-helix	trans	-59.1	-40.6	177.5	-27.5	35.8	0	0	0	114.8	M360	M360-P402 HydrophobicContact SD-CB 4.28Å
403	L	91.1	Very high	93.1	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-77.5	-35.6	178.9	-66.7	-168.1	0	0	0	112	I359 M360 A397 L398 C400 G401 R405 L406 W408	I359-L403 HydrophobicContact CB-CD1 4.3Å; I359-L403 HydrophobicContact CB-CD2 4.19Å; I359-L403 HydrophobicContact CD1-CD1 3.67Å; I359-L403 HydrophobicContact CG2-CD1 4.16Å; I359-L403 HydrophobicContact CG2-CD2 3.59Å; M360-L403 HydrophobicContact CG-CD2 3.88Å; A397-L403 WeakPolarHBondContact O-CD1 3.47Å; L398-L403 HydrophobicContact CD2-CD1 4.4Å; C400-L403 PolarHBondContact O-N 2.83Å; C400-L403 VanDerWaalsContact O-N 3.08Å; G401-L403 PolarHBondContact O-N 2.84Å; L403-R405 PolarHBondContact O-N 2.84Å; L403-L406 HydrophobicContact CD2-CD1 4.01Å; L403-L406 PolarHBondContact O-N 2.89Å; L403-L406 VanDerWaalsContact O-N 3.11Å; L403-W408 HydrophobicContact CB-CZ2 4.22Å; L403-W408 HydrophobicContact CD2-CZ2 4.26Å; L403-W408 PolarHBondContact O-NE1 3.03Å
404	R	90.9	Very high	93.1	Very high	142 Å²	142	51 Å²	51	54%	0.536	26%	0.259	S	S	.	.	H	α-helix	trans	-58.5	-29.7	175.1	-78.1	-166.6	-69.4	-127.4	3.3	114	D399 C400 G401 L406	D399-R404 PolarHBondContact O-NE 3.38Å; D399-R404 PolarHBondContact O-NH1 3.38Å; D399-R404 VanDerWaalsContact OD1-CD 3.32Å; D399-R404 WeakPolarHBondContact OD1-CD 3.49Å; D399-R404 IonicContact OD1-CZ 3.92Å; D399-R404 IonicContact OD1-NH1 3.68Å; D399-R404 PolarHBondContact OD1-NH1 2.94Å; D399-R404 VanDerWaalsContact OD1-NH1 3.1Å; D399-R404 IonicContact OD2-NH1 3.78Å; D399-R404 PolarHBondContact OD2-NH1 3.45Å; C400-R404 PolarHBondContact O-N 3.46Å; G401-R404 PolarHBondContact O-N 2.71Å; R404-L406 VanDerWaalsContact C-N 3.27Å; R404-L406 PolarHBondContact O-N 2.91Å
405	R	91.8	Very high	93	Very high	190 Å²	190	53.7 Å²	53.7	72%	0.717	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-10.1	179.1	-70.5	-170.1	-60	-95	8.1	114.2	G401 L403	G401-R405 WeakPolarHBondContact O-CG 3.49Å; G401-R405 PolarHBondContact O-N 3.42Å; G401-R405 PolarHBondContact O-NH1 3.11Å; L403-R405 PolarHBondContact O-N 2.84Å
406	L	91.6	Very high	93	Very high	49 Å²	49	54 Å²	54	26%	0.257	27%	0.273	S	S	.	.	S	Bend	trans	-90.1	150	177.6	-58	174.3	0	0	0	109.5	R368 L403 R404 W408	R368-L406 VanDerWaalsContact CD-CD1 3.46Å; L403-L406 HydrophobicContact CD2-CD1 4.01Å; L403-L406 PolarHBondContact O-N 2.89Å; L403-L406 VanDerWaalsContact O-N 3.11Å; R404-L406 VanDerWaalsContact C-N 3.27Å; R404-L406 PolarHBondContact O-N 2.91Å; L406-W408 HydrophobicContact CB-CZ2 3.83Å; L406-W408 HydrophobicContact CD1-CH2 4.45Å; L406-W408 HydrophobicContact CD1-CZ2 4.09Å; L406-W408 PolarHBondContact O-NE1 3.35Å; L406-W408 VanDerWaalsContact O-NE1 3.15Å
407	D	92	Very high	93.1	Very high	135 Å²	135	56.6 Å²	56.6	72%	0.722	30%	0.295	S	S	*	.			trans	-73.3	134.1	177.3	-66	-45.8	0	0	0	110.3	Q365	Q365-D407 PolarHBondContact NE2-O 2.84Å
408	W	95.4	Very high	93	Very high	24 Å²	24	61.9 Å²	61.9	9%	0.091	32%	0.323	C	S	.	.			trans	-132.2	149.5	176.9	-54.5	105	0	0	0	110.5	I359 R368 E369 F372 L403 L406 N410 L413	I359-W408 HydrophobicContact CG2-CH2 3.62Å; I359-W408 HydrophobicContact CG2-CZ2 4.37Å; R368-W408 HydrophobicContact CG-CH2 3.54Å; R368-W408 HydrophobicContact CG-CZ3 3.8Å; E369-W408 HydrophobicContact CG-CE3 4.18Å; E369-W408 HydrophobicContact CG-CZ3 4.42Å; F372-W408 HydrophobicContact CB-CE3 3.77Å; F372-W408 HydrophobicContact CB-CH2 3.95Å; F372-W408 HydrophobicContact CB-CZ3 3.37Å; F372-W408 HydrophobicContact CD1-CD2 4.48Å; F372-W408 HydrophobicContact CD1-CE3 4.21Å; F372-W408 AromaticContact CD2-CD2 3.81Å; F372-W408 HydrophobicContact CD2-CD2 3.81Å; F372-W408 AromaticContact CD2-CE2 3.72Å; F372-W408 AromaticContact CD2-CE3 3.75Å; F372-W408 HydrophobicContact CD2-CE3 3.75Å; F372-W408 AromaticContact CD2-CH2 3.49Å; F372-W408 HydrophobicContact CD2-CH2 3.49Å; F372-W408 VanDerWaalsContact CD2-CH2 3.49Å; F372-W408 AromaticContact CD2-CZ2 3.57Å; F372-W408 HydrophobicContact CD2-CZ2 3.57Å; F372-W408 AromaticContact CD2-CZ3 3.6Å; F372-W408 HydrophobicContact CD2-CZ3 3.6Å; F372-W408 AromaticContact CE2-CD2 3.97Å; F372-W408 HydrophobicContact CE2-CD2 3.97Å; F372-W408 AromaticContact CE2-CE2 3.74Å; F372-W408 HydrophobicContact CE2-CE3 4.36Å; F372-W408 HydrophobicContact CE2-CG 4.46Å; F372-W408 HydrophobicContact CE2-CH2 4.3Å; F372-W408 AromaticContact CE2-CZ2 3.93Å; F372-W408 HydrophobicContact CE2-CZ2 3.93Å; F372-W408 HydrophobicContact CG-CD2 4.08Å; F372-W408 AromaticContact CG-CE3 3.66Å; F372-W408 HydrophobicContact CG-CE3 3.66Å; F372-W408 HydrophobicContact CG-CH2 4.02Å; F372-W408 HydrophobicContact CG-CZ2 4.43Å; F372-W408 AromaticContact CG-CZ3 3.63Å; F372-W408 HydrophobicContact CG-CZ3 3.63Å; F372-W408 HydrophobicContact CZ-CD2 4.36Å; F372-W408 HydrophobicContact CZ-CG 4.46Å; L403-W408 HydrophobicContact CB-CZ2 4.22Å; L403-W408 HydrophobicContact CD2-CZ2 4.26Å; L403-W408 PolarHBondContact O-NE1 3.03Å; L406-W408 HydrophobicContact CB-CZ2 3.83Å; L406-W408 HydrophobicContact CD1-CH2 4.45Å; L406-W408 HydrophobicContact CD1-CZ2 4.09Å; L406-W408 PolarHBondContact O-NE1 3.35Å; L406-W408 VanDerWaalsContact O-NE1 3.15Å; W408-N410 PolarHBondContact O-N 3.47Å; W408-L413 HydrophobicContact CB-CD1 4.44Å; W408-L413 HydrophobicContact CB-CD2 3.91Å; W408-L413 HydrophobicContact CB-CG 3.99Å; W408-L413 HydrophobicContact CG-CD2 4.24Å
409	P	94.8	Very high	93	Very high	45 Å²	45	62.8 Å²	62.8	29%	0.292	33%	0.326	S	S	.	.			trans	-57.6	136.1	171.9	-23.4	32.9	0	0	0	111.5	E369 S411 A412 L413	E369-P409 HydrophobicContact CG-CG 4.43Å; P409-S411 PolarHBondContact O-N 3.28Å; P409-A412 WeakPolarHBondContact O-CA 3.34Å; P409-A412 WeakPolarHBondContact O-CB 3.29Å; P409-A412 PolarHBondContact O-N 3.03Å; P409-L413 PolarHBondContact O-N 2.66Å; P409-L413 VanDerWaalsContact O-N 3.17Å
410	N	95.6	Very high	93	Very high	123 Å²	123	62.4 Å²	62.4	66%	0.658	33%	0.327	S	S	*	.	H	α-helix	trans	-52.7	-34.1	178.2	-71.3	-33	0	0	0	113	W408 A412 L413 N414	W408-N410 PolarHBondContact O-N 3.47Å; N410-A412 VanDerWaalsContact C-N 3.29Å; N410-A412 PolarHBondContact O-N 2.96Å; N410-L413 PolarHBondContact O-N 2.69Å; N410-N414 WeakPolarHBondContact O-CB 3.38Å; N410-N414 PolarHBondContact O-N 2.98Å; N410-N414 PolarHBondContact O-ND2 3.24Å; N410-N414 PolarHBondContact O-OD1 3.42Å
411	S	95.7	Very high	93.3	Very high	79 Å²	79	65.2 Å²	65.2	55%	0.552	35%	0.35	S	S	*	.	H	α-helix	trans	-66.2	-28.3	176.7	60.4	0	0	0	0	113.9	P409 Q415	P409-S411 PolarHBondContact O-N 3.28Å; S411-Q415 WeakPolarHBondContact O-CG 3.39Å; S411-Q415 PolarHBondContact O-N 3.45Å; S411-Q415 PolarHBondContact O-NE2 3.39Å
412	A	95.4	Very high	93.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-78.8	-40.5	174.2	0	0	0	0	0	110.8	F372 V373 L376 P409 N410 Q415 L416	F372-A412 HydrophobicContact CD1-CB 4.07Å; F372-A412 HydrophobicContact CE1-CB 3.96Å; V373-A412 HydrophobicContact CG2-CB 4.4Å; L376-A412 HydrophobicContact CD1-CB 3.81Å; P409-A412 WeakPolarHBondContact O-CA 3.34Å; P409-A412 WeakPolarHBondContact O-CB 3.29Å; P409-A412 PolarHBondContact O-N 3.03Å; N410-A412 VanDerWaalsContact C-N 3.29Å; N410-A412 PolarHBondContact O-N 2.96Å; A412-Q415 PolarHBondContact O-N 3.27Å; A412-L416 PolarHBondContact O-N 3.27Å
413	L	95.5	Very high	93.8	Very high	68 Å²	68	63.4 Å²	63.4	36%	0.356	34%	0.336	S	S	.	.	H	α-helix	trans	-63.7	-43.3	175.8	-65.5	177.9	0	0	0	112.3	W408 P409 N410 Q415 L416 A417	W408-L413 HydrophobicContact CB-CD1 4.44Å; W408-L413 HydrophobicContact CB-CD2 3.91Å; W408-L413 HydrophobicContact CB-CG 3.99Å; W408-L413 HydrophobicContact CG-CD2 4.24Å; P409-L413 PolarHBondContact O-N 2.66Å; P409-L413 VanDerWaalsContact O-N 3.17Å; N410-L413 PolarHBondContact O-N 2.69Å; L413-Q415 VanDerWaalsContact C-N 3.34Å; L413-Q415 PolarHBondContact O-N 3.47Å; L413-L416 WeakPolarHBondContact O-CB 3.42Å; L413-L416 PolarHBondContact O-N 2.88Å; L413-L416 VanDerWaalsContact O-N 3.14Å; L413-A417 PolarHBondContact O-N 3.16Å
