A0A077Z4S5_TRITR Loading...

Follicle stimulating hormone receptor

AlphaFold DB , UniProt , Accession A0A077Z4S5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 656 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	45.3	Very low	41.8	Very low	233 Å²	233	148.4 Å²	148.4	100%	1.148	82%	0.818	S	S	*	*				0	107.7	0	-67.6	-129.5	88.3	0	0	109.8
2	S	37.3	Very low	41.6	Very low	93 Å²	93	146.8 Å²	146.8	65%	0.65	82%	0.815	S	S	*	*			cis	-179.7	118.5	-25	-87.1	0	0	0	0	102.9
3	L	37.9	Very low	40.9	Very low	149 Å²	149	142.4 Å²	142.4	78%	0.78	80%	0.801	S	S	*	*			trans	30.2	111.9	141.7	-71.3	148.9	0	0	0	117.2
4	L	44.2	Very low	40.4	Very low	169 Å²	169	140.1 Å²	140.1	89%	0.885	80%	0.799	S	S	*	*			trans	-168.3	78.5	140.9	-97.3	154	0	0	0	107.1
5	L	44.8	Very low	40	Very low	134 Å²	134	139.1 Å²	139.1	70%	0.702	80%	0.797	S	S	*	*				70.3	104.2	97.5	-98.9	116.3	0	0	0	114.4
6	V	41.9	Very low	39.6	Very low	133 Å²	133	137.4 Å²	137.4	81%	0.806	80%	0.796	S	S	*	*				51.5	83.9	129.3	-169	0	0	0	0	115.5
7	G	44.3	Very low	39.7	Very low	69 Å²	69	139.6 Å²	139.6	71%	0.711	79%	0.794	S	S	*	*			trans	-147.8	108.7	167.2	0	0	0	0	0	110.7
8	L	44.6	Very low	39.9	Very low	156 Å²	156	141.7 Å²	141.7	82%	0.817	80%	0.796	S	S	*	*			trans	83.1	60.4	164.1	-65	138.7	0	0	0	117.7	H10	L8-H10 PolarHBondContact O-N 3.47Å
9	L	39.5	Very low	40.7	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	80%	0.798	S	S	*	*				-46.8	87	128.8	-82.7	147.2	0	0	0	110.4
10	H	40.9	Very low	41.8	Very low	154 Å²	154	139 Å²	139	71%	0.713	77%	0.768	S	S	*	*			trans	-157.9	73.2	154.2	-88.8	-57.9	0	0	0	108.5	L8 V12	L8-H10 PolarHBondContact O-N 3.47Å; H10-V12 PolarHBondContact O-N 3.05Å
11	L	38.8	Very low	43.1	Very low	180 Å²	180	137.6 Å²	137.6	94%	0.942	77%	0.765	S	S	*	*			trans	-56.7	98.2	145	-87	151.6	0	0	0	105.8	S13	L11-S13 PolarHBondContact O-N 3.23Å
12	V	39.8	Very low	44.8	Very low	129 Å²	129	130.6 Å²	130.6	78%	0.782	73%	0.729	S	S	*	*			trans	-56.5	112.3	174.9	171.3	0	0	0	0	107	H10 S14	H10-V12 PolarHBondContact O-N 3.05Å; V12-S14 PolarHBondContact O-N 3.23Å; V12-S14 VanDerWaalsContact O-N 3.15Å
13	S	32.7	Very low	47	Very low	90 Å²	90	127 Å²	127	63%	0.629	70%	0.703	S	S	*	*			trans	-49.9	112.1	174.5	44.8	0	0	0	0	110.2	L11 T15	L11-S13 PolarHBondContact O-N 3.23Å; S13-T15 VanDerWaalsContact C-N 3.33Å; S13-T15 PolarHBondContact O-N 3.08Å
14	S	33.5	Very low	49.4	Very low	111 Å²	111	126 Å²	126	78%	0.776	70%	0.698	S	S	*	*			trans	-61.2	105.6	150.7	63.3	0	0	0	0	105.9	V12 S16	V12-S14 PolarHBondContact O-N 3.23Å; V12-S14 VanDerWaalsContact O-N 3.15Å; S14-S16 VanDerWaalsContact C-N 3.33Å; S14-S16 PolarHBondContact O-N 3.19Å
15	T	34.7	Very low	51.5	Low	125 Å²	125	120 Å²	120	77%	0.767	67%	0.67	S	S	*	*			trans	-59.9	95.5	173.6	42.4	0	0	0	0	108.6	S13 K17	S13-T15 VanDerWaalsContact C-N 3.33Å; S13-T15 PolarHBondContact O-N 3.08Å; T15-K17 VanDerWaalsContact C-N 3.29Å; T15-K17 PolarHBondContact O-N 2.79Å
16	S	33.9	Very low	53.7	Low	111 Å²	111	116.6 Å²	116.6	78%	0.776	65%	0.653	S	S	*	*			trans	-65.3	95.5	165	62.9	0	0	0	0	106.9	S14 E18	S14-S16 VanDerWaalsContact C-N 3.33Å; S14-S16 PolarHBondContact O-N 3.19Å; S16-E18 PolarHBondContact O-N 3.01Å
17	K	41.5	Very low	55.7	Low	175 Å²	175	116.5 Å²	116.5	76%	0.761	66%	0.658	S	S	*	*			trans	-52.1	112.1	158.8	-81.4	-178.9	175.8	177.4	0	106	T15 K19	T15-K17 VanDerWaalsContact C-N 3.29Å; T15-K17 PolarHBondContact O-N 2.79Å; K17-K19 PolarHBondContact O-N 2.94Å
18	E	43	Very low	57.8	Low	178 Å²	178	115.7 Å²	115.7	83%	0.832	65%	0.645	S	S	*	*			trans	-48.9	100.8	173.2	-159.6	170	-160.9	0	0	107.7	S16	S16-E18 PolarHBondContact O-N 3.01Å
19	K	55.1	Low	59.7	Low	192 Å²	192	109.5 Å²	109.5	84%	0.835	62%	0.616	S	S	*	*			trans	-80.1	119.2	179	-83.7	-176.4	176.4	-179.2	0	106.8	K17	K17-K19 PolarHBondContact O-N 2.94Å
20	D	62.2	Low	62	Low	36 Å²	36	108 Å²	108	19%	0.193	60%	0.599	C	S	.	*			trans	-57.1	120.4	166.1	-168.5	-44.6	0	0	0	108.2	F22 C23	D20-F22 PolarHBondContact O-N 3.1Å; D20-F22 VanDerWaalsContact O-N 3.1Å; D20-F22 PolarHBondContact OD1-N 3.25Å; D20-F22 VanDerWaalsContact OD1-N 3.16Å; D20-C23 HydrophobicContact CB-CB 4.21Å; D20-C23 PolarHBondContact O-N 2.66Å
21	P	69.5	Low	64.3	Low	110 Å²	110	105 Å²	105	71%	0.714	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-15.6	-171.9	24	-32	0	0	0	113.3
22	F	80.3	Confident	66.8	Low	87 Å²	87	96.5 Å²	96.5	38%	0.382	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-10.2	-174.5	-52.7	-62	0	0	0	113.9	D20 C34 I35 Q38 V39	D20-F22 PolarHBondContact O-N 3.1Å; D20-F22 VanDerWaalsContact O-N 3.1Å; D20-F22 PolarHBondContact OD1-N 3.25Å; D20-F22 VanDerWaalsContact OD1-N 3.16Å; F22-C34 VanDerWaalsContact O-CA 3.3Å; F22-C34 WeakPolarHBondContact O-CA 3.43Å; F22-I35 PolarHBondContact O-N 2.84Å; F22-Q38 HydrophobicContact CE1-CB 4.25Å; F22-Q38 HydrophobicContact CZ-CB 4.44Å; F22-V39 HydrophobicContact CB-CG2 3.96Å
23	C	84.6	Confident	69.1	Low	16 Å²	16	97.8 Å²	97.8	11%	0.108	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.7	-175.2	-62.1	0	0	0	0	111.9	D20 R33 C34 P43 L46	D20-C23 HydrophobicContact CB-CB 4.21Å; D20-C23 PolarHBondContact O-N 2.66Å; C23-R33 WeakPolarHBondContact CA-O 3.46Å; C23-C34 HydrophobicContact CB-CB 4.09Å; C23-C34 WeakPolarHBondContact CB-SG 3.47Å; C23-C34 WeakPolarHBondContact SG-CB 3.4Å; C23-C34 CovalentContact SG-SG 2.04Å; C23-C34 PolarHBondContact SG-SG 2.88Å; C23-P43 WeakPolarHBondContact SG-CG 3.45Å; C23-L46 HydrophobicContact CB-CD2 4.01Å
24	N	88.2	Confident	71.7	Confident	128 Å²	128	93.5 Å²	93.5	68%	0.684	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.1	172.1	-169	13.4	0	0	0	110	C32 R33	N24-C32 WeakPolarHBondContact O-CA 3.07Å; N24-R33 PolarHBondContact N-O 2.96Å; N24-R33 PolarHBondContact O-N 3.42Å
25	C	88.6	Confident	73.7	Confident	44 Å²	44	92.9 Å²	92.9	30%	0.297	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	151.2	-178	-57.7	0	0	0	0	111.8	Q31 C32	C25-Q31 CarbonylContact C-O 3.56Å; C25-Q31 VanDerWaalsContact CA-O 3.27Å; C25-Q31 WeakPolarHBondContact CA-O 3.46Å; C25-C32 HydrophobicContact CB-CB 4.12Å; C25-C32 WeakPolarHBondContact CB-SG 3.17Å; C25-C32 WeakPolarHBondContact SG-CB 3.28Å; C25-C32 CovalentContact SG-SG 2.03Å; C25-C32 PolarHBondContact SG-SG 3.28Å
26	D	89.7	Confident	75.4	Confident	62 Å²	62	87.9 Å²	87.9	33%	0.332	46%	0.462	S	S	.	.			trans	-62.9	166.5	171.5	72.6	-22.8	0	0	0	112.3	A28 A29 R30 Q31	D26-A28 PolarHBondContact O-N 2.91Å; D26-A29 PolarHBondContact O-N 3.16Å; D26-A29 WeakPolarHBondContact OD1-CA 3.44Å; D26-A29 PolarHBondContact OD1-N 2.87Å; D26-R30 PolarHBondContact OD1-N 3.26Å; D26-Q31 HydrophobicContact CB-CB 4.49Å; D26-Q31 PolarHBondContact N-O 3.24Å; D26-Q31 PolarHBondContact OD1-N 2.96Å