414	N	96.1	Very high	93.8	Very high	106 Å²	106	67 Å²	67	57%	0.567	36%	0.355	S	S	*	.	H	α-helix	trans	-61.1	-43.5	176.2	-68.7	-12.3	0	0	0	111.5	N410 L416 A417 D418	N410-N414 WeakPolarHBondContact O-CB 3.38Å; N410-N414 PolarHBondContact O-N 2.98Å; N410-N414 PolarHBondContact O-ND2 3.24Å; N410-N414 PolarHBondContact O-OD1 3.42Å; N414-L416 VanDerWaalsContact C-N 3.32Å; N414-L416 PolarHBondContact O-N 2.81Å; N414-A417 WeakPolarHBondContact O-CB 3.49Å; N414-A417 PolarHBondContact O-N 3.26Å; N414-D418 PolarHBondContact O-N 2.76Å
415	Q	95.3	Very high	93.7	Very high	55 Å²	55	64.3 Å²	64.3	26%	0.257	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-39.6	174.6	-80.8	175.5	79.4	0	0	112.1	L376 S411 A412 L413 Y419	L376-Q415 HydrophobicContact CD1-CB 4.2Å; L376-Q415 HydrophobicContact CD2-CB 4.49Å; S411-Q415 WeakPolarHBondContact O-CG 3.39Å; S411-Q415 PolarHBondContact O-N 3.45Å; S411-Q415 PolarHBondContact O-NE2 3.39Å; A412-Q415 PolarHBondContact O-N 3.27Å; L413-Q415 VanDerWaalsContact C-N 3.34Å; L413-Q415 PolarHBondContact O-N 3.47Å; Q415-Y419 WeakPolarHBondContact O-CD2 3.37Å
416	L	96	Very high	93.5	Very high	11 Å²	11	58.2 Å²	58.2	6%	0.058	35%	0.345	C	S	.	.	H	α-helix	trans	-64.4	-43.3	176.6	-171.7	68.6	0	0	0	110.9	F372 L376 L395 L398 A412 L413 N414 D418 Y419 S420	F372-L416 HydrophobicContact CZ-CD2 4.14Å; L376-L416 HydrophobicContact CD2-CB 4.3Å; L376-L416 HydrophobicContact CD2-CD1 4.11Å; L395-L416 HydrophobicContact CD1-CD1 3.52Å; L395-L416 HydrophobicContact CD1-CG 4.17Å; L398-L416 HydrophobicContact CB-CD1 3.72Å; L398-L416 HydrophobicContact CB-CD2 4.24Å; L398-L416 HydrophobicContact CD1-CD1 3.95Å; L398-L416 HydrophobicContact CG-CD1 4.48Å; A412-L416 PolarHBondContact O-N 3.27Å; L413-L416 WeakPolarHBondContact O-CB 3.42Å; L413-L416 PolarHBondContact O-N 2.88Å; L413-L416 VanDerWaalsContact O-N 3.14Å; N414-L416 VanDerWaalsContact C-N 3.32Å; N414-L416 PolarHBondContact O-N 2.81Å; L416-D418 VanDerWaalsContact C-N 3.29Å; L416-D418 PolarHBondContact O-N 2.89Å; L416-Y419 CarbonylContact O-C 3.59Å; L416-Y419 WeakPolarHBondContact O-CA 3.3Å; L416-Y419 PolarHBondContact O-N 3.5Å; L416-S420 PolarHBondContact O-N 3.46Å; L416-S420 PolarHBondContact O-OG 2.85Å
417	A	95.3	Very high	93.4	Very high	54 Å²	54	62.5 Å²	62.5	45%	0.446	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-38.4	178.8	0	0	0	0	0	112.7	L413 N414 Y419 S420 A421	L413-A417 PolarHBondContact O-N 3.16Å; N414-A417 WeakPolarHBondContact O-CB 3.49Å; N414-A417 PolarHBondContact O-N 3.26Å; A417-Y419 PolarHBondContact O-N 3.48Å; A417-S420 PolarHBondContact O-N 3.13Å; A417-S420 VanDerWaalsContact O-N 3.17Å; A417-A421 PolarHBondContact O-N 2.99Å
418	D	92.8	Very high	93.3	Very high	111 Å²	111	60 Å²	60	59%	0.594	36%	0.356	S	S	*	.	H	α-helix	trans	-60.7	-32.3	174.3	-66.1	-24.5	0	0	0	112.8	N414 L416	N414-D418 PolarHBondContact O-N 2.76Å; L416-D418 VanDerWaalsContact C-N 3.29Å; L416-D418 PolarHBondContact O-N 2.89Å
419	Y	94.5	Very high	93.2	Very high	21 Å²	21	60.6 Å²	60.6	8%	0.082	36%	0.36	C	S	.	.	H	α-helix	trans	-82.7	-34.3	173.6	-69	-81.7	0	0	0	112.1	M379 R380 R383 L395 Q415 L416 A417 A421 L422	M379-Y419 HydrophobicContact CB-CE1 4.49Å; M379-Y419 HydrophobicContact CE-CD1 3.89Å; M379-Y419 HydrophobicContact CE-CD2 3.9Å; M379-Y419 HydrophobicContact CE-CE1 4.48Å; M379-Y419 HydrophobicContact CE-CG 3.58Å; R380-Y419 VanDerWaalsContact CA-OH 3.24Å; R380-Y419 WeakPolarHBondContact CA-OH 3.26Å; R380-Y419 WeakPolarHBondContact CB-OH 3.23Å; R383-Y419 HydrophobicContact CB-CE1 4.29Å; L395-Y419 WeakPolarHBondContact CD2-O 3.4Å; Q415-Y419 WeakPolarHBondContact O-CD2 3.37Å; L416-Y419 CarbonylContact O-C 3.59Å; L416-Y419 WeakPolarHBondContact O-CA 3.3Å; L416-Y419 PolarHBondContact O-N 3.5Å; A417-Y419 PolarHBondContact O-N 3.48Å; Y419-A421 VanDerWaalsContact C-N 3.27Å; Y419-A421 PolarHBondContact O-N 3.27Å; Y419-L422 VanDerWaalsContact O-CB 3.24Å; Y419-L422 WeakPolarHBondContact O-CB 3.34Å; Y419-L422 PolarHBondContact O-N 2.91Å; Y419-L422 VanDerWaalsContact O-N 3.11Å
420	S	93.9	Very high	93.2	Very high	39 Å²	39	63.4 Å²	63.4	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-39.8	173.5	-59.3	0	0	0	0	111.3	L416 A417 L422 I423 D424	L416-S420 PolarHBondContact O-N 3.46Å; L416-S420 PolarHBondContact O-OG 2.85Å; A417-S420 PolarHBondContact O-N 3.13Å; A417-S420 VanDerWaalsContact O-N 3.17Å; S420-L422 PolarHBondContact O-N 3.39Å; S420-I423 CarbonylContact O-C 3.57Å; S420-I423 PolarHBondContact O-N 3.38Å; S420-I423 VanDerWaalsContact O-N 3.09Å; S420-D424 PolarHBondContact O-N 3.33Å
421	A	94	Very high	93.1	Very high	59 Å²	59	59.7 Å²	59.7	49%	0.488	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-61.3	-24.3	175.8	0	0	0	0	0	113.7	A417 Y419 I423	A417-A421 PolarHBondContact O-N 2.99Å; Y419-A421 VanDerWaalsContact C-N 3.27Å; Y419-A421 PolarHBondContact O-N 3.27Å; A421-I423 VanDerWaalsContact C-N 3.33Å
422	L	91.4	Very high	93.1	Very high	9 Å²	9	56 Å²	56	5%	0.047	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-66	-37.5	175.7	178.4	63.5	0	0	0	111.5	Y419 S420 Y432 V435	Y419-L422 VanDerWaalsContact O-CB 3.24Å; Y419-L422 WeakPolarHBondContact O-CB 3.34Å; Y419-L422 PolarHBondContact O-N 2.91Å; Y419-L422 VanDerWaalsContact O-N 3.11Å; S420-L422 PolarHBondContact O-N 3.39Å; L422-Y432 HydrophobicContact CG-CD2 4.39Å; L422-Y432 WeakPolarHBondContact O-CA 3.45Å; L422-Y432 VanDerWaalsContact O-CB 3.24Å; L422-Y432 WeakPolarHBondContact O-CB 3.25Å; L422-Y432 PolarHBondContact O-N 3.45Å; L422-V435 HydrophobicContact CD1-CB 4.05Å; L422-V435 HydrophobicContact CD1-CG1 4.31Å; L422-V435 HydrophobicContact CD1-CG2 3.67Å
423	I	91.4	Very high	93.1	Very high	12 Å²	12	59.6 Å²	59.6	6%	0.062	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-110.6	22.3	-174.3	-154.4	57.1	0	0	0	112.5	F109 L392 L395 S420 A421 S425 F429 Y432 L449	F109-I423 HydrophobicContact CE1-CG2 4.45Å; F109-I423 HydrophobicContact CE2-CG1 4.39Å; F109-I423 HydrophobicContact CE2-CG2 4.18Å; F109-I423 HydrophobicContact CZ-CB 4.33Å; F109-I423 HydrophobicContact CZ-CG1 3.75Å; F109-I423 HydrophobicContact CZ-CG2 3.62Å; L392-I423 HydrophobicContact CD1-CD1 3.73Å; L392-I423 HydrophobicContact CD1-CG1 4Å; L392-I423 HydrophobicContact CD2-CB 3.87Å; L392-I423 HydrophobicContact CD2-CG1 4.09Å; L392-I423 HydrophobicContact CD2-CG2 4.14Å; L395-I423 HydrophobicContact CD2-CG2 3.68Å; S420-I423 CarbonylContact O-C 3.57Å; S420-I423 PolarHBondContact O-N 3.38Å; S420-I423 VanDerWaalsContact O-N 3.09Å; A421-I423 VanDerWaalsContact C-N 3.33Å; I423-S425 PolarHBondContact O-N 3.24Å; I423-F429 HydrophobicContact CD1-CD1 4.01Å; I423-F429 HydrophobicContact CG1-CD1 4.25Å; I423-F429 HydrophobicContact CG1-CE1 4.43Å; I423-F429 WeakPolarHBondContact O-CD1 2.98Å; I423-F429 WeakPolarHBondContact O-CE1 3.47Å; I423-Y432 HydrophobicContact CD1-CD1 4.45Å; I423-Y432 HydrophobicContact CD1-CD2 3.83Å; I423-Y432 HydrophobicContact CD1-CG 3.76Å; I423-L449 HydrophobicContact CD1-CD1 3.8Å
424	D	89.7	Confident	93	Very high	75 Å²	75	58.9 Å²	58.9	40%	0.401	35%	0.345	S	S	.	.			trans	-57.7	135	174.7	-178.6	73.1	0	0	0	110.9	S420 S426 F429	S420-D424 PolarHBondContact O-N 3.33Å; D424-S426 VanDerWaalsContact C-N 3.25Å; D424-S426 PolarHBondContact O-N 2.74Å; D424-S426 WeakPolarHBondContact OD2-CB 3.17Å; D424-S426 PolarHBondContact OD2-N 2.96Å; D424-S426 PolarHBondContact OD2-OG 3.44Å; D424-F429 WeakPolarHBondContact O-CA 3.4Å; D424-F429 WeakPolarHBondContact O-CD1 3.49Å