27	S	85.5	Confident	76.9	Confident	132 Å²	132	93.7 Å²	93.7	92%	0.923	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.5	-177.3	-52.7	0	0	0	0	113.5
28	A	87	Confident	78.1	Confident	52 Å²	52	92 Å²	92	43%	0.43	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.7	176.8	0	0	0	0	0	113.9	D26 R30	D26-A28 PolarHBondContact O-N 2.91Å; A28-R30 HydrophobicContact CB-CB 4.43Å; A28-R30 HydrophobicContact CB-CG 3.93Å; A28-R30 PolarHBondContact O-N 3.23Å
29	A	85.2	Confident	79.6	Confident	25 Å²	25	83.9 Å²	83.9	21%	0.207	43%	0.425	C	S	.	.	S	Bend	trans	51.5	31.6	-171.7	0	0	0	0	0	114.2	D26	D26-A29 PolarHBondContact O-N 3.16Å; D26-A29 WeakPolarHBondContact OD1-CA 3.44Å; D26-A29 PolarHBondContact OD1-N 2.87Å
30	R	88.2	Confident	80.8	Confident	132 Å²	132	79.4 Å²	79.4	50%	0.498	41%	0.41	S	S	.	.	S	Bend	trans	-94.5	-23.5	177.1	-70	-175.9	-178.1	176.2	0.4	112.6	D26 A28 T51 R52	D26-R30 PolarHBondContact OD1-N 3.26Å; A28-R30 HydrophobicContact CB-CB 4.43Å; A28-R30 HydrophobicContact CB-CG 3.93Å; A28-R30 PolarHBondContact O-N 3.23Å; R30-T51 PolarHBondContact O-N 2.87Å; R30-T51 PolarHBondContact O-OG1 2.98Å; R30-R52 PolarHBondContact O-N 3.32Å
31	Q	89	Confident	81.8	Confident	89 Å²	89	82.8 Å²	82.8	42%	0.416	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	117.8	177.1	-53.4	-168.7	1.6	0	0	108.8	C25 D26 R52	C25-Q31 CarbonylContact C-O 3.56Å; C25-Q31 VanDerWaalsContact CA-O 3.27Å; C25-Q31 WeakPolarHBondContact CA-O 3.46Å; D26-Q31 HydrophobicContact CB-CB 4.49Å; D26-Q31 PolarHBondContact N-O 3.24Å; D26-Q31 PolarHBondContact OD1-N 2.96Å; Q31-R52 WeakPolarHBondContact CA-O 3.36Å; Q31-R52 HydrophobicContact CB-CB 4.33Å; Q31-R52 HydrophobicContact CG-CB 4.06Å
32	C	90.3	Very high	82.5	Confident	3 Å²	3	77.7 Å²	77.7	2%	0.02	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.6	179	-64.4	0	0	0	0	110.7	N24 C25 L46 L50 R52 I53 T54	N24-C32 WeakPolarHBondContact O-CA 3.07Å; C25-C32 HydrophobicContact CB-CB 4.12Å; C25-C32 WeakPolarHBondContact CB-SG 3.17Å; C25-C32 WeakPolarHBondContact SG-CB 3.28Å; C25-C32 CovalentContact SG-SG 2.03Å; C25-C32 PolarHBondContact SG-SG 3.28Å; C32-L46 HydrophobicContact CB-CD1 4.19Å; C32-L46 HydrophobicContact CB-CD2 4.47Å; C32-L50 HydrophobicContact CB-CD1 3.74Å; C32-L50 WeakPolarHBondContact SG-CD1 3.37Å; C32-R52 PolarHBondContact N-O 2.75Å; C32-I53 WeakPolarHBondContact O-CA 3.29Å; C32-T54 PolarHBondContact O-N 2.83Å
33	R	89.4	Confident	82.6	Confident	155 Å²	155	73.9 Å²	73.9	59%	0.585	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	115.3	176.3	175.2	-179.2	-73.7	-165.9	1.9	108.7	C23 N24 I35 T54	C23-R33 WeakPolarHBondContact CA-O 3.46Å; N24-R33 PolarHBondContact N-O 2.96Å; N24-R33 PolarHBondContact O-N 3.42Å; R33-I35 HydrophobicContact CG-CD1 3.63Å; R33-I35 HydrophobicContact CG-CG1 3.74Å; R33-T54 CarbonylContact C-O 3.59Å; R33-T54 WeakPolarHBondContact CA-O 3.24Å; R33-T54 HydrophobicContact CG-CG2 4.46Å
34	C	86.9	Confident	82.4	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	112.9	176	-48.1	0	0	0	0	107.8	F22 C23 V39 T54 I55	F22-C34 VanDerWaalsContact O-CA 3.3Å; F22-C34 WeakPolarHBondContact O-CA 3.43Å; C23-C34 HydrophobicContact CB-CB 4.09Å; C23-C34 WeakPolarHBondContact CB-SG 3.47Å; C23-C34 WeakPolarHBondContact SG-CB 3.4Å; C23-C34 CovalentContact SG-SG 2.04Å; C23-C34 PolarHBondContact SG-SG 2.88Å; C34-V39 HydrophobicContact CB-CG2 4.39Å; C34-T54 PolarHBondContact N-O 3.22Å; C34-I55 HydrophobicContact CB-CG1 4.17Å; C34-I55 WeakPolarHBondContact O-CA 3.45Å
35	I	76	Confident	82.1	Confident	98 Å²	98	81.8 Å²	81.8	50%	0.503	40%	0.399	S	S	.	.			trans	-128.6	126.3	-179.8	-64	175.3	0	0	0	107.3	F22 R33	F22-I35 PolarHBondContact O-N 2.84Å; R33-I35 HydrophobicContact CG-CD1 3.63Å; R33-I35 HydrophobicContact CG-CG1 3.74Å
36	G	69.6	Low	81.9	Confident	21 Å²	21	80.3 Å²	80.3	22%	0.216	39%	0.388	C	S	.	.	S	Bend	trans	155.5	146.4	176.8	0	0	0	0	0	112.1	Q38 V39 S58	G36-Q38 PolarHBondContact O-N 3.49Å; G36-V39 PolarHBondContact O-N 3.44Å; G36-S58 PolarHBondContact O-OG 3.28Å
37	W	64.5	Low	81.8	Confident	232 Å²	232	79.3 Å²	79.3	88%	0.879	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.7	-176.2	-59.6	5.6	0	0	0	113.3
38	Q	66.5	Low	81.7	Confident	141 Å²	141	76.6 Å²	76.6	66%	0.659	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-4.8	179.7	-68.6	-178.1	-40	0	0	113.9	F22 G36 D40	F22-Q38 HydrophobicContact CE1-CB 4.25Å; F22-Q38 HydrophobicContact CZ-CB 4.44Å; G36-Q38 PolarHBondContact O-N 3.49Å; Q38-D40 PolarHBondContact O-N 3.36Å; Q38-D40 VanDerWaalsContact O-N 3.14Å
39	V	75.4	Confident	81.6	Confident	6 Å²	6	75.5 Å²	75.5	4%	0.036	36%	0.356	C	S	.	.			trans	-82.6	92.6	174.9	-172.6	0	0	0	0	108.6	F22 C34 G36 H41 I55 A59	F22-V39 HydrophobicContact CB-CG2 3.96Å; C34-V39 HydrophobicContact CB-CG2 4.39Å; G36-V39 PolarHBondContact O-N 3.44Å; V39-H41 WeakPolarHBondContact CG1-O 3.24Å; V39-I55 HydrophobicContact CB-CG2 4.3Å; V39-I55 HydrophobicContact CG1-CG2 3.73Å; V39-A59 PolarHBondContact O-N 2.85Å
40	D	81	Confident	81.6	Confident	98 Å²	98	74.3 Å²	74.3	52%	0.524	35%	0.346	S	S	.	.			trans	-104.9	-5.5	177.9	65.7	-14.8	0	0	0	113.2	Q38	Q38-D40 PolarHBondContact O-N 3.36Å; Q38-D40 VanDerWaalsContact O-N 3.14Å
41	H	83.1	Confident	81.5	Confident	107 Å²	107	69.3 Å²	69.3	50%	0.495	33%	0.33	S	S	.	.	S	Bend	trans	-140	160.7	175.7	60.9	-79.5	0	0	0	111.3	V39 P43	V39-H41 WeakPolarHBondContact CG1-O 3.24Å; H41-P43 WeakPolarHBondContact O-CD 3.46Å
42	I	83.5	Confident	81.3	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.015	33%	0.328	C	S	.	.			trans	-67.1	124.3	173.5	-58.4	-56.1	0	0	0	109	R44 I55 L60 I63 D67 F68 Y71	I42-R44 PolarHBondContact O-N 2.86Å; I42-I55 HydrophobicContact CD1-CD1 3.66Å; I42-L60 HydrophobicContact CD1-CD1 4.2Å; I42-L60 HydrophobicContact CD1-CD2 4.35Å; I42-I63 HydrophobicContact CD1-CD1 4Å; I42-I63 HydrophobicContact CD1-CG1 4.18Å; I42-I63 HydrophobicContact CG1-CG1 4.3Å; I42-I63 HydrophobicContact CG1-CG2 4.14Å; I42-D67 HydrophobicContact CB-CB 4.01Å; I42-D67 HydrophobicContact CG1-CB 3.87Å; I42-F68 HydrophobicContact CD1-CE1 3.81Å; I42-F68 HydrophobicContact CD1-CE2 4.4Å; I42-F68 HydrophobicContact CD1-CZ 3.49Å; I42-F68 VanDerWaalsContact CD1-CZ 3.49Å; I42-F68 HydrophobicContact CG1-CE1 4.03Å; I42-F68 HydrophobicContact CG1-CE2 4.45Å; I42-F68 HydrophobicContact CG1-CZ 3.86Å; I42-F68 HydrophobicContact CG2-CD1 4.18Å; I42-F68 HydrophobicContact CG2-CE1 3.82Å; I42-Y71 HydrophobicContact CG2-CE2 4.1Å
43	P	83.4	Confident	81.2	Confident	7 Å²	7	69.6 Å²	69.6	5%	0.045	33%	0.327	C	S	.	.			trans	-55.8	133.1	179.3	-24.8	32.4	0	0	0	110.5	C23 H41 L46 Y71	C23-P43 WeakPolarHBondContact SG-CG 3.45Å; H41-P43 WeakPolarHBondContact O-CD 3.46Å; P43-L46 HydrophobicContact CB-CD1 3.96Å; P43-L46 HydrophobicContact CB-CG 3.97Å; P43-L46 HydrophobicContact CG-CD1 4.28Å; P43-Y71 PolarHBondContact O-OH 3.25Å
44	R	80	Confident	81.1	Confident	168 Å²	168	63.3 Å²	63.3	63%	0.634	31%	0.306	S	S	*	.	S	Bend	trans	-96	-8.4	-178.1	-65	-176.7	-177.2	-178.7	1.2	113.5	I42 K70	I42-R44 PolarHBondContact O-N 2.86Å; R44-K70 WeakPolarHBondContact O-CD 3.45Å; R44-K70 WeakPolarHBondContact O-CE 3.5Å; R44-K70 PolarHBondContact O-NZ 2.8Å
45	H	80.9	Confident	81.2	Confident	143 Å²	143	63.3 Å²	63.3	66%	0.662	31%	0.306	S	S	*	.	S	Bend	trans	-100.5	1.4	-171.4	-60.3	-78.2	0	0	0	114.2
46	L	85.1	Confident	81.6	Confident	12 Å²	12	60.2 Å²	60.2	6%	0.063	29%	0.29	C	S	.	.	S	Bend	trans	-72.4	162.2	-179.3	-52.8	175.8	0	0	0	112.1	C23 C32 P43 L50 I53 K70 Y71	C23-L46 HydrophobicContact CB-CD2 4.01Å; C32-L46 HydrophobicContact CB-CD1 4.19Å; C32-L46 HydrophobicContact CB-CD2 4.47Å; P43-L46 HydrophobicContact CB-CD1 3.96Å; P43-L46 HydrophobicContact CB-CG 3.97Å; P43-L46 HydrophobicContact CG-CD1 4.28Å; L46-L50 HydrophobicContact CB-CD2 4.32Å; L46-L50 HydrophobicContact CD1-CD2 3.92Å; L46-I53 HydrophobicContact CD1-CD1 3.92Å; L46-K70 WeakPolarHBondContact O-CE 3.35Å; L46-Y71 HydrophobicContact CB-CE1 3.76Å; L46-Y71 WeakPolarHBondContact CB-OH 3.41Å
47	S	86.6	Confident	82.5	Confident	41 Å²	41	64.4 Å²	64.4	29%	0.287	30%	0.304	S	S	.	.			trans	-63.1	139.7	-179	-177.6	0	0	0	0	112	S49 L50 Y71	S47-S49 PolarHBondContact O-N 2.84Å; S47-S49 PolarHBondContact OG-N 3.41Å; S47-S49 PolarHBondContact OG-OG 3.38Å; S47-L50 VanDerWaalsContact O-CB 3.23Å; S47-L50 WeakPolarHBondContact O-CB 3.27Å; S47-L50 PolarHBondContact O-N 3.33Å; S47-L50 VanDerWaalsContact O-N 3.14Å; S47-Y71 WeakPolarHBondContact O-CD1 3.41Å
48	S	84.6	Confident	83.6	Confident	75 Å²	75	54 Å²	54	52%	0.524	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.2	172.5	55.3	0	0	0	0	113.5	L50	S48-L50 VanDerWaalsContact C-N 3.3Å
49	S	84.9	Confident	84.5	Confident	30 Å²	30	49.4 Å²	49.4	21%	0.21	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	6.1	173.7	67.5	0	0	0	0	114.1	S47 T51	S47-S49 PolarHBondContact O-N 2.84Å; S47-S49 PolarHBondContact OG-N 3.41Å; S47-S49 PolarHBondContact OG-OG 3.38Å; S49-T51 PolarHBondContact O-N 3.29Å
50	L	85.5	Confident	85	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.251	C	S	.	.			trans	-58	124.2	178.9	-169.4	67.7	0	0	0	110.8	C32 L46 S47 S48 R52 I53 Y71 R73 L74	C32-L50 HydrophobicContact CB-CD1 3.74Å; C32-L50 WeakPolarHBondContact SG-CD1 3.37Å; L46-L50 HydrophobicContact CB-CD2 4.32Å; L46-L50 HydrophobicContact CD1-CD2 3.92Å; S47-L50 VanDerWaalsContact O-CB 3.23Å; S47-L50 WeakPolarHBondContact O-CB 3.27Å; S47-L50 PolarHBondContact O-N 3.33Å; S47-L50 VanDerWaalsContact O-N 3.14Å; S48-L50 VanDerWaalsContact C-N 3.3Å; L50-R52 VanDerWaalsContact CD1-O 3.28Å; L50-R52 WeakPolarHBondContact CD1-O 3.46Å; L50-I53 HydrophobicContact CD2-CB 3.99Å; L50-I53 HydrophobicContact CD2-CD1 4.11Å; L50-I53 HydrophobicContact CD2-CG1 4.21Å; L50-Y71 HydrophobicContact CB-CD1 4.08Å; L50-Y71 HydrophobicContact CD2-CD1 4.09Å; L50-Y71 HydrophobicContact CD2-CE1 4.29Å; L50-Y71 HydrophobicContact CD2-CG 4.28Å; L50-R73 CarbonylContact O-C 3.22Å; L50-L74 HydrophobicContact CD2-CD1 4.14Å; L50-L74 HydrophobicContact CG-CD1 4.02Å; L50-L74 WeakPolarHBondContact O-CA 3.45Å; L50-L74 PolarHBondContact O-N 3.41Å
51	T	84.9	Confident	85.2	Confident	27 Å²	27	48.3 Å²	48.3	17%	0.166	25%	0.25	C	C	.	.			trans	-106.8	-28.8	178.7	59.1	0	0	0	0	112.6	R30 S49 R73 V75 D76	R30-T51 PolarHBondContact O-N 2.87Å; R30-T51 PolarHBondContact O-OG1 2.98Å; S49-T51 PolarHBondContact O-N 3.29Å; T51-R73 WeakPolarHBondContact CA-O 3.47Å; T51-V75 PolarHBondContact O-N 3.41Å; T51-D76 PolarHBondContact O-N 2.74Å
52	R	85.1	Confident	85.1	Confident	98 Å²	98	48.5 Å²	48.5	37%	0.37	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.2	179.2	178.5	177.3	-74.8	161.4	-6.5	110.9	R30 Q31 C32 L50 D76	R30-R52 PolarHBondContact O-N 3.32Å; Q31-R52 WeakPolarHBondContact CA-O 3.36Å; Q31-R52 HydrophobicContact CB-CB 4.33Å; Q31-R52 HydrophobicContact CG-CB 4.06Å; C32-R52 PolarHBondContact N-O 2.75Å; L50-R52 VanDerWaalsContact CD1-O 3.28Å; L50-R52 WeakPolarHBondContact CD1-O 3.46Å; R52-D76 VanDerWaalsContact CA-O 3.26Å; R52-D76 WeakPolarHBondContact CA-O 3.37Å; R52-D76 HydrophobicContact CB-CB 4.08Å; R52-D76 HydrophobicContact CG-CB 4Å; R52-D76 IonicContact CZ-OD2 3.11Å; R52-D76 IonicContact NE-OD2 2.71Å; R52-D76 PolarHBondContact NE-OD2 3.24Å; R52-D76 IonicContact NH2-OD2 2.7Å; R52-D76 PolarHBondContact NH2-OD2 2.87Å
53	I	87.3	Confident	84.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	136.5	169.9	-161.6	171.3	0	0	0	110.1	C32 L46 L50 I55 L74 D76 M77 N78	C32-I53 WeakPolarHBondContact O-CA 3.29Å; L46-I53 HydrophobicContact CD1-CD1 3.92Å; L50-I53 HydrophobicContact CD2-CB 3.99Å; L50-I53 HydrophobicContact CD2-CD1 4.11Å; L50-I53 HydrophobicContact CD2-CG1 4.21Å; I53-I55 HydrophobicContact CD1-CD1 3.93Å; I53-I55 HydrophobicContact CD1-CG1 4.18Å; I53-I55 HydrophobicContact CG1-CD1 4.4Å; I53-I55 HydrophobicContact CG1-CG1 4.1Å; I53-L74 HydrophobicContact CB-CD1 3.99Å; I53-L74 HydrophobicContact CG2-CD1 3.9Å; I53-L74 HydrophobicContact CG2-CD2 3.91Å; I53-L74 HydrophobicContact CG2-CG 4.46Å; I53-D76 PolarHBondContact N-O 3.06Å; I53-M77 HydrophobicContact CG2-CB 4.28Å; I53-M77 HydrophobicContact CG2-CG 3.97Å; I53-M77 WeakPolarHBondContact O-CA 3.38Å; I53-N78 PolarHBondContact O-N 3.32Å
54	T	88.5	Confident	84.4	Confident	22 Å²	22	50.7 Å²	50.7	14%	0.135	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	114.6	173	-57.3	0	0	0	0	108.6	C32 R33 C34 D56 N78	C32-T54 PolarHBondContact O-N 2.83Å; R33-T54 CarbonylContact C-O 3.59Å; R33-T54 WeakPolarHBondContact CA-O 3.24Å; R33-T54 HydrophobicContact CG-CG2 4.46Å; C34-T54 PolarHBondContact N-O 3.22Å; T54-D56 HydrophobicContact CG2-CB 4.17Å; T54-N78 CarbonylContact C-O 3.5Å; T54-N78 WeakPolarHBondContact CA-O 3.39Å; T54-N78 HydrophobicContact CG2-CB 4.05Å
55	I	87.9	Confident	83.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	94.6	171.1	-47.1	176.8	0	0	0	106.9	C34 V39 I42 I53 L60 N78 L79 N82	C34-I55 HydrophobicContact CB-CG1 4.17Å; C34-I55 WeakPolarHBondContact O-CA 3.45Å; V39-I55 HydrophobicContact CB-CG2 4.3Å; V39-I55 HydrophobicContact CG1-CG2 3.73Å; I42-I55 HydrophobicContact CD1-CD1 3.66Å; I53-I55 HydrophobicContact CD1-CD1 3.93Å; I53-I55 HydrophobicContact CD1-CG1 4.18Å; I53-I55 HydrophobicContact CG1-CD1 4.4Å; I53-I55 HydrophobicContact CG1-CG1 4.1Å; I55-L60 HydrophobicContact CB-CD1 3.91Å; I55-L60 HydrophobicContact CD1-CD1 3.95Å; I55-L60 HydrophobicContact CG2-CD1 3.48Å; I55-L60 VanDerWaalsContact CG2-CD1 3.48Å; I55-L60 HydrophobicContact CG2-CG 4.22Å; I55-N78 PolarHBondContact N-O 3.17Å; I55-L79 HydrophobicContact CB-CD2 3.93Å; I55-L79 HydrophobicContact CD1-CD2 4.14Å; I55-L79 HydrophobicContact CG1-CD2 4.22Å; I55-L79 WeakPolarHBondContact O-CA 2.99Å; I55-N82 PolarHBondContact O-ND2 3.18Å