425	S	88.8	Confident	92.9	Very high	85 Å²	85	56 Å²	56	59%	0.594	33%	0.331	S	S	*	.			trans	-78	-8.8	-173.8	59.3	0	0	0	0	113.4	I423 S428	I423-S425 PolarHBondContact O-N 3.24Å; S425-S428 PolarHBondContact O-N 3.15Å
426	S	87.7	Confident	92.8	Very high	63 Å²	63	54.5 Å²	54.5	44%	0.441	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-58.8	142.4	179.2	72.5	0	0	0	0	111.5	D424 S428 F429 K430	D424-S426 VanDerWaalsContact C-N 3.25Å; D424-S426 PolarHBondContact O-N 2.74Å; D424-S426 WeakPolarHBondContact OD2-CB 3.17Å; D424-S426 PolarHBondContact OD2-N 2.96Å; D424-S426 PolarHBondContact OD2-OG 3.44Å; S426-S428 PolarHBondContact O-N 3.27Å; S426-S428 VanDerWaalsContact O-N 3.13Å; S426-F429 PolarHBondContact O-N 2.97Å; S426-K430 PolarHBondContact O-N 3.28Å
427	Q	91.2	Very high	92.7	Very high	138 Å²	138	56.6 Å²	56.6	65%	0.645	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	49.4	41.1	-178.8	-63.5	173.9	64.6	0	0	112.4	K430	Q427-K430 HydrophobicContact CB-CB 3.88Å; Q427-K430 HydrophobicContact CB-CD 4.12Å; Q427-K430 PolarHBondContact O-N 2.91Å; Q427-K430 VanDerWaalsContact OE1-CD 3.26Å
428	S	88.9	Confident	92.5	Very high	82 Å²	82	60.7 Å²	60.7	57%	0.573	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	58.5	48.1	178.8	-56.1	0	0	0	0	113.7	S425 S426 R433	S425-S428 PolarHBondContact O-N 3.15Å; S426-S428 PolarHBondContact O-N 3.27Å; S426-S428 VanDerWaalsContact O-N 3.13Å; S428-R433 WeakPolarHBondContact O-CD 3.31Å; S428-R433 PolarHBondContact O-NE 3.03Å
429	F	93.9	Very high	92.5	Very high	38 Å²	38	56.9 Å²	56.9	17%	0.167	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	37.9	179.4	-51.3	-88.4	0	0	0	114	I423 D424 S426 A431 Y432 R433 L449	I423-F429 HydrophobicContact CD1-CD1 4.01Å; I423-F429 HydrophobicContact CG1-CD1 4.25Å; I423-F429 HydrophobicContact CG1-CE1 4.43Å; I423-F429 WeakPolarHBondContact O-CD1 2.98Å; I423-F429 WeakPolarHBondContact O-CE1 3.47Å; D424-F429 WeakPolarHBondContact O-CA 3.4Å; D424-F429 WeakPolarHBondContact O-CD1 3.49Å; S426-F429 PolarHBondContact O-N 2.97Å; F429-A431 VanDerWaalsContact C-N 3.29Å; F429-A431 PolarHBondContact O-N 3.42Å; F429-Y432 PolarHBondContact O-N 3.28Å; F429-R433 WeakPolarHBondContact O-CG 3.41Å; F429-R433 PolarHBondContact O-N 3.23Å; F429-L449 HydrophobicContact CB-CD1 3.76Å; F429-L449 HydrophobicContact CB-CD2 4.31Å; F429-L449 HydrophobicContact CD1-CD1 4.26Å; F429-L449 HydrophobicContact CD1-CD2 4.21Å; F429-L449 HydrophobicContact CD2-CD1 4.32Å; F429-L449 HydrophobicContact CD2-CD2 3.31Å; F429-L449 HydrophobicContact CD2-CG 4.47Å; F429-L449 HydrophobicContact CE1-CD2 4.37Å; F429-L449 HydrophobicContact CE2-CD2 3.51Å; F429-L449 HydrophobicContact CG-CD1 3.87Å; F429-L449 HydrophobicContact CG-CD2 3.69Å; F429-L449 HydrophobicContact CG-CG 4.46Å; F429-L449 HydrophobicContact CZ-CD2 4.05Å
430	K	94.5	Very high	92.3	Very high	103 Å²	103	64.1 Å²	64.1	45%	0.448	37%	0.371	S	S	.	.	H	α-helix	trans	-53.1	-43.2	-176.3	-177.7	177.9	-175.2	177.2	0	113.3	S426 Q427 R433 A434	S426-K430 PolarHBondContact O-N 3.28Å; Q427-K430 HydrophobicContact CB-CB 3.88Å; Q427-K430 HydrophobicContact CB-CD 4.12Å; Q427-K430 PolarHBondContact O-N 2.91Å; Q427-K430 VanDerWaalsContact OE1-CD 3.26Å; K430-R433 PolarHBondContact O-N 3.18Å; K430-A434 WeakPolarHBondContact O-CB 3.44Å; K430-A434 PolarHBondContact O-N 3.36Å
431	A	93.6	Very high	92.3	Very high	45 Å²	45	65 Å²	65	37%	0.372	38%	0.375	S	S	.	.	H	α-helix	trans	-61.6	-50.2	-179	0	0	0	0	0	111.7	F429 R433 A434 V435	F429-A431 VanDerWaalsContact C-N 3.29Å; F429-A431 PolarHBondContact O-N 3.42Å; A431-R433 PolarHBondContact O-N 3.2Å; A431-A434 PolarHBondContact O-N 2.85Å; A431-V435 WeakPolarHBondContact O-CG2 3.2Å; A431-V435 PolarHBondContact O-N 3.15Å; A431-V435 VanDerWaalsContact O-N 3.11Å
432	Y	95	Very high	92.2	Very high	1 Å²	1	65.5 Å²	65.5	0%	0.004	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-45.3	175.9	178	-94.3	0	0	0	111.6	L388 L392 L422 I423 F429 A434 V435 L436 Y446 L449	L388-Y432 HydrophobicContact CB-CE2 4.23Å; L388-Y432 HydrophobicContact CD1-CE2 4.01Å; L392-Y432 HydrophobicContact CD1-CD2 4.2Å; L392-Y432 HydrophobicContact CD1-CE2 3.89Å; L422-Y432 HydrophobicContact CG-CD2 4.39Å; L422-Y432 WeakPolarHBondContact O-CA 3.45Å; L422-Y432 VanDerWaalsContact O-CB 3.24Å; L422-Y432 WeakPolarHBondContact O-CB 3.25Å; L422-Y432 PolarHBondContact O-N 3.45Å; I423-Y432 HydrophobicContact CD1-CD1 4.45Å; I423-Y432 HydrophobicContact CD1-CD2 3.83Å; I423-Y432 HydrophobicContact CD1-CG 3.76Å; F429-Y432 PolarHBondContact O-N 3.28Å; Y432-A434 VanDerWaalsContact C-N 3.35Å; Y432-A434 PolarHBondContact O-N 3.24Å; Y432-V435 PolarHBondContact O-N 2.96Å; Y432-L436 HydrophobicContact CE1-CB 4.25Å; Y432-L436 HydrophobicContact CE1-CD2 3.9Å; Y432-L436 WeakPolarHBondContact O-CB 3.25Å; Y432-L436 PolarHBondContact O-N 3.46Å; Y432-Y446 WeakPolarHBondContact OH-CB 3.43Å; Y432-Y446 PolarHBondContact OH-N 3.39Å; Y432-L449 HydrophobicContact CD1-CD1 3.3Å; Y432-L449 HydrophobicContact CE1-CD1 3.72Å; Y432-L449 HydrophobicContact CG-CD1 3.94Å
433	R	94.7	Very high	92.4	Very high	76 Å²	76	65 Å²	65	29%	0.287	37%	0.371	S	S	.	.	H	α-helix	trans	-62.9	-40.1	-178.9	-70.5	176.8	-174.9	-78.7	1.2	112.3	S428 F429 K430 A431 L436 A437 D453	S428-R433 WeakPolarHBondContact O-CD 3.31Å; S428-R433 PolarHBondContact O-NE 3.03Å; F429-R433 WeakPolarHBondContact O-CG 3.41Å; F429-R433 PolarHBondContact O-N 3.23Å; K430-R433 PolarHBondContact O-N 3.18Å; A431-R433 PolarHBondContact O-N 3.2Å; R433-L436 PolarHBondContact O-N 2.89Å; R433-A437 WeakPolarHBondContact O-CB 3.33Å; R433-A437 PolarHBondContact O-N 3.37Å; R433-D453 IonicContact CZ-OD1 3.83Å; R433-D453 IonicContact CZ-OD2 3.6Å; R433-D453 VanDerWaalsContact NH1-CG 3.34Å; R433-D453 IonicContact NH1-OD1 3.89Å; R433-D453 PolarHBondContact NH1-OD1 3.1Å; R433-D453 IonicContact NH1-OD2 4Å; R433-D453 PolarHBondContact NH1-OD2 3.04Å; R433-D453 IonicContact NH2-OD1 2.84Å; R433-D453 PolarHBondContact NH2-OD1 3.37Å; R433-D453 IonicContact NH2-OD2 2.78Å
434	A	94.7	Very high	92.7	Very high	53 Å²	53	64.5 Å²	64.5	44%	0.438	37%	0.369	S	S	.	.	H	α-helix	trans	-62.6	-48.3	174.7	0	0	0	0	0	111.3	K430 A431 Y432 L436 A437 D438	K430-A434 WeakPolarHBondContact O-CB 3.44Å; K430-A434 PolarHBondContact O-N 3.36Å; A431-A434 PolarHBondContact O-N 2.85Å; Y432-A434 VanDerWaalsContact C-N 3.35Å; Y432-A434 PolarHBondContact O-N 3.24Å; A434-L436 VanDerWaalsContact C-N 3.31Å; A434-L436 PolarHBondContact O-N 3.24Å; A434-A437 PolarHBondContact O-N 3.46Å; A434-D438 PolarHBondContact O-N 2.87Å; A434-D438 VanDerWaalsContact O-N 3.1Å
435	V	93.7	Very high	93.1	Very high	46 Å²	46	61 Å²	61	28%	0.279	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-44.4	175.7	170.8	0	0	0	0	111	L388 L422 A431 Y432 A437 D438 T439	L388-V435 HydrophobicContact CD1-CG1 4.49Å; L422-V435 HydrophobicContact CD1-CB 4.05Å; L422-V435 HydrophobicContact CD1-CG1 4.31Å; L422-V435 HydrophobicContact CD1-CG2 3.67Å; A431-V435 WeakPolarHBondContact O-CG2 3.2Å; A431-V435 PolarHBondContact O-N 3.15Å; A431-V435 VanDerWaalsContact O-N 3.11Å; Y432-V435 PolarHBondContact O-N 2.96Å; V435-A437 PolarHBondContact O-N 3.14Å; V435-D438 PolarHBondContact O-N 2.81Å; V435-T439 WeakPolarHBondContact O-CB 3.32Å; V435-T439 PolarHBondContact O-N 3.43Å; V435-T439 PolarHBondContact O-OG1 2.81Å
436	L	93.9	Very high	93.4	Very high	23 Å²	23	58.5 Å²	58.5	12%	0.12	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-39.8	179.6	-175.1	64.2	0	0	0	112	L388 Y432 R433 A434 T439 P445 R493 F494	L388-L436 HydrophobicContact CD1-CD1 4.25Å; Y432-L436 HydrophobicContact CE1-CB 4.25Å; Y432-L436 HydrophobicContact CE1-CD2 3.9Å; Y432-L436 WeakPolarHBondContact O-CB 3.25Å; Y432-L436 PolarHBondContact O-N 3.46Å; R433-L436 PolarHBondContact O-N 2.89Å; A434-L436 VanDerWaalsContact C-N 3.31Å; A434-L436 PolarHBondContact O-N 3.24Å; L436-T439 PolarHBondContact O-N 3.3Å; L436-P445 HydrophobicContact CD1-CB 3.8Å; L436-P445 HydrophobicContact CD2-CB 4.48Å; L436-R493 PolarHBondContact O-NH2 2.82Å; L436-F494 HydrophobicContact CD1-CD2 4.49Å; L436-F494 HydrophobicContact CD1-CE2 3.51Å; L436-F494 HydrophobicContact CD1-CZ 3.73Å; L436-F494 HydrophobicContact CG-CE2 4.1Å; L436-F494 HydrophobicContact CG-CZ 4.37Å