56	D	86.4	Confident	83.3	Confident	33 Å²	33	44.3 Å²	44.3	18%	0.176	27%	0.268	C	S	.	.			trans	-124.4	143.2	-171.5	176.5	31.4	0	0	0	109.7	T54 S58 A80 N81	T54-D56 HydrophobicContact CG2-CB 4.17Å; D56-S58 PolarHBondContact O-N 3.32Å; D56-A80 WeakPolarHBondContact CA-O 2.73Å; D56-N81 WeakPolarHBondContact OD1-CB 3.24Å; D56-N81 PolarHBondContact OD1-ND2 2.77Å
57	H	87.7	Confident	82.8	Confident	109 Å²	109	45.8 Å²	45.8	51%	0.505	28%	0.276	S	S	.	.	S	Bend	trans	56.4	44.3	-175.8	-61.3	78.5	0	0	0	113.6	A80 N81	H57-A80 PolarHBondContact N-O 2.98Å; H57-N81 WeakPolarHBondContact CA-O 3.49Å; H57-N81 PolarHBondContact CE1-ND2 3.49Å; H57-N81 PolarHBondContact N-O 3.28Å
58	S	87.4	Confident	82.3	Confident	14 Å²	14	44.6 Å²	44.6	10%	0.098	27%	0.266	C	S	.	.	S	Bend	trans	-119.1	-179.4	-178.4	-76.9	0	0	0	0	112.2	G36 D56 N82	G36-S58 PolarHBondContact O-OG 3.28Å; D56-S58 PolarHBondContact O-N 3.32Å; S58-N82 VanDerWaalsContact CA-OD1 3.3Å; S58-N82 WeakPolarHBondContact CA-OD1 3.24Å; S58-N82 WeakPolarHBondContact CB-OD1 3.05Å; S58-N82 PolarHBondContact N-OD1 3.18Å; S58-N82 PolarHBondContact O-OD1 3.31Å; S58-N82 VanDerWaalsContact O-OD1 3.06Å
59	A	85	Confident	81.9	Confident	45 Å²	45	47.3 Å²	47.3	37%	0.372	27%	0.27	S	S	.	.			trans	-97.2	21.7	-174.1	0	0	0	0	0	113.1	V39 T61	V39-A59 PolarHBondContact O-N 2.85Å; A59-T61 PolarHBondContact O-N 3.41Å; A59-T61 VanDerWaalsContact O-N 3.13Å
60	L	85.8	Confident	81.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.281	C	S	.	.			trans	-65.1	113.7	179.9	-70.7	173.3	0	0	0	110.4	I42 I55 L79 N82 G83 L84	I42-L60 HydrophobicContact CD1-CD1 4.2Å; I42-L60 HydrophobicContact CD1-CD2 4.35Å; I55-L60 HydrophobicContact CB-CD1 3.91Å; I55-L60 HydrophobicContact CD1-CD1 3.95Å; I55-L60 HydrophobicContact CG2-CD1 3.48Å; I55-L60 VanDerWaalsContact CG2-CD1 3.48Å; I55-L60 HydrophobicContact CG2-CG 4.22Å; L60-L79 HydrophobicContact CD1-CD2 3.96Å; L60-N82 HydrophobicContact CB-CB 4.01Å; L60-G83 CarbonylContact O-C 3.31Å; L60-G83 VanDerWaalsContact O-C 3.31Å; L60-G83 VanDerWaalsContact O-CA 3.26Å; L60-G83 WeakPolarHBondContact O-CA 3.35Å; L60-G83 PolarHBondContact O-N 3.36Å; L60-L84 HydrophobicContact CB-CD2 4.33Å; L60-L84 PolarHBondContact O-N 3.14Å
61	T	85	Confident	81.3	Confident	80 Å²	80	51 Å²	51	49%	0.491	28%	0.283	S	S	.	.			trans	-105.6	-31.1	178.8	51.4	0	0	0	0	112.9	A59	A59-T61 PolarHBondContact O-N 3.41Å; A59-T61 VanDerWaalsContact O-N 3.13Å
62	T	81.6	Confident	80.9	Confident	111 Å²	111	53 Å²	53	68%	0.681	30%	0.296	S	S	*	.			trans	-142.2	150.6	179.3	60.5	0	0	0	0	109.7
63	I	79.3	Confident	80.6	Confident	22 Å²	22	56 Å²	56	11%	0.113	31%	0.307	C	S	.	.			trans	-129.9	122.8	173.3	-66.1	169.4	0	0	0	107.8	I42 D67 F68 L79 L84 P88	I42-I63 HydrophobicContact CD1-CD1 4Å; I42-I63 HydrophobicContact CD1-CG1 4.18Å; I42-I63 HydrophobicContact CG1-CG1 4.3Å; I42-I63 HydrophobicContact CG1-CG2 4.14Å; I63-D67 HydrophobicContact CG2-CB 4.03Å; I63-F68 HydrophobicContact CD1-CE2 4.26Å; I63-F68 HydrophobicContact CD1-CZ 4.32Å; I63-F68 HydrophobicContact CG2-CD2 4.13Å; I63-F68 HydrophobicContact CG2-CE2 3.63Å; I63-F68 HydrophobicContact CG2-CZ 4.35Å; I63-L79 HydrophobicContact CD1-CD1 3.47Å; I63-L79 VanDerWaalsContact CD1-CD1 3.47Å; I63-L79 HydrophobicContact CD1-CD2 4.46Å; I63-L84 HydrophobicContact CD1-CD1 4.16Å; I63-L84 HydrophobicContact CD1-CD2 3.92Å; I63-L84 HydrophobicContact CG1-CD2 3.99Å; I63-P88 HydrophobicContact CB-CB 4.07Å; I63-P88 HydrophobicContact CB-CG 4.29Å; I63-P88 HydrophobicContact CD1-CB 4.14Å; I63-P88 HydrophobicContact CD1-CG 3.64Å; I63-P88 HydrophobicContact CG1-CG 4.45Å; I63-P88 HydrophobicContact CG2-CB 4.13Å
64	G	73.1	Confident	80	Confident	34 Å²	34	57.3 Å²	57.3	35%	0.351	31%	0.314	S	S	.	.			trans	-68.8	154.4	177.8	0	0	0	0	0	112.1	L66 D67	G64-L66 PolarHBondContact O-N 3.47Å; G64-L66 VanDerWaalsContact O-N 3.14Å; G64-D67 WeakPolarHBondContact CA-OD2 3.34Å; G64-D67 PolarHBondContact N-OD2 3.35Å; G64-D67 PolarHBondContact O-N 3.12Å
65	A	66	Low	79.5	Confident	53 Å²	53	58.4 Å²	58.4	44%	0.438	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-19.1	-176.8	0	0	0	0	0	114.6
66	L	71.1	Confident	79	Confident	124 Å²	124	59.8 Å²	59.8	65%	0.649	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-3.5	-176.6	-53	176	0	0	0	112.8	G64 F68 E69	G64-L66 PolarHBondContact O-N 3.47Å; G64-L66 VanDerWaalsContact O-N 3.14Å; L66-F68 PolarHBondContact O-N 2.9Å; L66-E69 WeakPolarHBondContact CD2-OE2 3.37Å; L66-E69 WeakPolarHBondContact O-CB 3.39Å; L66-E69 PolarHBondContact O-N 3.2Å; L66-E69 VanDerWaalsContact O-N 3.12Å
67	D	75.7	Confident	79	Confident	44 Å²	44	58.6 Å²	58.6	24%	0.235	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.6	-172.3	-74.7	-20.1	0	0	0	112.7	I42 I63 G64	I42-D67 HydrophobicContact CB-CB 4.01Å; I42-D67 HydrophobicContact CG1-CB 3.87Å; I63-D67 HydrophobicContact CG2-CB 4.03Å; G64-D67 WeakPolarHBondContact CA-OD2 3.34Å; G64-D67 PolarHBondContact N-OD2 3.35Å; G64-D67 PolarHBondContact O-N 3.12Å
68	F	76.3	Confident	78.9	Confident	16 Å²	16	55 Å²	55	7%	0.07	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-1.8	177.7	-64.9	-62.9	0	0	0	114.5	I42 I63 L66 K70 Y71 L74 M77 L79 P88 L90	I42-F68 HydrophobicContact CD1-CE1 3.81Å; I42-F68 HydrophobicContact CD1-CE2 4.4Å; I42-F68 HydrophobicContact CD1-CZ 3.49Å; I42-F68 VanDerWaalsContact CD1-CZ 3.49Å; I42-F68 HydrophobicContact CG1-CE1 4.03Å; I42-F68 HydrophobicContact CG1-CE2 4.45Å; I42-F68 HydrophobicContact CG1-CZ 3.86Å; I42-F68 HydrophobicContact CG2-CD1 4.18Å; I42-F68 HydrophobicContact CG2-CE1 3.82Å; I63-F68 HydrophobicContact CD1-CE2 4.26Å; I63-F68 HydrophobicContact CD1-CZ 4.32Å; I63-F68 HydrophobicContact CG2-CD2 4.13Å; I63-F68 HydrophobicContact CG2-CE2 3.63Å; I63-F68 HydrophobicContact CG2-CZ 4.35Å; L66-F68 PolarHBondContact O-N 2.9Å; F68-K70 PolarHBondContact O-N 2.87Å; F68-K70 VanDerWaalsContact O-N 3.17Å; F68-Y71 HydrophobicContact CD1-CD2 4.17Å; F68-Y71 PolarHBondContact O-N 2.98Å; F68-L74 HydrophobicContact CD1-CD2 3.81Å; F68-L74 HydrophobicContact CE1-CD2 4.2Å; F68-M77 HydrophobicContact CD1-CE 3.65Å; F68-M77 HydrophobicContact CD2-CE 3.77Å; F68-M77 HydrophobicContact CE1-CE 3.38Å; F68-M77 HydrophobicContact CE1-SD 4.27Å; F68-M77 HydrophobicContact CE2-CE 3.44Å; F68-M77 VanDerWaalsContact CE2-CE 3.44Å; F68-M77 HydrophobicContact CE2-SD 3.82Å; F68-M77 HydrophobicContact CG-CE 3.86Å; F68-M77 HydrophobicContact CZ-CE 3.26Å; F68-M77 HydrophobicContact CZ-SD 3.63Å; F68-L79 HydrophobicContact CZ-CD1 4.34Å; F68-P88 HydrophobicContact CE2-CB 4.48Å; F68-L90 HydrophobicContact CD2-CD2 3.77Å; F68-L90 HydrophobicContact CE2-CD2 3.88Å