437	A	92.5	Very high	93.8	Very high	56 Å²	56	55.6 Å²	55.6	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-46.9	178.2	0	0	0	0	0	111.7	R433 A434 V435 T439 R493	R433-A437 WeakPolarHBondContact O-CB 3.33Å; R433-A437 PolarHBondContact O-N 3.37Å; A434-A437 PolarHBondContact O-N 3.46Å; V435-A437 PolarHBondContact O-N 3.14Å; A437-T439 VanDerWaalsContact C-N 3.34Å; A437-R493 PolarHBondContact O-NH1 2.96Å; A437-R493 PolarHBondContact O-NH2 2.92Å; A437-R493 VanDerWaalsContact O-NH2 3.12Å
438	D	92.3	Very high	93.9	Very high	139 Å²	139	49.3 Å²	49.3	74%	0.743	28%	0.28	S	S	*	.	H	α-helix	trans	-76	-19.9	-178.6	-71.5	-8	0	0	0	113.6	A434 V435 K440	A434-D438 PolarHBondContact O-N 2.87Å; A434-D438 VanDerWaalsContact O-N 3.1Å; V435-D438 PolarHBondContact O-N 2.81Å; D438-K440 PolarHBondContact O-N 3.38Å
439	T	92.4	Very high	94	Very high	31 Å²	31	45.7 Å²	45.7	19%	0.19	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-70.9	128.3	-179.3	-63.2	0	0	0	0	110.8	V435 L436 A437 C443 F494	V435-T439 WeakPolarHBondContact O-CB 3.32Å; V435-T439 PolarHBondContact O-N 3.43Å; V435-T439 PolarHBondContact O-OG1 2.81Å; L436-T439 PolarHBondContact O-N 3.3Å; A437-T439 VanDerWaalsContact C-N 3.34Å; T439-C443 HydrophobicContact CG2-CB 3.61Å; T439-C443 VanDerWaalsContact CG2-SG 3.58Å; T439-F494 HydrophobicContact CG2-CE1 4.47Å; T439-F494 VanDerWaalsContact O-CE1 3.32Å; T439-F494 WeakPolarHBondContact O-CE1 3.47Å
440	K	91.1	Very high	94.1	Very high	174 Å²	174	44.5 Å²	44.5	76%	0.757	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-95.1	156.5	171.1	-62.3	-178.2	-178.4	-179.9	0	110.7	D438	D438-K440 PolarHBondContact O-N 3.38Å
441	P	92.2	Very high	94.1	Very high	56 Å²	56	39.6 Å²	39.6	36%	0.364	23%	0.228	S	C	.	.	S	Bend	trans	-55.3	147.3	169	-23.8	34.2	0	0	0	112	R493 F494 W497	P441-R493 VanDerWaalsContact CG-O 3.24Å; P441-R493 WeakPolarHBondContact CG-O 3.14Å; P441-F494 HydrophobicContact CG-CD1 4.21Å; P441-W497 HydrophobicContact CB-CG 4.4Å
442	P	93.8	Very high	94	Very high	70 Å²	70	41 Å²	41	46%	0.455	23%	0.226	S	C	.	.	S	Bend	cis	-75	134.8	-0.7	31.7	-36.1	0	0	0	112.9	W497	P442-W497 HydrophobicContact CB-CD2 3.42Å; P442-W497 VanDerWaalsContact CB-CD2 3.42Å; P442-W497 HydrophobicContact CB-CE3 3.49Å; P442-W497 VanDerWaalsContact CB-CE3 3.49Å; P442-W497 HydrophobicContact CB-CG 4.01Å; P442-W497 HydrophobicContact CB-CH2 3.71Å; P442-W497 HydrophobicContact CB-CZ2 3.7Å; P442-W497 HydrophobicContact CB-CZ3 3.64Å
443	C	95.4	Very high	94	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.			trans	-150.9	139.1	178.1	176.4	0	0	0	0	110.7	G386 T439 F494	G386-C443 CarbonylContact O-C 3.56Å; G386-C443 WeakPolarHBondContact O-CA 3.47Å; T439-C443 HydrophobicContact CG2-CB 3.61Å; T439-C443 VanDerWaalsContact CG2-SG 3.58Å; C443-F494 HydrophobicContact CB-CD1 3.54Å; C443-F494 HydrophobicContact CB-CE1 3.63Å; C443-F494 HydrophobicContact CB-CG 4.23Å; C443-F494 HydrophobicContact CB-CZ 4.39Å
444	L	97.5	Very high	94	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-115.2	97.8	173	-62	163.4	0	0	0	108.2	T311 D314 W315 F318 G386 N387 L388 N389 W497	T311-L444 HydrophobicContact CG2-CD1 3.95Å; D314-L444 HydrophobicContact CB-CD1 3.7Å; W315-L444 HydrophobicContact CB-CD1 4.22Å; W315-L444 HydrophobicContact CB-CD2 4.23Å; F318-L444 HydrophobicContact CB-CD2 3.88Å; F318-L444 HydrophobicContact CD1-CD2 3.59Å; F318-L444 HydrophobicContact CE1-CD2 4.4Å; F318-L444 HydrophobicContact CG-CD2 3.91Å; G386-L444 PolarHBondContact O-N 3.28Å; N387-L444 HydrophobicContact CB-CD1 4.12Å; L388-L444 PolarHBondContact N-O 3.47Å; N389-L444 PolarHBondContact N-O 2.79Å; L444-W497 HydrophobicContact CD2-CZ2 4.11Å; L444-W497 HydrophobicContact CG-CZ2 4.21Å
445	P	96.7	Very high	93.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.206	C	C	.	.			trans	-72	150.3	-176.5	29.9	-35.6	0	0	0	111.7	F318 L436 L447 I450 F494	F318-P445 HydrophobicContact CE2-CG 4.2Å; F318-P445 HydrophobicContact CZ-CG 4.16Å; L436-P445 HydrophobicContact CD1-CB 3.8Å; L436-P445 HydrophobicContact CD2-CB 4.48Å; P445-L447 HydrophobicContact CG-CD2 3.96Å; P445-L447 PolarHBondContact O-N 3.09Å; P445-I450 HydrophobicContact CB-CD1 3.97Å; P445-I450 HydrophobicContact CG-CD1 4.19Å; P445-F494 HydrophobicContact CB-CD2 4.48Å; P445-F494 HydrophobicContact CG-CD2 4.07Å
446	Y	96.2	Very high	94	Very high	34 Å²	34	42.9 Å²	42.9	13%	0.133	23%	0.227	C	C	.	.			trans	-70.7	110.3	162.3	174.5	-117.1	0	0	0	110.1	V112 F348 L392 Y432 G448 L449	V112-Y446 HydrophobicContact CG2-CE2 4.31Å; F348-Y446 HydrophobicContact CD2-CD2 4.31Å; F348-Y446 HydrophobicContact CD2-CE2 4.37Å; F348-Y446 AromaticContact CE2-CD2 3.77Å; F348-Y446 HydrophobicContact CE2-CD2 3.77Å; F348-Y446 AromaticContact CE2-CE2 3.78Å; F348-Y446 HydrophobicContact CE2-CE2 3.78Å; F348-Y446 HydrophobicContact CZ-CD2 4.3Å; F348-Y446 AromaticContact CZ-CE2 3.88Å; F348-Y446 HydrophobicContact CZ-CE2 3.88Å; L392-Y446 HydrophobicContact CD1-CD1 3.98Å; L392-Y446 HydrophobicContact CD1-CG 3.82Å; Y432-Y446 WeakPolarHBondContact OH-CB 3.43Å; Y432-Y446 PolarHBondContact OH-N 3.39Å; Y446-G448 VanDerWaalsContact C-N 3.25Å; Y446-G448 PolarHBondContact O-N 3.01Å; Y446-L449 HydrophobicContact CD1-CD1 4.42Å; Y446-L449 HydrophobicContact CD1-CG 4.04Å; Y446-L449 HydrophobicContact CE1-CG 4.1Å
447	L	95.3	Very high	94	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-71.3	-17.7	-174.3	-63.1	-172.6	0	0	0	113.7	F318 I321 M326 L341 F344 P445 L449 I450 L451	F318-L447 HydrophobicContact CD2-CD1 4.3Å; F318-L447 HydrophobicContact CE2-CD1 4.42Å; F318-L447 HydrophobicContact CE2-CD2 4Å; I321-L447 HydrophobicContact CD1-CD1 3.55Å; M326-L447 HydrophobicContact CE-CD2 4.01Å; L341-L447 HydrophobicContact CD1-CD1 3.8Å; F344-L447 HydrophobicContact CD1-CD1 3.72Å; F344-L447 HydrophobicContact CD1-CG 4.3Å; F344-L447 HydrophobicContact CE1-CB 4.43Å; F344-L447 HydrophobicContact CE1-CD1 3.65Å; F344-L447 HydrophobicContact CE1-CG 3.77Å; F344-L447 HydrophobicContact CZ-CD1 4.48Å; P445-L447 HydrophobicContact CG-CD2 3.96Å; P445-L447 PolarHBondContact O-N 3.09Å; L447-L449 VanDerWaalsContact C-N 3.32Å; L447-L449 PolarHBondContact O-N 3.47Å; L447-I450 HydrophobicContact CD2-CD1 3.77Å; L447-I450 PolarHBondContact O-N 2.98Å; L447-I450 VanDerWaalsContact O-N 3.11Å; L447-L451 WeakPolarHBondContact O-CG 3.39Å; L447-L451 PolarHBondContact O-N 3.33Å
448	G	92.9	Very high	94	Very high	6 Å²	6	41.2 Å²	41.2	6%	0.062	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-40.2	-175.3	0	0	0	0	0	113.9	Y446 Q452	Y446-G448 VanDerWaalsContact C-N 3.25Å; Y446-G448 PolarHBondContact O-N 3.01Å; G448-Q452 WeakPolarHBondContact O-CB 3.45Å; G448-Q452 PolarHBondContact O-N 3.36Å
449	L	92.7	Very high	94	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-71.5	-33.8	176.4	-67.5	177.9	0	0	0	112.7	I423 F429 Y432 Y446 L447 Q452 D453	I423-L449 HydrophobicContact CD1-CD1 3.8Å; F429-L449 HydrophobicContact CB-CD1 3.76Å; F429-L449 HydrophobicContact CB-CD2 4.31Å; F429-L449 HydrophobicContact CD1-CD1 4.26Å; F429-L449 HydrophobicContact CD1-CD2 4.21Å; F429-L449 HydrophobicContact CD2-CD1 4.32Å; F429-L449 HydrophobicContact CD2-CD2 3.31Å; F429-L449 HydrophobicContact CD2-CG 4.47Å; F429-L449 HydrophobicContact CE1-CD2 4.37Å; F429-L449 HydrophobicContact CE2-CD2 3.51Å; F429-L449 HydrophobicContact CG-CD1 3.87Å; F429-L449 HydrophobicContact CG-CD2 3.69Å; F429-L449 HydrophobicContact CG-CG 4.46Å; F429-L449 HydrophobicContact CZ-CD2 4.05Å; Y432-L449 HydrophobicContact CD1-CD1 3.3Å; Y432-L449 HydrophobicContact CE1-CD1 3.72Å; Y432-L449 HydrophobicContact CG-CD1 3.94Å; Y446-L449 HydrophobicContact CD1-CD1 4.42Å; Y446-L449 HydrophobicContact CD1-CG 4.04Å; Y446-L449 HydrophobicContact CE1-CG 4.1Å; L447-L449 VanDerWaalsContact C-N 3.32Å; L447-L449 PolarHBondContact O-N 3.47Å; L449-Q452 WeakPolarHBondContact O-CB 3.37Å; L449-Q452 PolarHBondContact O-N 3.12Å; L449-D453 PolarHBondContact O-N 3.3Å