69	E	76.6	Confident	79	Confident	132 Å²	132	54.4 Å²	54.4	62%	0.617	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.9	-179.2	-168.8	177.7	-176	0	0	112	L66 Y71	L66-E69 WeakPolarHBondContact CD2-OE2 3.37Å; L66-E69 WeakPolarHBondContact O-CB 3.39Å; L66-E69 PolarHBondContact O-N 3.2Å; L66-E69 VanDerWaalsContact O-N 3.12Å; E69-Y71 PolarHBondContact O-N 3.48Å
70	K	76.5	Confident	79.2	Confident	102 Å²	102	52.3 Å²	52.3	44%	0.443	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18	175.7	-178.5	168.6	176.6	170	0	114	R44 L46 F68 P72	R44-K70 WeakPolarHBondContact O-CD 3.45Å; R44-K70 WeakPolarHBondContact O-CE 3.5Å; R44-K70 PolarHBondContact O-NZ 2.8Å; L46-K70 WeakPolarHBondContact O-CE 3.35Å; F68-K70 PolarHBondContact O-N 2.87Å; F68-K70 VanDerWaalsContact O-N 3.17Å; K70-P72 WeakPolarHBondContact O-CD 3.22Å
71	Y	80.7	Confident	79.5	Confident	6 Å²	6	55.4 Å²	55.4	2%	0.024	30%	0.301	C	S	.	.			trans	-114	69	-172.9	-52.6	-56.8	0	0	0	111.5	I42 P43 L46 S47 L50 F68 E69 R73 L74	I42-Y71 HydrophobicContact CG2-CE2 4.1Å; P43-Y71 PolarHBondContact O-OH 3.25Å; L46-Y71 HydrophobicContact CB-CE1 3.76Å; L46-Y71 WeakPolarHBondContact CB-OH 3.41Å; S47-Y71 WeakPolarHBondContact O-CD1 3.41Å; L50-Y71 HydrophobicContact CB-CD1 4.08Å; L50-Y71 HydrophobicContact CD2-CD1 4.09Å; L50-Y71 HydrophobicContact CD2-CE1 4.29Å; L50-Y71 HydrophobicContact CD2-CG 4.28Å; F68-Y71 HydrophobicContact CD1-CD2 4.17Å; F68-Y71 PolarHBondContact O-N 2.98Å; E69-Y71 PolarHBondContact O-N 3.48Å; Y71-R73 PolarHBondContact O-N 3.3Å; Y71-R73 VanDerWaalsContact O-N 3.08Å; Y71-L74 VanDerWaalsContact O-CB 3.29Å; Y71-L74 WeakPolarHBondContact O-CB 3.26Å; Y71-L74 PolarHBondContact O-N 2.9Å; Y71-L74 VanDerWaalsContact O-N 3.07Å
72	P	75.8	Confident	79.7	Confident	69 Å²	69	52.1 Å²	52.1	45%	0.448	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.5	-172.9	29.1	-37.4	0	0	0	114	K70	K70-P72 WeakPolarHBondContact O-CD 3.22Å
73	R	78.1	Confident	80.1	Confident	159 Å²	159	47.4 Å²	47.4	60%	0.6	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	7.4	178	-63.1	-171.8	178.8	-176.2	-1.7	113.2	L50 T51 Y71 V75	L50-R73 CarbonylContact O-C 3.22Å; T51-R73 WeakPolarHBondContact CA-O 3.47Å; Y71-R73 PolarHBondContact O-N 3.3Å; Y71-R73 VanDerWaalsContact O-N 3.08Å; R73-V75 WeakPolarHBondContact O-CG2 3.43Å; R73-V75 PolarHBondContact O-N 3.2Å
74	L	76.7	Confident	80.6	Confident	28 Å²	28	46.4 Å²	46.4	15%	0.147	25%	0.248	C	C	.	.			trans	-71.8	118.4	-177.1	-167	69.9	0	0	0	109.9	L50 I53 F68 Y71 M77	L50-L74 HydrophobicContact CD2-CD1 4.14Å; L50-L74 HydrophobicContact CG-CD1 4.02Å; L50-L74 WeakPolarHBondContact O-CA 3.45Å; L50-L74 PolarHBondContact O-N 3.41Å; I53-L74 HydrophobicContact CB-CD1 3.99Å; I53-L74 HydrophobicContact CG2-CD1 3.9Å; I53-L74 HydrophobicContact CG2-CD2 3.91Å; I53-L74 HydrophobicContact CG2-CG 4.46Å; F68-L74 HydrophobicContact CD1-CD2 3.81Å; F68-L74 HydrophobicContact CE1-CD2 4.2Å; Y71-L74 VanDerWaalsContact O-CB 3.29Å; Y71-L74 WeakPolarHBondContact O-CB 3.26Å; Y71-L74 PolarHBondContact O-N 2.9Å; Y71-L74 VanDerWaalsContact O-N 3.07Å; L74-M77 HydrophobicContact CD2-CE 3.4Å; L74-M77 VanDerWaalsContact CD2-CE 3.4Å
75	V	76.5	Confident	81.3	Confident	45 Å²	45	49.8 Å²	49.8	27%	0.273	26%	0.255	S	S	.	.			trans	-115.8	-36.1	-176	173.4	0	0	0	0	110.3	T51 R73 F100 H101 G102 A103	T51-V75 PolarHBondContact O-N 3.41Å; R73-V75 WeakPolarHBondContact O-CG2 3.43Å; R73-V75 PolarHBondContact O-N 3.2Å; V75-F100 HydrophobicContact CB-CB 4.42Å; V75-F100 HydrophobicContact CG1-CB 4Å; V75-F100 HydrophobicContact CG2-CB 4.08Å; V75-H101 VanDerWaalsContact CG1-C 3.45Å; V75-H101 WeakPolarHBondContact CG1-O 3.35Å; V75-G102 WeakPolarHBondContact O-CA 3.46Å; V75-A103 PolarHBondContact O-N 3.45Å
76	D	78.9	Confident	82.1	Confident	29 Å²	29	53.9 Å²	53.9	16%	0.155	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.1	-177.6	-167	-12.7	0	0	0	111.2	T51 R52 I53 A103	T51-D76 PolarHBondContact O-N 2.74Å; R52-D76 VanDerWaalsContact CA-O 3.26Å; R52-D76 WeakPolarHBondContact CA-O 3.37Å; R52-D76 HydrophobicContact CB-CB 4.08Å; R52-D76 HydrophobicContact CG-CB 4Å; R52-D76 IonicContact CZ-OD2 3.11Å; R52-D76 IonicContact NE-OD2 2.71Å; R52-D76 PolarHBondContact NE-OD2 3.24Å; R52-D76 IonicContact NH2-OD2 2.7Å; R52-D76 PolarHBondContact NH2-OD2 2.87Å; I53-D76 PolarHBondContact N-O 3.06Å; D76-A103 WeakPolarHBondContact CA-O 3.31Å
77	M	84.6	Confident	82.6	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.039	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	115.8	-175.3	179.2	-178.9	-62	0	0	110	I53 F68 L74 L79 L90 A103 T104 D105	I53-M77 HydrophobicContact CG2-CB 4.28Å; I53-M77 HydrophobicContact CG2-CG 3.97Å; I53-M77 WeakPolarHBondContact O-CA 3.38Å; F68-M77 HydrophobicContact CD1-CE 3.65Å; F68-M77 HydrophobicContact CD2-CE 3.77Å; F68-M77 HydrophobicContact CE1-CE 3.38Å; F68-M77 HydrophobicContact CE1-SD 4.27Å; F68-M77 HydrophobicContact CE2-CE 3.44Å; F68-M77 VanDerWaalsContact CE2-CE 3.44Å; F68-M77 HydrophobicContact CE2-SD 3.82Å; F68-M77 HydrophobicContact CG-CE 3.86Å; F68-M77 HydrophobicContact CZ-CE 3.26Å; F68-M77 HydrophobicContact CZ-SD 3.63Å; L74-M77 HydrophobicContact CD2-CE 3.4Å; L74-M77 VanDerWaalsContact CD2-CE 3.4Å; M77-L79 HydrophobicContact CG-CD1 3.93Å; M77-L79 HydrophobicContact CG-CD2 4.32Å; M77-L79 HydrophobicContact CG-CG 3.69Å; M77-L79 HydrophobicContact SD-CD1 3.39Å; M77-L79 WeakPolarHBondContact SD-CD1 3.15Å; M77-L79 HydrophobicContact SD-CG 3.88Å; M77-L90 HydrophobicContact CE-CD2 3.43Å; M77-L90 VanDerWaalsContact CE-CD2 3.43Å; M77-L90 HydrophobicContact SD-CD2 3.63Å; M77-A103 PolarHBondContact N-O 2.79Å; M77-T104 CarbonylContact O-C 3.57Å; M77-T104 VanDerWaalsContact O-CA 3.29Å; M77-T104 WeakPolarHBondContact O-CA 3.15Å; M77-D105 PolarHBondContact O-N 3.45Å
78	N	87.2	Confident	82.6	Confident	35 Å²	35	46.2 Å²	46.2	19%	0.187	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	115.2	169.1	-176.4	-30.3	0	0	0	109.1	I53 T54 I55 A80 D105	I53-N78 PolarHBondContact O-N 3.32Å; T54-N78 CarbonylContact C-O 3.5Å; T54-N78 WeakPolarHBondContact CA-O 3.39Å; T54-N78 HydrophobicContact CG2-CB 4.05Å; I55-N78 PolarHBondContact N-O 3.17Å; N78-A80 VanDerWaalsContact OD1-CB 3.23Å; N78-A80 WeakPolarHBondContact OD1-CB 3.41Å; N78-A80 PolarHBondContact OD1-N 3.4Å; N78-D105 HydrophobicContact CB-CB 4.26Å; N78-D105 PolarHBondContact ND2-OD2 2.77Å