450	I	94.3	Very high	94	Very high	12 Å²	12	40.1 Å²	40.1	6%	0.062	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-43.1	176.7	-65	156	0	0	0	110.5	M326 P445 L447 Q452 D453 L454 I487 V491	M326-I450 HydrophobicContact CE-CB 4.39Å; M326-I450 HydrophobicContact CE-CG2 3.6Å; P445-I450 HydrophobicContact CB-CD1 3.97Å; P445-I450 HydrophobicContact CG-CD1 4.19Å; L447-I450 HydrophobicContact CD2-CD1 3.77Å; L447-I450 PolarHBondContact O-N 2.98Å; L447-I450 VanDerWaalsContact O-N 3.11Å; I450-Q452 VanDerWaalsContact C-N 3.3Å; I450-Q452 PolarHBondContact O-N 3.1Å; I450-D453 PolarHBondContact O-N 3.41Å; I450-L454 HydrophobicContact CG2-CD1 4.47Å; I450-L454 WeakPolarHBondContact O-CG 3.48Å; I450-L454 PolarHBondContact O-N 3.27Å; I450-I487 HydrophobicContact CG2-CG2 3.79Å; I450-V491 HydrophobicContact CD1-CG2 3.86Å; I450-V491 HydrophobicContact CG1-CG2 4.41Å; I450-V491 HydrophobicContact CG2-CG2 3.7Å
451	L	95.4	Very high	94	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-66.3	-34.8	175.9	-65.2	174.5	0	0	0	111.7	F114 M326 W329 L341 L447 L454 T455	F114-L451 HydrophobicContact CD1-CD1 4.33Å; F114-L451 HydrophobicContact CD2-CD1 3.93Å; F114-L451 HydrophobicContact CE1-CD1 4.04Å; F114-L451 HydrophobicContact CE2-CD1 3.53Å; F114-L451 HydrophobicContact CG-CD1 4.31Å; F114-L451 HydrophobicContact CZ-CD1 3.62Å; M326-L451 HydrophobicContact CB-CD2 4.14Å; M326-L451 HydrophobicContact CE-CD2 4.17Å; M326-L451 HydrophobicContact CG-CD2 4.41Å; W329-L451 HydrophobicContact CB-CD2 4.32Å; W329-L451 HydrophobicContact CG-CD2 4.28Å; L341-L451 HydrophobicContact CD1-CD1 4.2Å; L341-L451 HydrophobicContact CD2-CD1 4Å; L341-L451 HydrophobicContact CD2-CD2 3.99Å; L341-L451 HydrophobicContact CG-CD1 4.48Å; L447-L451 WeakPolarHBondContact O-CG 3.39Å; L447-L451 PolarHBondContact O-N 3.33Å; L451-L454 HydrophobicContact CD2-CD1 4.39Å; L451-L454 PolarHBondContact O-N 2.89Å; L451-T455 WeakPolarHBondContact O-CB 3.39Å; L451-T455 PolarHBondContact O-N 2.67Å; L451-T455 PolarHBondContact O-OG1 2.79Å
452	Q	92.5	Very high	94.1	Very high	74 Å²	74	35.7 Å²	35.7	35%	0.346	21%	0.207	S	C	.	.	H	α-helix	trans	-60.6	-45.4	172.1	-178.3	-178.2	-15.7	0	0	111	G448 L449 I450 T455 F456	G448-Q452 WeakPolarHBondContact O-CB 3.45Å; G448-Q452 PolarHBondContact O-N 3.36Å; L449-Q452 WeakPolarHBondContact O-CB 3.37Å; L449-Q452 PolarHBondContact O-N 3.12Å; I450-Q452 VanDerWaalsContact C-N 3.3Å; I450-Q452 PolarHBondContact O-N 3.1Å; Q452-T455 PolarHBondContact O-N 3.13Å; Q452-F456 WeakPolarHBondContact O-CB 3.5Å; Q452-F456 PolarHBondContact O-N 3.21Å
453	D	94.3	Very high	93.9	Very high	39 Å²	39	35 Å²	35	21%	0.209	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-43.3	177.7	-61.4	-24.5	0	0	0	112.1	R433 L449 I450 T455 F456 V457 I487	R433-D453 IonicContact CZ-OD1 3.83Å; R433-D453 IonicContact CZ-OD2 3.6Å; R433-D453 VanDerWaalsContact NH1-CG 3.34Å; R433-D453 IonicContact NH1-OD1 3.89Å; R433-D453 PolarHBondContact NH1-OD1 3.1Å; R433-D453 IonicContact NH1-OD2 4Å; R433-D453 PolarHBondContact NH1-OD2 3.04Å; R433-D453 IonicContact NH2-OD1 2.84Å; R433-D453 PolarHBondContact NH2-OD1 3.37Å; R433-D453 IonicContact NH2-OD2 2.78Å; L449-D453 PolarHBondContact O-N 3.3Å; I450-D453 PolarHBondContact O-N 3.41Å; D453-T455 VanDerWaalsContact C-N 3.29Å; D453-T455 PolarHBondContact O-N 3.41Å; D453-F456 WeakPolarHBondContact O-CB 3.44Å; D453-F456 PolarHBondContact O-N 2.89Å; D453-V457 WeakPolarHBondContact O-CG2 3.36Å; D453-V457 PolarHBondContact O-N 3.47Å; D453-I487 HydrophobicContact CB-CD1 3.8Å; D453-I487 HydrophobicContact CB-CG1 4.34Å; D453-I487 HydrophobicContact CB-CG2 4.25Å
454	L	95.2	Very high	93.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-40.5	176.1	-72.7	169.8	0	0	0	111.7	M326 I450 L451 V457 H458 Q484 I487 L488	M326-L454 HydrophobicContact CB-CD1 4.18Å; I450-L454 HydrophobicContact CG2-CD1 4.47Å; I450-L454 WeakPolarHBondContact O-CG 3.48Å; I450-L454 PolarHBondContact O-N 3.27Å; L451-L454 HydrophobicContact CD2-CD1 4.39Å; L451-L454 PolarHBondContact O-N 2.89Å; L454-V457 PolarHBondContact O-N 3.26Å; L454-H458 VanDerWaalsContact O-CB 3.29Å; L454-H458 WeakPolarHBondContact O-CB 3.4Å; L454-H458 PolarHBondContact O-N 2.76Å; L454-Q484 HydrophobicContact CD2-CB 4.14Å; L454-Q484 HydrophobicContact CD2-CG 4.38Å; L454-I487 HydrophobicContact CD2-CB 3.97Å; L454-I487 HydrophobicContact CD2-CD1 4.19Å; L454-I487 HydrophobicContact CD2-CG2 3.9Å; L454-I487 HydrophobicContact CG-CB 4.44Å; L454-I487 HydrophobicContact CG-CG2 3.83Å; L454-L488 HydrophobicContact CD1-CD2 3.79Å; L454-L488 HydrophobicContact CD1-CG 4.4Å; L454-L488 HydrophobicContact CD2-CD2 4.41Å; L454-L488 HydrophobicContact CD2-CG 4.11Å
455	T	92.7	Very high	93.3	Very high	16 Å²	16	43.5 Å²	43.5	10%	0.098	24%	0.24	C	C	.	.	H	α-helix	trans	-66.5	-42.6	177	-55.6	0	0	0	0	110.6	L451 Q452 D453 V457 H458 V459	L451-T455 WeakPolarHBondContact O-CB 3.39Å; L451-T455 PolarHBondContact O-N 2.67Å; L451-T455 PolarHBondContact O-OG1 2.79Å; Q452-T455 PolarHBondContact O-N 3.13Å; D453-T455 VanDerWaalsContact C-N 3.29Å; D453-T455 PolarHBondContact O-N 3.41Å; T455-V457 PolarHBondContact O-N 3.3Å; T455-H458 PolarHBondContact O-N 3.1Å; T455-H458 VanDerWaalsContact O-N 3.16Å; T455-V459 HydrophobicContact CG2-CG2 4.19Å; T455-V459 WeakPolarHBondContact O-CB 3.45Å; T455-V459 WeakPolarHBondContact O-CG2 3.45Å; T455-V459 PolarHBondContact O-N 3.41Å
456	F	93.9	Very high	92.6	Very high	161 Å²	161	52.6 Å²	52.6	71%	0.706	28%	0.283	S	S	*	.	H	α-helix	trans	-58.7	-47.9	175.8	-179.2	-96.5	0	0	0	111.7	Q452 D453 H458 G460	Q452-F456 WeakPolarHBondContact O-CB 3.5Å; Q452-F456 PolarHBondContact O-N 3.21Å; D453-F456 WeakPolarHBondContact O-CB 3.44Å; D453-F456 PolarHBondContact O-N 2.89Å; F456-H458 VanDerWaalsContact C-N 3.32Å; F456-H458 PolarHBondContact O-N 2.75Å; F456-G460 PolarHBondContact O-N 2.92Å
457	V	94.7	Very high	91.3	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-39	175.1	173.1	0	0	0	0	111.4	D453 L454 T455 N461 K480 Q483 Q484 I487	D453-V457 WeakPolarHBondContact O-CG2 3.36Å; D453-V457 PolarHBondContact O-N 3.47Å; L454-V457 PolarHBondContact O-N 3.26Å; T455-V457 PolarHBondContact O-N 3.3Å; V457-N461 WeakPolarHBondContact O-CB 3.27Å; V457-N461 PolarHBondContact O-N 3.07Å; V457-N461 PolarHBondContact O-ND2 3.37Å; V457-K480 HydrophobicContact CG1-CG 4.19Å; V457-Q483 HydrophobicContact CG1-CB 3.71Å; V457-Q483 HydrophobicContact CG2-CB 4.19Å; V457-Q484 HydrophobicContact CB-CG 4.33Å; V457-Q484 HydrophobicContact CG1-CG 3.63Å; V457-I487 HydrophobicContact CG2-CD1 3.72Å
458	H	93.3	Very high	89.9	Confident	36 Å²	36	61.1 Å²	61.1	17%	0.167	33%	0.326	C	S	.	.	H	α-helix	trans	-64.4	-48.1	-179.8	179.7	65.9	0	0	0	112.5	S330 L454 T455 F456 K480	S330-H458 PolarHBondContact O-CD2 3.48Å; L454-H458 VanDerWaalsContact O-CB 3.29Å; L454-H458 WeakPolarHBondContact O-CB 3.4Å; L454-H458 PolarHBondContact O-N 2.76Å; T455-H458 PolarHBondContact O-N 3.1Å; T455-H458 VanDerWaalsContact O-N 3.16Å; F456-H458 VanDerWaalsContact C-N 3.32Å; F456-H458 PolarHBondContact O-N 2.75Å; H458-K480 PolarHBondContact ND1-NZ 2.87Å; H458-K480 WeakPolarHBondContact O-CE 3.41Å; H458-K480 PolarHBondContact O-NZ 2.75Å