79	L	88.8	Confident	82.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.			trans	-122.5	29.1	175.4	-62.5	176	0	0	0	110.8	I55 L60 I63 F68 M77 N82 L84 P88 D105 L106 N109	I55-L79 HydrophobicContact CB-CD2 3.93Å; I55-L79 HydrophobicContact CD1-CD2 4.14Å; I55-L79 HydrophobicContact CG1-CD2 4.22Å; I55-L79 WeakPolarHBondContact O-CA 2.99Å; L60-L79 HydrophobicContact CD1-CD2 3.96Å; I63-L79 HydrophobicContact CD1-CD1 3.47Å; I63-L79 VanDerWaalsContact CD1-CD1 3.47Å; I63-L79 HydrophobicContact CD1-CD2 4.46Å; F68-L79 HydrophobicContact CZ-CD1 4.34Å; M77-L79 HydrophobicContact CG-CD1 3.93Å; M77-L79 HydrophobicContact CG-CD2 4.32Å; M77-L79 HydrophobicContact CG-CG 3.69Å; M77-L79 HydrophobicContact SD-CD1 3.39Å; M77-L79 WeakPolarHBondContact SD-CD1 3.15Å; M77-L79 HydrophobicContact SD-CG 3.88Å; L79-N82 VanDerWaalsContact C-ND2 3.27Å; L79-N82 PolarHBondContact O-ND2 2.83Å; L79-L84 HydrophobicContact CB-CD1 4.19Å; L79-L84 HydrophobicContact CD1-CD1 4.21Å; L79-P88 HydrophobicContact CD1-CG 4.04Å; L79-D105 CarbonylContact C-O 3.55Å; L79-D105 WeakPolarHBondContact CA-O 3.25Å; L79-D105 PolarHBondContact N-O 3.29Å; L79-L106 HydrophobicContact CB-CD2 4.08Å; L79-L106 HydrophobicContact CD1-CD2 4.17Å; L79-N109 PolarHBondContact O-ND2 3.37Å
80	A	88.7	Confident	81.2	Confident	2 Å²	2	41.1 Å²	41.1	2%	0.017	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	155.6	-178.7	0	0	0	0	0	112.1	D56 H57 N78 N82 D105 S107	D56-A80 WeakPolarHBondContact CA-O 2.73Å; H57-A80 PolarHBondContact N-O 2.98Å; N78-A80 VanDerWaalsContact OD1-CB 3.23Å; N78-A80 WeakPolarHBondContact OD1-CB 3.41Å; N78-A80 PolarHBondContact OD1-N 3.4Å; A80-N82 VanDerWaalsContact C-N 3.31Å; A80-N82 PolarHBondContact O-N 3.5Å; A80-N82 PolarHBondContact O-ND2 2.95Å; A80-D105 PolarHBondContact N-O 3.18Å; A80-S107 CarbonylContact C-O 3.24Å; A80-S107 VanDerWaalsContact CA-O 3.24Å; A80-S107 WeakPolarHBondContact CA-O 3.44Å; A80-S107 VanDerWaalsContact CB-OG 3.29Å; A80-S107 WeakPolarHBondContact CB-OG 3.41Å
81	N	91.5	Very high	79.6	Confident	64 Å²	64	41 Å²	41	34%	0.342	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	43.8	172.3	-49.4	-65.9	0	0	0	114.2	D56 H57 S107	D56-N81 WeakPolarHBondContact OD1-CB 3.24Å; D56-N81 PolarHBondContact OD1-ND2 2.77Å; H57-N81 WeakPolarHBondContact CA-O 3.49Å; H57-N81 PolarHBondContact CE1-ND2 3.49Å; H57-N81 PolarHBondContact N-O 3.28Å; N81-S107 PolarHBondContact N-O 2.99Å
82	N	90.2	Very high	78.1	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.064	23%	0.227	C	C	.	.	S	Bend	trans	-110.1	-168.3	172.5	-74.5	-73.1	0	0	0	110.7	I55 S58 L60 L79 A80 L84 N109	I55-N82 PolarHBondContact O-ND2 3.18Å; S58-N82 VanDerWaalsContact CA-OD1 3.3Å; S58-N82 WeakPolarHBondContact CA-OD1 3.24Å; S58-N82 WeakPolarHBondContact CB-OD1 3.05Å; S58-N82 PolarHBondContact N-OD1 3.18Å; S58-N82 PolarHBondContact O-OD1 3.31Å; S58-N82 VanDerWaalsContact O-OD1 3.06Å; L60-N82 HydrophobicContact CB-CB 4.01Å; L79-N82 VanDerWaalsContact C-ND2 3.27Å; L79-N82 PolarHBondContact O-ND2 2.83Å; A80-N82 VanDerWaalsContact C-N 3.31Å; A80-N82 PolarHBondContact O-N 3.5Å; A80-N82 PolarHBondContact O-ND2 2.95Å; N82-L84 HydrophobicContact CB-CG 4.34Å; N82-N109 WeakPolarHBondContact CA-OD1 3.35Å; N82-N109 VanDerWaalsContact CB-OD1 3.23Å; N82-N109 WeakPolarHBondContact CB-OD1 3.46Å; N82-N109 PolarHBondContact N-OD1 3.02Å; N82-N109 PolarHBondContact O-OD1 3.09Å
83	G	90.6	Very high	75.7	Confident	11 Å²	11	44.4 Å²	44.4	11%	0.113	23%	0.232	C	C	.	.			trans	-101.6	19.6	179	0	0	0	0	0	114.7	L60 E85	L60-G83 CarbonylContact O-C 3.31Å; L60-G83 VanDerWaalsContact O-C 3.31Å; L60-G83 VanDerWaalsContact O-CA 3.26Å; L60-G83 WeakPolarHBondContact O-CA 3.35Å; L60-G83 PolarHBondContact O-N 3.36Å; G83-E85 PolarHBondContact O-N 3.02Å
84	L	88.4	Confident	73.4	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	23%	0.232	C	C	.	.			trans	-66.1	123.3	-172.1	-60.2	172.8	0	0	0	111.3	L60 I63 L79 N82 P88 L106 N109 K110 I111	L60-L84 HydrophobicContact CB-CD2 4.33Å; L60-L84 PolarHBondContact O-N 3.14Å; I63-L84 HydrophobicContact CD1-CD1 4.16Å; I63-L84 HydrophobicContact CD1-CD2 3.92Å; I63-L84 HydrophobicContact CG1-CD2 3.99Å; L79-L84 HydrophobicContact CB-CD1 4.19Å; L79-L84 HydrophobicContact CD1-CD1 4.21Å; N82-L84 HydrophobicContact CB-CG 4.34Å; L84-P88 HydrophobicContact CD1-CG 4.21Å; L84-L106 HydrophobicContact CD1-CD2 3.93Å; L84-N109 HydrophobicContact CB-CB 4.18Å; L84-N109 WeakPolarHBondContact CB-OD1 3.36Å; L84-N109 WeakPolarHBondContact CG-OD1 3.08Å; L84-N109 PolarHBondContact N-OD1 2.91Å; L84-K110 CarbonylContact O-C 3.44Å; L84-K110 VanDerWaalsContact O-C 3.24Å; L84-K110 VanDerWaalsContact O-CA 3.28Å; L84-K110 WeakPolarHBondContact O-CA 2.88Å; L84-K110 WeakPolarHBondContact O-CB 3.06Å; L84-K110 PolarHBondContact O-N 2.87Å; L84-I111 PolarHBondContact O-N 3.23Å
85	E	88.3	Confident	71	Confident	105 Å²	105	44.3 Å²	44.3	49%	0.491	26%	0.258	S	S	.	.	S	Bend	trans	-90.7	-17.3	175.7	-59.9	-159.1	175.1	0	0	113.2	G83 K110 I111	G83-E85 PolarHBondContact O-N 3.02Å; E85-K110 HydrophobicContact CG-CB 4.12Å; E85-I111 WeakPolarHBondContact O-CA 3.49Å
86	E	84.1	Confident	68.7	Low	140 Å²	140	51.4 Å²	51.4	65%	0.654	29%	0.285	S	S	*	.	S	Bend	trans	-136.6	155.6	-177.9	-63.2	-173.2	177.5	0	0	110.9
87	V	81.4	Confident	66.5	Low	2 Å²	2	56.2 Å²	56.2	1%	0.012	31%	0.311	C	S	.	.			trans	-70.3	129.3	174	176.5	0	0	0	0	110.3	L106 I111 L114 E118 F121	V87-L106 HydrophobicContact CG1-CD1 4.14Å; V87-L106 HydrophobicContact CG2-CD1 4.35Å; V87-I111 HydrophobicContact CG2-CD1 4.11Å; V87-I111 HydrophobicContact CG2-CG2 4.26Å; V87-L114 HydrophobicContact CG2-CD2 3.49Å; V87-L114 VanDerWaalsContact CG2-CD2 3.49Å; V87-E118 HydrophobicContact CB-CG 4.18Å; V87-F121 HydrophobicContact CB-CZ 4.3Å; V87-F121 HydrophobicContact CG1-CD1 4.45Å; V87-F121 HydrophobicContact CG1-CE1 3.67Å; V87-F121 HydrophobicContact CG1-CE2 3.81Å; V87-F121 HydrophobicContact CG1-CZ 3.31Å; V87-F121 HydrophobicContact CG2-CE2 4.45Å; V87-F121 HydrophobicContact CG2-CZ 4.01Å
88	P	74	Confident	64.2	Low	5 Å²	5	60.7 Å²	60.7	3%	0.032	35%	0.349	C	S	.	.			trans	-59.4	149.4	178.6	-24.9	35.4	0	0	0	113.3	I63 F68 L79 L84 L90 L106	I63-P88 HydrophobicContact CB-CB 4.07Å; I63-P88 HydrophobicContact CB-CG 4.29Å; I63-P88 HydrophobicContact CD1-CB 4.14Å; I63-P88 HydrophobicContact CD1-CG 3.64Å; I63-P88 HydrophobicContact CG1-CG 4.45Å; I63-P88 HydrophobicContact CG2-CB 4.13Å; F68-P88 HydrophobicContact CE2-CB 4.48Å; L79-P88 HydrophobicContact CD1-CG 4.04Å; L84-P88 HydrophobicContact CD1-CG 4.21Å; P88-L90 HydrophobicContact CB-CD2 4.26Å; P88-L90 PolarHBondContact O-N 2.88Å; P88-L90 VanDerWaalsContact O-N 3.11Å; P88-L106 HydrophobicContact CG-CD2 4.33Å