459	V	92	Very high	88.6	Confident	90 Å²	90	70.3 Å²	70.3	55%	0.545	37%	0.367	S	S	.	.	H	α-helix	trans	-76.1	-38.9	-177	174.5	0	0	0	0	111.5	A121 T455 N461	A121-V459 HydrophobicContact CB-CG1 4.29Å; T455-V459 HydrophobicContact CG2-CG2 4.19Å; T455-V459 WeakPolarHBondContact O-CB 3.45Å; T455-V459 WeakPolarHBondContact O-CG2 3.45Å; T455-V459 PolarHBondContact O-N 3.41Å; V459-N461 VanDerWaalsContact C-N 3.31Å; V459-N461 PolarHBondContact O-N 2.95Å
460	G	91.5	Very high	87.4	Confident	57 Å²	57	78.6 Å²	78.6	59%	0.588	40%	0.403	S	S	*	.	H	α-helix	trans	-74.9	-14.7	-175.5	0	0	0	0	0	115.2	F456	F456-G460 PolarHBondContact O-N 2.92Å
461	N	92.1	Very high	86.2	Confident	51 Å²	51	82.1 Å²	82.1	27%	0.273	42%	0.422	S	S	.	.	S	Bend	trans	-126.5	132.8	-174.9	-62.4	-82.8	0	0	0	111.9	V457 V459 K480 Q483	V457-N461 WeakPolarHBondContact O-CB 3.27Å; V457-N461 PolarHBondContact O-N 3.07Å; V457-N461 PolarHBondContact O-ND2 3.37Å; V459-N461 VanDerWaalsContact C-N 3.31Å; V459-N461 PolarHBondContact O-N 2.95Å; N461-K480 HydrophobicContact CB-CB 3.99Å; N461-K480 HydrophobicContact CB-CD 3.8Å; N461-K480 HydrophobicContact CB-CG 3.83Å; N461-K480 WeakPolarHBondContact O-CD 3.43Å; N461-K480 VanDerWaalsContact O-CE 3.27Å; N461-K480 WeakPolarHBondContact O-CE 3.29Å; N461-K480 PolarHBondContact O-NZ 3.44Å; N461-Q483 PolarHBondContact ND2-OE1 3.45Å
462	S	92.9	Very high	85.1	Confident	86 Å²	86	87.2 Å²	87.2	60%	0.601	46%	0.455	S	S	*	.			trans	-61.9	143.4	171.9	-60.4	0	0	0	0	111.6	F464 N477	S462-F464 WeakPolarHBondContact CB-O 3.46Å; S462-F464 PolarHBondContact O-N 2.89Å; S462-N477 WeakPolarHBondContact O-CB 3.08Å; S462-N477 PolarHBondContact O-ND2 3.3Å
463	D	91.3	Very high	84.5	Confident	57 Å²	57	89.6 Å²	89.6	31%	0.305	47%	0.47	S	S	.	.	S	Bend	trans	-68.4	-21.8	174.5	-73.8	-41	0	0	0	113.2	N477 K480 R481	D463-N477 PolarHBondContact O-N 3.37Å; D463-K480 WeakPolarHBondContact OD1-CE 3.19Å; D463-K480 IonicContact OD1-NZ 3.79Å; D463-K480 PolarHBondContact OD1-NZ 3.36Å; D463-R481 IonicContact OD1-CZ 3.66Å; D463-R481 IonicContact OD1-NH1 3.01Å; D463-R481 PolarHBondContact OD1-NH1 3.5Å; D463-R481 VanDerWaalsContact OD1-NH1 3.1Å; D463-R481 IonicContact OD1-NH2 3.94Å; D463-R481 PolarHBondContact OD1-NH2 2.75Å
464	F	92.3	Very high	84	Confident	91 Å²	91	95.2 Å²	95.2	40%	0.399	49%	0.493	S	S	.	.	B	Isolated β-bridge	trans	-125.2	145.5	178.4	-55.6	-81.9	0	0	0	110.1	S462 K474 V475 V476	S462-F464 WeakPolarHBondContact CB-O 3.46Å; S462-F464 PolarHBondContact O-N 2.89Å; F464-K474 HydrophobicContact CB-CB 4.46Å; F464-K474 HydrophobicContact CD1-CB 3.62Å; F464-K474 HydrophobicContact CD1-CD 4.49Å; F464-K474 HydrophobicContact CD2-CD 4.33Å; F464-K474 HydrophobicContact CE1-CB 4.01Å; F464-K474 HydrophobicContact CE2-CD 4.41Å; F464-K474 HydrophobicContact CG-CB 4.04Å; F464-K474 HydrophobicContact CG-CD 4.37Å; F464-V475 CarbonylContact C-O 3.58Å; F464-V475 WeakPolarHBondContact CA-O 3.4Å; F464-V475 WeakPolarHBondContact CB-O 3.48Å; F464-V476 HydrophobicContact CD1-CG2 4.27Å; F464-V476 HydrophobicContact CE1-CG2 4.04Å
465	L	87.4	Confident	83.6	Confident	87 Å²	87	97.9 Å²	97.9	46%	0.455	51%	0.509	S	S	.	.			trans	-67	155.5	168.2	-59.3	178.3	0	0	0	109.3	Q467 V475 N477	L465-Q467 PolarHBondContact O-N 3.41Å; L465-V475 HydrophobicContact CB-CB 4.43Å; L465-V475 HydrophobicContact CD1-CG1 4Å; L465-V475 PolarHBondContact N-O 2.82Å; L465-N477 HydrophobicContact CD2-CB 3.95Å; L465-N477 HydrophobicContact CG-CB 4.32Å
466	Q	81	Confident	83.5	Confident	192 Å²	192	100.8 Å²	100.8	90%	0.897	53%	0.526	S	S	*	.			trans	-55.6	135.1	173.2	-69	-178	0.9	0	0	109	D468	Q466-D468 PolarHBondContact O-N 2.76Å
467	Q	69	Low	83.4	Confident	131 Å²	131	93.7 Å²	93.7	61%	0.612	50%	0.496	S	S	*	.			trans	-61.2	111	-178.6	-172.8	169.9	3.3	0	0	108.6	L465 Q469	L465-Q467 PolarHBondContact O-N 3.41Å; Q467-Q469 PolarHBondContact O-N 3.13Å
468	D	66.1	Low	83.4	Confident	84 Å²	84	99.8 Å²	99.8	45%	0.449	52%	0.522	S	S	.	.			trans	-63.9	130.2	164.2	-168.1	-16.4	0	0	0	106.6	Q466 K470 L471	Q466-D468 PolarHBondContact O-N 2.76Å; D468-K470 PolarHBondContact O-N 2.78Å; D468-K470 PolarHBondContact OD1-N 2.9Å; D468-L471 HydrophobicContact CB-CD1 4.44Å; D468-L471 PolarHBondContact O-N 3.06Å
469	Q	65.5	Low	83.3	Confident	198 Å²	198	102.1 Å²	102.1	93%	0.925	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-19.8	177.7	-67.6	178.2	6.3	0	0	111.9	Q467	Q467-Q469 PolarHBondContact O-N 3.13Å
470	K	68.2	Low	83.4	Confident	180 Å²	180	98 Å²	98	78%	0.783	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.9	179.6	-61.4	-178.8	179.8	-179	0	115	D468	D468-K470 PolarHBondContact O-N 2.78Å; D468-K470 PolarHBondContact OD1-N 2.9Å
471	L	68.9	Low	83.6	Confident	86 Å²	86	98.8 Å²	98.8	45%	0.45	50%	0.499	S	S	.	.			trans	-111.1	123.7	-177.5	-73.9	167.1	0	0	0	110.8	D468 N473 V475	D468-L471 HydrophobicContact CB-CD1 4.44Å; D468-L471 PolarHBondContact O-N 3.06Å; L471-N473 PolarHBondContact O-N 2.83Å; L471-V475 HydrophobicContact CD1-CG2 3.84Å
472	P	71.7	Confident	83.7	Confident	109 Å²	109	102.8 Å²	102.8	71%	0.708	51%	0.51	S	S	*	.	S	Bend	trans	-69.4	-21.8	-176.6	26.3	-33.5	0	0	0	113.2
473	N	81	Confident	83.8	Confident	124 Å²	124	99.8 Å²	99.8	66%	0.663	49%	0.487	S	S	*	.	S	Bend	trans	-115.8	152.8	-170.4	-66.4	-21.6	0	0	0	112.5	L471 V475	L471-N473 PolarHBondContact O-N 2.83Å; N473-V475 PolarHBondContact O-N 2.97Å
474	K	82.9	Confident	84	Confident	156 Å²	156	97.3 Å²	97.3	68%	0.678	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-63	127.5	173.2	-63.9	-177.8	179.8	178.7	0	110.4	F464	F464-K474 HydrophobicContact CB-CB 4.46Å; F464-K474 HydrophobicContact CD1-CB 3.62Å; F464-K474 HydrophobicContact CD1-CD 4.49Å; F464-K474 HydrophobicContact CD2-CD 4.33Å; F464-K474 HydrophobicContact CE1-CB 4.01Å; F464-K474 HydrophobicContact CE2-CD 4.41Å; F464-K474 HydrophobicContact CG-CB 4.04Å; F464-K474 HydrophobicContact CG-CD 4.37Å
475	V	86.6	Confident	84.2	Confident	56 Å²	56	97.1 Å²	97.1	34%	0.339	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-95.9	124.7	179.5	-177.6	0	0	0	0	109.8	F464 L465 L471 N473	F464-V475 CarbonylContact C-O 3.58Å; F464-V475 WeakPolarHBondContact CA-O 3.4Å; F464-V475 WeakPolarHBondContact CB-O 3.48Å; L465-V475 HydrophobicContact CB-CB 4.43Å; L465-V475 HydrophobicContact CD1-CG1 4Å; L465-V475 PolarHBondContact N-O 2.82Å; L471-V475 HydrophobicContact CD1-CG2 3.84Å; N473-V475 PolarHBondContact O-N 2.97Å
476	V	90.5	Very high	84.4	Confident	77 Å²	77	95.4 Å²	95.4	47%	0.467	46%	0.463	S	S	.	.	B	Isolated β-bridge	trans	-64.7	134.9	179	176.3	0	0	0	0	110.6	F464 F478	F464-V476 HydrophobicContact CD1-CG2 4.27Å; F464-V476 HydrophobicContact CE1-CG2 4.04Å; V476-F478 PolarHBondContact O-N 2.64Å
477	N	91.8	Very high	85	Confident	13 Å²	13	87.1 Å²	87.1	7%	0.07	43%	0.425	C	S	.	.			trans	-76.6	87.6	173.7	-177.7	-2.6	0	0	0	110.4	S462 D463 L465 T479 K480	S462-N477 WeakPolarHBondContact O-CB 3.08Å; S462-N477 PolarHBondContact O-ND2 3.3Å; D463-N477 PolarHBondContact O-N 3.37Å; L465-N477 HydrophobicContact CD2-CB 3.95Å; L465-N477 HydrophobicContact CG-CB 4.32Å; N477-T479 VanDerWaalsContact C-N 3.26Å; N477-T479 PolarHBondContact O-N 3.29Å; N477-T479 WeakPolarHBondContact OD1-CB 3.49Å; N477-T479 PolarHBondContact OD1-N 3.31Å; N477-K480 HydrophobicContact CB-CB 4.28Å; N477-K480 WeakPolarHBondContact O-CB 3.44Å; N477-K480 PolarHBondContact O-N 3.21Å; N477-K480 PolarHBondContact OD1-N 3.32Å
478	F	95.1	Very high	86.2	Confident	135 Å²	135	81.5 Å²	81.5	59%	0.592	40%	0.399	S	S	*	.	H	α-helix	trans	-67.8	-25.9	179.7	-160.8	-101.3	0	0	0	112.9	V476 K480 R481 W482	V476-F478 PolarHBondContact O-N 2.64Å; F478-K480 VanDerWaalsContact C-N 3.28Å; F478-K480 PolarHBondContact O-N 2.87Å; F478-R481 HydrophobicContact CD2-CB 4.23Å; F478-R481 HydrophobicContact CD2-CG 4.42Å; F478-R481 HydrophobicContact CE2-CB 4.46Å; F478-R481 WeakPolarHBondContact O-CA 3.44Å; F478-R481 WeakPolarHBondContact O-CB 3.46Å; F478-R481 PolarHBondContact O-N 2.87Å; F478-W482 HydrophobicContact CE1-CE3 4.37Å; F478-W482 PolarHBondContact O-N 3.46Å
479	T	92.1	Very high	87.4	Confident	85 Å²	85	80.5 Å²	80.5	52%	0.521	39%	0.393	S	S	.	.	H	α-helix	trans	-57.2	-43.1	172.8	-51.3	0	0	0	0	111.3	N477 R481 W482 Q483	N477-T479 VanDerWaalsContact C-N 3.26Å; N477-T479 PolarHBondContact O-N 3.29Å; N477-T479 WeakPolarHBondContact OD1-CB 3.49Å; N477-T479 PolarHBondContact OD1-N 3.31Å; T479-R481 VanDerWaalsContact C-N 3.33Å; T479-R481 PolarHBondContact O-N 2.84Å; T479-W482 PolarHBondContact O-N 3.04Å; T479-Q483 WeakPolarHBondContact O-CG 3.33Å; T479-Q483 PolarHBondContact O-N 2.84Å
480	K	94.4	Very high	88.3	Confident	3 Å²	3	75 Å²	75	1%	0.013	37%	0.37	C	S	.	.	H	α-helix	trans	-58.9	-44.3	172.8	179.5	-179.1	-173.6	173.7	0	111.6	V457 H458 N461 D463 N477 F478 Q483 Q484	V457-K480 HydrophobicContact CG1-CG 4.19Å; H458-K480 PolarHBondContact ND1-NZ 2.87Å; H458-K480 WeakPolarHBondContact O-CE 3.41Å; H458-K480 PolarHBondContact O-NZ 2.75Å; N461-K480 HydrophobicContact CB-CB 3.99Å; N461-K480 HydrophobicContact CB-CD 3.8Å; N461-K480 HydrophobicContact CB-CG 3.83Å; N461-K480 WeakPolarHBondContact O-CD 3.43Å; N461-K480 VanDerWaalsContact O-CE 3.27Å; N461-K480 WeakPolarHBondContact O-CE 3.29Å; N461-K480 PolarHBondContact O-NZ 3.44Å; D463-K480 WeakPolarHBondContact OD1-CE 3.19Å; D463-K480 IonicContact OD1-NZ 3.79Å; D463-K480 PolarHBondContact OD1-NZ 3.36Å; N477-K480 HydrophobicContact CB-CB 4.28Å; N477-K480 WeakPolarHBondContact O-CB 3.44Å; N477-K480 PolarHBondContact O-N 3.21Å; N477-K480 PolarHBondContact OD1-N 3.32Å; F478-K480 VanDerWaalsContact C-N 3.28Å; F478-K480 PolarHBondContact O-N 2.87Å; K480-Q483 PolarHBondContact O-N 2.89Å; K480-Q484 WeakPolarHBondContact O-CG 3.39Å; K480-Q484 PolarHBondContact O-N 3Å; K480-Q484 VanDerWaalsContact O-N 3.07Å
481	R	95.7	Very high	89.3	Confident	74 Å²	74	66.4 Å²	66.4	28%	0.279	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-41.5	-179.4	-53.5	-52.3	175.2	-142.6	-5.1	111.6	D463 F478 T479 Q484 F485	D463-R481 IonicContact OD1-CZ 3.66Å; D463-R481 IonicContact OD1-NH1 3.01Å; D463-R481 PolarHBondContact OD1-NH1 3.5Å; D463-R481 VanDerWaalsContact OD1-NH1 3.1Å; D463-R481 IonicContact OD1-NH2 3.94Å; D463-R481 PolarHBondContact OD1-NH2 2.75Å; F478-R481 HydrophobicContact CD2-CB 4.23Å; F478-R481 HydrophobicContact CD2-CG 4.42Å; F478-R481 HydrophobicContact CE2-CB 4.46Å; F478-R481 WeakPolarHBondContact O-CA 3.44Å; F478-R481 WeakPolarHBondContact O-CB 3.46Å; F478-R481 PolarHBondContact O-N 2.87Å; T479-R481 VanDerWaalsContact C-N 3.33Å; T479-R481 PolarHBondContact O-N 2.84Å; R481-Q484 PolarHBondContact O-N 3.35Å; R481-F485 WeakPolarHBondContact O-CB 3Å; R481-F485 PolarHBondContact O-N 3.28Å
482	W	94.5	Very high	90.4	Very high	135 Å²	135	66.6 Å²	66.6	51%	0.511	33%	0.328	S	S	.	.	H	α-helix	trans	-61.2	-44.4	175.5	-172.2	-102.4	0	0	0	112.1	F478 T479 Q484 F485 M486	F478-W482 HydrophobicContact CE1-CE3 4.37Å; F478-W482 PolarHBondContact O-N 3.46Å; T479-W482 PolarHBondContact O-N 3.04Å; W482-Q484 PolarHBondContact O-N 3.38Å; W482-F485 HydrophobicContact CE3-CD1 4.25Å; W482-F485 HydrophobicContact CZ3-CD1 4.14Å; W482-F485 HydrophobicContact CZ3-CE1 4.37Å; W482-F485 WeakPolarHBondContact O-CB 3.35Å; W482-F485 PolarHBondContact O-N 3.4Å; W482-M486 HydrophobicContact CH2-CE 4.12Å; W482-M486 HydrophobicContact CZ2-CE 3.73Å; W482-M486 HydrophobicContact CZ2-SD 4.26Å; W482-M486 WeakPolarHBondContact O-CG 3.18Å; W482-M486 PolarHBondContact O-N 3.28Å
483	Q	94.6	Very high	91.2	Very high	23 Å²	23	65.2 Å²	65.2	11%	0.107	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-44.9	175.2	-71	-179.7	-20.2	0	0	112.2	Y141 V457 N461 T479 K480 F485 M486 I487	Y141-Q483 HydrophobicContact CD1-CG 3.89Å; Y141-Q483 HydrophobicContact CE1-CB 4.34Å; Y141-Q483 HydrophobicContact CE1-CG 3.59Å; V457-Q483 HydrophobicContact CG1-CB 3.71Å; V457-Q483 HydrophobicContact CG2-CB 4.19Å; N461-Q483 PolarHBondContact ND2-OE1 3.45Å; T479-Q483 WeakPolarHBondContact O-CG 3.33Å; T479-Q483 PolarHBondContact O-N 2.84Å; K480-Q483 PolarHBondContact O-N 2.89Å; Q483-F485 VanDerWaalsContact C-N 3.32Å; Q483-F485 PolarHBondContact O-N 3.18Å; Q483-M486 PolarHBondContact O-N 2.82Å; Q483-I487 WeakPolarHBondContact O-CG1 3.45Å; Q483-I487 PolarHBondContact O-N 3.34Å
484	Q	95.7	Very high	91.7	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-61.7	-41.5	175.6	-67.4	177.5	-56.1	0	0	111.5	L327 L454 V457 K480 R481 W482 I487 L488	L327-Q484 HydrophobicContact CD1-CB 3.93Å; L327-Q484 HydrophobicContact CD1-CG 4.12Å; L454-Q484 HydrophobicContact CD2-CB 4.14Å; L454-Q484 HydrophobicContact CD2-CG 4.38Å; V457-Q484 HydrophobicContact CB-CG 4.33Å; V457-Q484 HydrophobicContact CG1-CG 3.63Å; K480-Q484 WeakPolarHBondContact O-CG 3.39Å; K480-Q484 PolarHBondContact O-N 3Å; K480-Q484 VanDerWaalsContact O-N 3.07Å; R481-Q484 PolarHBondContact O-N 3.35Å; W482-Q484 PolarHBondContact O-N 3.38Å; Q484-I487 PolarHBondContact O-N 3.05Å; Q484-L488 WeakPolarHBondContact O-CG 3.35Å; Q484-L488 PolarHBondContact O-N 3.02Å; Q484-L488 VanDerWaalsContact O-N 3.1Å
485	F	94.8	Very high	91.9	Very high	87 Å²	87	53.8 Å²	53.8	38%	0.382	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-45.8	177.2	174.2	-111.3	0	0	0	112.4	R481 W482 Q483 I487 L488 D489	R481-F485 WeakPolarHBondContact O-CB 3Å; R481-F485 PolarHBondContact O-N 3.28Å; W482-F485 HydrophobicContact CE3-CD1 4.25Å; W482-F485 HydrophobicContact CZ3-CD1 4.14Å; W482-F485 HydrophobicContact CZ3-CE1 4.37Å; W482-F485 WeakPolarHBondContact O-CB 3.35Å; W482-F485 PolarHBondContact O-N 3.4Å; Q483-F485 VanDerWaalsContact C-N 3.32Å; Q483-F485 PolarHBondContact O-N 3.18Å; F485-I487 VanDerWaalsContact C-N 3.26Å; F485-I487 PolarHBondContact O-N 3.08Å; F485-L488 CarbonylContact O-C 3.56Å; F485-L488 PolarHBondContact O-N 3.49Å; F485-D489 HydrophobicContact CZ-CB 4.42Å; F485-D489 WeakPolarHBondContact O-CB 3.18Å; F485-D489 PolarHBondContact O-N 3.47Å
486	M	93.1	Very high	91.7	Very high	52 Å²	52	57.7 Å²	57.7	26%	0.256	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-34.7	177.4	-69.6	-68.5	99.4	0	0	113.1	W482 Q483 N490	W482-M486 HydrophobicContact CH2-CE 4.12Å; W482-M486 HydrophobicContact CZ2-CE 3.73Å; W482-M486 HydrophobicContact CZ2-SD 4.26Å; W482-M486 WeakPolarHBondContact O-CG 3.18Å; W482-M486 PolarHBondContact O-N 3.28Å; Q483-M486 PolarHBondContact O-N 2.82Å; M486-N490 PolarHBondContact O-ND2 3.41Å; M486-N490 VanDerWaalsContact O-ND2 3.13Å
487	I	93.3	Very high	91.4	Very high	18 Å²	18	60.4 Å²	60.4	9%	0.092	27%	0.267	C	S	.	.	H	α-helix	trans	-68	-45.3	173.5	-65	162.5	0	0	0	110.4	I450 D453 L454 V457 Q483 Q484 F485	I450-I487 HydrophobicContact CG2-CG2 3.79Å; D453-I487 HydrophobicContact CB-CD1 3.8Å; D453-I487 HydrophobicContact CB-CG1 4.34Å; D453-I487 HydrophobicContact CB-CG2 4.25Å; L454-I487 HydrophobicContact CD2-CB 3.97Å; L454-I487 HydrophobicContact CD2-CD1 4.19Å; L454-I487 HydrophobicContact CD2-CG2 3.9Å; L454-I487 HydrophobicContact CG-CB 4.44Å; L454-I487 HydrophobicContact CG-CG2 3.83Å; V457-I487 HydrophobicContact CG2-CD1 3.72Å; Q483-I487 WeakPolarHBondContact O-CG1 3.45Å; Q483-I487 PolarHBondContact O-N 3.34Å; Q484-I487 PolarHBondContact O-N 3.05Å; F485-I487 VanDerWaalsContact C-N 3.26Å; F485-I487 PolarHBondContact O-N 3.08Å