89	S	65.9	Low	61.9	Low	16 Å²	16	64 Å²	64	11%	0.112	37%	0.371	C	S	.	.			trans	-75.4	97.7	170.3	-33	0	0	0	0	110.2	V91 K120	S89-V91 PolarHBondContact O-N 3.41Å; S89-K120 VanDerWaalsContact CA-CD 3.49Å; S89-K120 WeakPolarHBondContact OG-CD 2.98Å; S89-K120 WeakPolarHBondContact OG-CE 3.47Å; S89-K120 PolarHBondContact OG-NZ 3.41Å
90	L	58	Low	59.7	Low	24 Å²	24	70.2 Å²	70.2	13%	0.126	40%	0.398	C	S	.	.			trans	-88.9	87.9	175.5	-51.8	172.2	0	0	0	108.9	F68 M77 P88 K92 T104 K120 F121	F68-L90 HydrophobicContact CD2-CD2 3.77Å; F68-L90 HydrophobicContact CE2-CD2 3.88Å; M77-L90 HydrophobicContact CE-CD2 3.43Å; M77-L90 VanDerWaalsContact CE-CD2 3.43Å; M77-L90 HydrophobicContact SD-CD2 3.63Å; P88-L90 HydrophobicContact CB-CD2 4.26Å; P88-L90 PolarHBondContact O-N 2.88Å; P88-L90 VanDerWaalsContact O-N 3.11Å; L90-K92 PolarHBondContact O-N 3.5Å; L90-T104 HydrophobicContact CD1-CG2 4.31Å; L90-K120 CarbonylContact C-O 3.56Å; L90-K120 WeakPolarHBondContact CA-O 3.22Å; L90-K120 VanDerWaalsContact CB-O 3.23Å; L90-K120 WeakPolarHBondContact CB-O 3.49Å; L90-K120 PolarHBondContact N-O 3Å; L90-F121 HydrophobicContact CD1-CD1 4.4Å
91	V	42.5	Very low	58.2	Low	100 Å²	100	76.2 Å²	76.2	61%	0.606	43%	0.425	S	S	*	.			trans	-72.1	94.7	172.4	-175.6	0	0	0	0	108.1	S89 A93	S89-V91 PolarHBondContact O-N 3.41Å; V91-A93 PolarHBondContact O-N 2.75Å
92	K	49.4	Very low	57	Low	81 Å²	81	73.2 Å²	73.2	35%	0.352	41%	0.41	S	S	.	.			trans	-72.9	105.3	167.2	-81.1	-167.6	-167.9	168.3	0	109.3	L90 G122 D124	L90-K92 PolarHBondContact O-N 3.5Å; K92-G122 PolarHBondContact NZ-O 2.77Å; K92-D124 VanDerWaalsContact NZ-CA 3.3Å; K92-D124 VanDerWaalsContact NZ-N 3.19Å; K92-D124 PolarHBondContact NZ-O 3.38Å
93	A	26.5	Very low	56.5	Low	66 Å²	66	74.1 Å²	74.1	55%	0.545	42%	0.418	S	S	.	.			trans	-91.6	141.4	153.2	0	0	0	0	0	108.5	V91	V91-A93 PolarHBondContact O-N 2.75Å
94	A	30.2	Very low	56.1	Low	72 Å²	72	74 Å²	74	60%	0.595	42%	0.416	S	S	*	.			trans	81.5	80.6	177.1	0	0	0	0	0	117.2	F96	A94-F96 PolarHBondContact O-N 3.29Å
95	T	26.5	Very low	56.1	Low	112 Å²	112	76 Å²	76	69%	0.687	43%	0.426	S	S	*	.				-39.4	115.6	126.3	44.6	0	0	0	0	108.6
96	F	28.1	Very low	56.2	Low	194 Å²	194	71 Å²	71	85%	0.851	40%	0.403	S	S	*	.			trans	162.3	68.4	157.5	-83.2	-61.6	0	0	0	109.6	A94	A94-F96 PolarHBondContact O-N 3.29Å
97	D	32.3	Very low	56.5	Low	130 Å²	130	65 Å²	65	70%	0.695	38%	0.376	S	S	*	.			trans	166.4	110.9	137.8	-97.5	-25.4	0	0	0	108.9	V99	D97-V99 PolarHBondContact O-N 2.91Å
98	A	35	Very low	57.1	Low	102 Å²	102	65.9 Å²	65.9	84%	0.843	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	17.6	179.7	0	0	0	0	0	114.2
99	V	40	Very low	57.9	Low	106 Å²	106	66 Å²	66	64%	0.642	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-21.6	-169.9	-175.3	0	0	0	0	112.5	D97	D97-V99 PolarHBondContact O-N 2.91Å
100	F	41.4	Very low	59.3	Low	129 Å²	129	70.7 Å²	70.7	57%	0.566	41%	0.405	S	S	*	.			trans	-112.6	116.7	-178	-69.1	-82.5	0	0	0	111.3	V75	V75-F100 HydrophobicContact CB-CB 4.42Å; V75-F100 HydrophobicContact CG1-CB 4Å; V75-F100 HydrophobicContact CG2-CB 4.08Å
101	H	58.6	Low	60.9	Low	129 Å²	129	69.5 Å²	69.5	60%	0.597	40%	0.399	S	S	*	.			trans	-86.1	123.1	-177.4	-71.1	-171.1	0	0	0	111.3	V75 I126	V75-H101 VanDerWaalsContact CG1-C 3.45Å; V75-H101 WeakPolarHBondContact CG1-O 3.35Å; H101-I126 HydrophobicContact CB-CB 4.44Å; H101-I126 HydrophobicContact CB-CD1 3.41Å; H101-I126 VanDerWaalsContact CB-CD1 3.41Å; H101-I126 HydrophobicContact CB-CG1 4.45Å; H101-I126 VanDerWaalsContact CD2-CD1 3.42Å; H101-I126 WeakPolarHBondContact CD2-CD1 3.31Å
102	G	66	Low	63.2	Low	1 Å²	1	70.1 Å²	70.1	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.1	-176.9	0	0	0	0	0	114.1	V75 I126 A127	V75-G102 WeakPolarHBondContact O-CA 3.46Å; G102-I126 PolarHBondContact O-N 3.4Å; G102-A127 PolarHBondContact O-N 3.17Å; G102-A127 VanDerWaalsContact O-N 3.16Å
103	A	78.8	Confident	65.2	Low	30 Å²	30	68.3 Å²	68.3	25%	0.248	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.6	172.2	0	0	0	0	0	109.6	V75 D76 M77 A127	V75-A103 PolarHBondContact O-N 3.45Å; D76-A103 WeakPolarHBondContact CA-O 3.31Å; M77-A103 PolarHBondContact N-O 2.79Å; A103-A127 WeakPolarHBondContact CA-O 3.29Å; A103-A127 HydrophobicContact CB-CB 4.04Å
104	T	83.9	Confident	68.1	Low	10 Å²	10	65.3 Å²	65.3	6%	0.061	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	119	175.4	-62.8	0	0	0	0	109.3	M77 L90 L106 L125 A127 L128 A129	M77-T104 CarbonylContact O-C 3.57Å; M77-T104 VanDerWaalsContact O-CA 3.29Å; M77-T104 WeakPolarHBondContact O-CA 3.15Å; L90-T104 HydrophobicContact CD1-CG2 4.31Å; T104-L106 HydrophobicContact CG2-CD1 4.11Å; T104-L106 HydrophobicContact CG2-CG 3.98Å; T104-L125 WeakPolarHBondContact OG1-CD1 3.36Å; T104-A127 PolarHBondContact N-O 3.35Å; T104-L128 HydrophobicContact CG2-CD1 4.4Å; T104-L128 WeakPolarHBondContact O-CA 3.22Å; T104-A129 PolarHBondContact O-N 2.85Å
105	D	87	Confident	70.5	Confident	41 Å²	41	63.8 Å²	63.8	22%	0.219	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.4	178	-172.9	-4.3	0	0	0	109.5	M77 N78 L79 A80 S107 A129	M77-D105 PolarHBondContact O-N 3.45Å; N78-D105 HydrophobicContact CB-CB 4.26Å; N78-D105 PolarHBondContact ND2-OD2 2.77Å; L79-D105 CarbonylContact C-O 3.55Å; L79-D105 WeakPolarHBondContact CA-O 3.25Å; L79-D105 PolarHBondContact N-O 3.29Å; A80-D105 PolarHBondContact N-O 3.18Å; D105-S107 WeakPolarHBondContact OD1-CB 3.35Å; D105-S107 PolarHBondContact OD1-N 2.87Å; D105-S107 PolarHBondContact OD1-OG 3.44Å; D105-A129 HydrophobicContact CB-CB 4.48Å
106	L	90	Very high	72.8	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.005	35%	0.345	C	S	.	.			trans	-117.1	18.8	176.8	-68.4	167.2	0	0	0	110.7	L79 L84 V87 P88 T104 N109 I111 F121 A129 L130 N133	L79-L106 HydrophobicContact CB-CD2 4.08Å; L79-L106 HydrophobicContact CD1-CD2 4.17Å; L84-L106 HydrophobicContact CD1-CD2 3.93Å; V87-L106 HydrophobicContact CG1-CD1 4.14Å; V87-L106 HydrophobicContact CG2-CD1 4.35Å; P88-L106 HydrophobicContact CG-CD2 4.33Å; T104-L106 HydrophobicContact CG2-CD1 4.11Å; T104-L106 HydrophobicContact CG2-CG 3.98Å; L106-N109 PolarHBondContact O-ND2 2.83Å; L106-I111 HydrophobicContact CB-CD1 4.11Å; L106-I111 HydrophobicContact CD1-CD1 4.32Å; L106-F121 HydrophobicContact CD1-CE1 4.04Å; L106-F121 HydrophobicContact CD1-CZ 4.24Å; L106-A129 WeakPolarHBondContact CA-O 3.21Å; L106-A129 PolarHBondContact N-O 3.25Å; L106-L130 HydrophobicContact CB-CD2 3.89Å; L106-L130 HydrophobicContact CD1-CD2 4Å; L106-N133 PolarHBondContact O-ND2 2.84Å