488	L	94.3	Very high	91.4	Very high	13 Å²	13	62.8 Å²	62.8	7%	0.068	28%	0.277	C	S	.	.	H	α-helix	trans	-70.1	-31.7	-179	-69.6	170.4	0	0	0	113.2	L323 M326 L327 L454 Q484 F485 N490 V491 R492	L323-L488 HydrophobicContact CB-CD2 4.41Å; L323-L488 HydrophobicContact CD2-CB 4.46Å; L323-L488 HydrophobicContact CD2-CD2 4.2Å; M326-L488 HydrophobicContact CB-CD2 3.8Å; M326-L488 HydrophobicContact CE-CD2 4.4Å; M326-L488 HydrophobicContact SD-CD2 4.33Å; L327-L488 HydrophobicContact CB-CD1 4.19Å; L327-L488 HydrophobicContact CD1-CD1 4.49Å; L454-L488 HydrophobicContact CD1-CD2 3.79Å; L454-L488 HydrophobicContact CD1-CG 4.4Å; L454-L488 HydrophobicContact CD2-CD2 4.41Å; L454-L488 HydrophobicContact CD2-CG 4.11Å; Q484-L488 WeakPolarHBondContact O-CG 3.35Å; Q484-L488 PolarHBondContact O-N 3.02Å; Q484-L488 VanDerWaalsContact O-N 3.1Å; F485-L488 CarbonylContact O-C 3.56Å; F485-L488 PolarHBondContact O-N 3.49Å; L488-N490 VanDerWaalsContact C-N 3.29Å; L488-N490 PolarHBondContact O-N 2.45Å; L488-V491 WeakPolarHBondContact O-CA 3.35Å; L488-V491 WeakPolarHBondContact O-CB 3.35Å; L488-V491 PolarHBondContact O-N 2.67Å; L488-R492 PolarHBondContact O-N 3.32Å
489	D	90	Very high	91.2	Very high	63 Å²	63	58.9 Å²	58.9	34%	0.337	26%	0.261	S	S	.	.	H	α-helix	trans	-64.5	-36.1	180	-166.4	57.3	0	0	0	111.8	F485 V491 R492 R493	F485-D489 HydrophobicContact CZ-CB 4.42Å; F485-D489 WeakPolarHBondContact O-CB 3.18Å; F485-D489 PolarHBondContact O-N 3.47Å; D489-V491 PolarHBondContact O-N 3.44Å; D489-R492 VanDerWaalsContact O-CB 3.32Å; D489-R492 WeakPolarHBondContact O-CB 3.09Å; D489-R492 PolarHBondContact O-N 2.77Å; D489-R492 VanDerWaalsContact O-N 3.08Å; D489-R493 PolarHBondContact O-N 3.49Å; D489-R493 VanDerWaalsContact O-N 3.09Å
490	N	84.7	Confident	91.1	Very high	81 Å²	81	57.5 Å²	57.5	43%	0.433	25%	0.246	S	C	.	.	H	α-helix	trans	-62.6	-24.6	170.2	-76.2	-51.1	0	0	0	113.7	M486 L488 R493 F494	M486-N490 PolarHBondContact O-ND2 3.41Å; M486-N490 VanDerWaalsContact O-ND2 3.13Å; L488-N490 VanDerWaalsContact C-N 3.29Å; L488-N490 PolarHBondContact O-N 2.45Å; N490-R493 WeakPolarHBondContact O-CG 3.15Å; N490-R493 PolarHBondContact O-NE 3.29Å; N490-F494 WeakPolarHBondContact O-CD2 3.47Å; N490-F494 VanDerWaalsContact O-CE2 3.3Å; N490-F494 WeakPolarHBondContact O-CE2 3.11Å
491	V	90.7	Very high	90.9	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-83.3	-39.2	172.1	-171.6	0	0	0	0	110.4	F318 L323 M326 I450 L488 D489 R493 F494	F318-V491 HydrophobicContact CE2-CG1 3.97Å; F318-V491 HydrophobicContact CZ-CG1 3.87Å; L323-V491 HydrophobicContact CD2-CB 4.12Å; L323-V491 HydrophobicContact CD2-CG1 4.2Å; M326-V491 HydrophobicContact CE-CG1 4.33Å; M326-V491 HydrophobicContact CE-CG2 4Å; M326-V491 HydrophobicContact SD-CG1 3.99Å; I450-V491 HydrophobicContact CD1-CG2 3.86Å; I450-V491 HydrophobicContact CG1-CG2 4.41Å; I450-V491 HydrophobicContact CG2-CG2 3.7Å; L488-V491 WeakPolarHBondContact O-CA 3.35Å; L488-V491 WeakPolarHBondContact O-CB 3.35Å; L488-V491 PolarHBondContact O-N 2.67Å; D489-V491 PolarHBondContact O-N 3.44Å; V491-R493 VanDerWaalsContact C-N 3.3Å; V491-R493 PolarHBondContact O-N 2.8Å; V491-F494 PolarHBondContact O-N 3.01Å
492	R	90.5	Very high	90.6	Very high	89 Å²	89	59.9 Å²	59.9	34%	0.336	26%	0.259	S	S	.	.	H	α-helix	trans	-54.8	-45.2	179.3	-164.3	-172.6	177.9	-179.5	0.3	111.1	L323 L488 D489 F494 K495 F496	L323-R492 HydrophobicContact CD1-CB 4Å; L323-R492 HydrophobicContact CD1-CG 4.07Å; L488-R492 PolarHBondContact O-N 3.32Å; D489-R492 VanDerWaalsContact O-CB 3.32Å; D489-R492 WeakPolarHBondContact O-CB 3.09Å; D489-R492 PolarHBondContact O-N 2.77Å; D489-R492 VanDerWaalsContact O-N 3.08Å; R492-F494 PolarHBondContact O-N 3.41Å; R492-F494 VanDerWaalsContact O-N 3.15Å; R492-K495 PolarHBondContact O-N 2.92Å; R492-F496 HydrophobicContact CG-CE2 3.8Å; R492-F496 HydrophobicContact CG-CZ 4.14Å; R492-F496 VanDerWaalsContact O-CD2 3.25Å; R492-F496 WeakPolarHBondContact O-CD2 2.95Å; R492-F496 WeakPolarHBondContact O-CE2 3.17Å
493	R	88.1	Confident	90.4	Very high	80 Å²	80	54.9 Å²	54.9	30%	0.302	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-55.9	-31.7	176.2	66.6	177.8	-170.2	169.8	8.6	113.7	L436 A437 P441 D489 N490 V491 K495	L436-R493 PolarHBondContact O-NH2 2.82Å; A437-R493 PolarHBondContact O-NH1 2.96Å; A437-R493 PolarHBondContact O-NH2 2.92Å; A437-R493 VanDerWaalsContact O-NH2 3.12Å; P441-R493 VanDerWaalsContact CG-O 3.24Å; P441-R493 WeakPolarHBondContact CG-O 3.14Å; D489-R493 PolarHBondContact O-N 3.49Å; D489-R493 VanDerWaalsContact O-N 3.09Å; N490-R493 WeakPolarHBondContact O-CG 3.15Å; N490-R493 PolarHBondContact O-NE 3.29Å; V491-R493 VanDerWaalsContact C-N 3.3Å; V491-R493 PolarHBondContact O-N 2.8Å; R493-K495 VanDerWaalsContact C-N 3.29Å; R493-K495 PolarHBondContact O-N 2.74Å
494	F	91.8	Very high	90.1	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-82.7	-2.7	-179.6	-64.2	-48	0	0	0	114.1	F318 L436 T439 P441 C443 P445 N490 V491 R492 W497	F318-F494 HydrophobicContact CE1-CB 4.35Å; F318-F494 HydrophobicContact CZ-CB 4.34Å; L436-F494 HydrophobicContact CD1-CD2 4.49Å; L436-F494 HydrophobicContact CD1-CE2 3.51Å; L436-F494 HydrophobicContact CD1-CZ 3.73Å; L436-F494 HydrophobicContact CG-CE2 4.1Å; L436-F494 HydrophobicContact CG-CZ 4.37Å; T439-F494 HydrophobicContact CG2-CE1 4.47Å; T439-F494 VanDerWaalsContact O-CE1 3.32Å; T439-F494 WeakPolarHBondContact O-CE1 3.47Å; P441-F494 HydrophobicContact CG-CD1 4.21Å; C443-F494 HydrophobicContact CB-CD1 3.54Å; C443-F494 HydrophobicContact CB-CE1 3.63Å; C443-F494 HydrophobicContact CB-CG 4.23Å; C443-F494 HydrophobicContact CB-CZ 4.39Å; P445-F494 HydrophobicContact CB-CD2 4.48Å; P445-F494 HydrophobicContact CG-CD2 4.07Å; N490-F494 WeakPolarHBondContact O-CD2 3.47Å; N490-F494 VanDerWaalsContact O-CE2 3.3Å; N490-F494 WeakPolarHBondContact O-CE2 3.11Å; V491-F494 PolarHBondContact O-N 3.01Å; R492-F494 PolarHBondContact O-N 3.41Å; R492-F494 VanDerWaalsContact O-N 3.15Å; F494-W497 VanDerWaalsContact O-CD1 3.23Å; F494-W497 PolarHBondContact O-NE1 3.27Å
495	K	88.5	Confident	89.6	Confident	40 Å²	40	61.2 Å²	61.2	17%	0.174	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-95.8	-6.5	174.9	-66.6	-170.7	174.6	178.9	0	114.1	F318 H319 I321 R492 R493 W497	F318-K495 HydrophobicContact CD1-CG 4.48Å; F318-K495 HydrophobicContact CE1-CG 3.66Å; F318-K495 HydrophobicContact CZ-CG 3.84Å; H319-K495 PolarHBondContact NE2-O 2.83Å; I321-K495 PolarHBondContact O-NZ 3.06Å; R492-K495 PolarHBondContact O-N 2.92Å; R493-K495 VanDerWaalsContact C-N 3.29Å; R493-K495 PolarHBondContact O-N 2.74Å; K495-W497 PolarHBondContact O-N 2.84Å
496	F	81.7	Confident	89.2	Confident	138 Å²	138	59.1 Å²	59.1	61%	0.605	26%	0.26	S	S	*	.			trans	-95.6	75.6	-179.4	-63.6	-67.9	0	0	0	111.1	R492	R492-F496 HydrophobicContact CG-CE2 3.8Å; R492-F496 HydrophobicContact CG-CZ 4.14Å; R492-F496 VanDerWaalsContact O-CD2 3.25Å; R492-F496 WeakPolarHBondContact O-CD2 2.95Å; R492-F496 WeakPolarHBondContact O-CE2 3.17Å
497	W	83.8	Confident	88.9	Confident	133 Å²	133	59.7 Å²	59.7	50%	0.504	26%	0.26	S	S	.	.			trans	-164.9	0	168.1	55.8	-79.1	0	0	0	113.2	W315 P441 P442 L444 F494 K495	W315-W497 HydrophobicContact CB-CH2 4.35Å; W315-W497 AromaticContact CD1-CH2 3.27Å; W315-W497 AromaticContact CD1-CZ2 3.55Å; W315-W497 AromaticContact CD1-CZ3 3.52Å; W315-W497 HydrophobicContact CG-CH2 4.08Å; W315-W497 HydrophobicContact CG-CZ3 4.41Å; W315-W497 AromaticContact NE1-CZ3 3.9Å; P441-W497 HydrophobicContact CB-CG 4.4Å; P442-W497 HydrophobicContact CB-CD2 3.42Å; P442-W497 VanDerWaalsContact CB-CD2 3.42Å; P442-W497 HydrophobicContact CB-CE3 3.49Å; P442-W497 VanDerWaalsContact CB-CE3 3.49Å; P442-W497 HydrophobicContact CB-CG 4.01Å; P442-W497 HydrophobicContact CB-CH2 3.71Å; P442-W497 HydrophobicContact CB-CZ2 3.7Å; P442-W497 HydrophobicContact CB-CZ3 3.64Å; L444-W497 HydrophobicContact CD2-CZ2 4.11Å; L444-W497 HydrophobicContact CG-CZ2 4.21Å; F494-W497 VanDerWaalsContact O-CD1 3.23Å; F494-W497 PolarHBondContact O-NE1 3.27Å; K495-W497 PolarHBondContact O-N 2.84Å

Retrieved 497 of 497 residues in 230.3 ms (Link to these results)

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