107	S	91.9	Very high	74	Confident	13 Å²	13	59 Å²	59	9%	0.091	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	150.7	-178.2	61.3	0	0	0	0	112.5	A80 N81 D105 N109 D131	A80-S107 CarbonylContact C-O 3.24Å; A80-S107 VanDerWaalsContact CA-O 3.24Å; A80-S107 WeakPolarHBondContact CA-O 3.44Å; A80-S107 VanDerWaalsContact CB-OG 3.29Å; A80-S107 WeakPolarHBondContact CB-OG 3.41Å; N81-S107 PolarHBondContact N-O 2.99Å; D105-S107 WeakPolarHBondContact OD1-CB 3.35Å; D105-S107 PolarHBondContact OD1-N 2.87Å; D105-S107 PolarHBondContact OD1-OG 3.44Å; S107-N109 VanDerWaalsContact C-N 3.3Å; S107-N109 PolarHBondContact O-N 3.39Å; S107-N109 PolarHBondContact O-ND2 2.9Å; S107-D131 CarbonylContact C-O 3.57Å; S107-D131 WeakPolarHBondContact CA-O 3.49Å; S107-D131 VanDerWaalsContact CB-OD1 3.23Å; S107-D131 WeakPolarHBondContact CB-OD1 3.12Å; S107-D131 WeakPolarHBondContact CB-OD2 3.35Å
108	G	92.5	Very high	75	Confident	22 Å²	22	53.6 Å²	53.6	23%	0.227	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	26.6	173.5	0	0	0	0	0	115.5	D131	G108-D131 PolarHBondContact N-O 3.4Å
109	N	92.6	Very high	75.8	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.043	27%	0.274	C	S	.	.	S	Bend	trans	-99.4	-168.1	175.8	-81.8	-77.3	0	0	0	111.6	L79 N82 L84 L106 S107 I111 N133 P134	L79-N109 PolarHBondContact O-ND2 3.37Å; N82-N109 WeakPolarHBondContact CA-OD1 3.35Å; N82-N109 VanDerWaalsContact CB-OD1 3.23Å; N82-N109 WeakPolarHBondContact CB-OD1 3.46Å; N82-N109 PolarHBondContact N-OD1 3.02Å; N82-N109 PolarHBondContact O-OD1 3.09Å; L84-N109 HydrophobicContact CB-CB 4.18Å; L84-N109 WeakPolarHBondContact CB-OD1 3.36Å; L84-N109 WeakPolarHBondContact CG-OD1 3.08Å; L84-N109 PolarHBondContact N-OD1 2.91Å; L106-N109 PolarHBondContact O-ND2 2.83Å; S107-N109 VanDerWaalsContact C-N 3.3Å; S107-N109 PolarHBondContact O-N 3.39Å; S107-N109 PolarHBondContact O-ND2 2.9Å; N109-I111 HydrophobicContact CB-CD1 4.33Å; N109-I111 HydrophobicContact CB-CG1 4.21Å; N109-N133 VanDerWaalsContact CA-OD1 3.27Å; N109-N133 WeakPolarHBondContact CA-OD1 3.33Å; N109-N133 WeakPolarHBondContact CB-OD1 3.4Å; N109-N133 PolarHBondContact N-OD1 3.26Å; N109-N133 PolarHBondContact O-OD1 2.91Å; N109-N133 VanDerWaalsContact O-OD1 3.1Å; N109-P134 WeakPolarHBondContact O-CD 3.41Å
110	K	94.2	Very high	76.5	Confident	113 Å²	113	48.9 Å²	48.9	49%	0.491	26%	0.258	S	S	.	.			trans	-108.3	23.6	-179.5	-63.8	-178.9	-178.1	174.1	0	113	L84 E85 K112 N133	L84-K110 CarbonylContact O-C 3.44Å; L84-K110 VanDerWaalsContact O-C 3.24Å; L84-K110 VanDerWaalsContact O-CA 3.28Å; L84-K110 WeakPolarHBondContact O-CA 2.88Å; L84-K110 WeakPolarHBondContact O-CB 3.06Å; L84-K110 PolarHBondContact O-N 2.87Å; E85-K110 HydrophobicContact CG-CB 4.12Å; K110-K112 PolarHBondContact O-N 3.18Å; K110-N133 PolarHBondContact N-OD1 3.26Å
111	I	91.2	Very high	77.2	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.			trans	-68.4	120.3	-175.8	-57.2	168.3	0	0	0	110	L84 E85 V87 L106 N109 L114 L130 N133 P134 L135	L84-I111 PolarHBondContact O-N 3.23Å; E85-I111 WeakPolarHBondContact O-CA 3.49Å; V87-I111 HydrophobicContact CG2-CD1 4.11Å; V87-I111 HydrophobicContact CG2-CG2 4.26Å; L106-I111 HydrophobicContact CB-CD1 4.11Å; L106-I111 HydrophobicContact CD1-CD1 4.32Å; N109-I111 HydrophobicContact CB-CD1 4.33Å; N109-I111 HydrophobicContact CB-CG1 4.21Å; I111-L114 HydrophobicContact CG2-CD2 4.23Å; I111-L130 HydrophobicContact CD1-CD2 3.91Å; I111-N133 HydrophobicContact CB-CB 4.31Å; I111-N133 VanDerWaalsContact CB-OD1 3.31Å; I111-N133 WeakPolarHBondContact CB-OD1 3.12Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.32Å; I111-N133 PolarHBondContact N-OD1 2.87Å; I111-P134 CarbonylContact O-C 3.49Å; I111-P134 WeakPolarHBondContact O-CD 3.34Å; I111-L135 WeakPolarHBondContact O-CA 3.24Å; I111-L135 PolarHBondContact O-N 3.25Å; I111-L135 VanDerWaalsContact O-N 3.12Å
112	K	92	Very high	77.3	Confident	112 Å²	112	37.2 Å²	37.2	49%	0.487	21%	0.207	S	C	.	.			trans	-100.5	-28.6	-174.6	-68.6	170.7	-170.7	156.4	0	114.3	K110 P134 L135 S136	K110-K112 PolarHBondContact O-N 3.18Å; K112-P134 HydrophobicContact CG-CG 4.04Å; K112-L135 WeakPolarHBondContact O-CA 3.36Å; K112-S136 PolarHBondContact O-N 3.01Å; K112-S136 PolarHBondContact O-OG 3.4Å
113	A	90.8	Very high	77.1	Confident	43 Å²	43	41.1 Å²	41.1	36%	0.355	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	154.9	-175.5	0	0	0	0	0	110.9	N137	A113-N137 CarbonylContact C-O 3.48Å; A113-N137 WeakPolarHBondContact CA-O 3.2Å; A113-N137 HydrophobicContact CB-CB 4.08Å
114	L	88	Confident	76.8	Confident	4 Å²	4	43 Å²	43	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.4	164.7	-56.5	176.7	0	0	0	110.9	V87 I111 E118 L130 L135 N137 V138 H139 A142 F143	V87-L114 HydrophobicContact CG2-CD2 3.49Å; V87-L114 VanDerWaalsContact CG2-CD2 3.49Å; I111-L114 HydrophobicContact CG2-CD2 4.23Å; L114-E118 WeakPolarHBondContact CA-OE2 3.38Å; L114-E118 WeakPolarHBondContact CB-OE2 3.29Å; L114-E118 WeakPolarHBondContact CD2-OE2 3.31Å; L114-L130 HydrophobicContact CD1-CD1 3.9Å; L114-L130 HydrophobicContact CD2-CD1 4.38Å; L114-L135 HydrophobicContact CD1-CD2 3.99Å; L114-L135 HydrophobicContact CD2-CD1 4.36Å; L114-L135 HydrophobicContact CG-CD1 3.75Å; L114-L135 HydrophobicContact CG-CD2 4.1Å; L114-N137 PolarHBondContact N-O 3.01Å; L114-V138 HydrophobicContact CB-CG1 4.06Å; L114-V138 HydrophobicContact CD1-CG1 3.94Å; L114-V138 HydrophobicContact CD1-CG2 4.19Å; L114-V138 HydrophobicContact CG-CG1 4.46Å; L114-V138 HydrophobicContact CG-CG2 4.41Å; L114-H139 VanDerWaalsContact O-CB 3.22Å; L114-H139 WeakPolarHBondContact O-CB 3.33Å; L114-H139 PolarHBondContact O-N 2.96Å; L114-A142 HydrophobicContact CB-CB 3.98Å; L114-F143 HydrophobicContact CD1-CE1 3.71Å; L114-F143 HydrophobicContact CD1-CZ 3.7Å
115	S	79.9	Confident	76.4	Confident	39 Å²	39	42.7 Å²	42.7	27%	0.273	24%	0.235	S	C	.	.			trans	-85.7	164.7	-178.8	65.4	0	0	0	0	113.3	S117 E118	S115-S117 PolarHBondContact O-N 3.46Å; S115-S117 PolarHBondContact OG-OG 3.39Å; S115-E118 WeakPolarHBondContact CB-OE1 3.37Å; S115-E118 PolarHBondContact N-OE1 2.88Å; S115-E118 PolarHBondContact N-OE2 3.48Å; S115-E118 PolarHBondContact O-N 2.95Å; S115-E118 VanDerWaalsContact OG-CD 3.32Å; S115-E118 VanDerWaalsContact OG-CG 3.26Å; S115-E118 WeakPolarHBondContact OG-CG 3.3Å; S115-E118 PolarHBondContact OG-N 3.39Å; S115-E118 PolarHBondContact OG-OE1 3.34Å
116	K	74.2	Confident	76.3	Confident	119 Å²	119	41.9 Å²	41.9	52%	0.517	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-58.9	-36.5	170.9	-170.8	179.9	174.9	-179.6	0	111.9	E118 L141	K116-E118 VanDerWaalsContact C-N 3.26Å; K116-E118 PolarHBondContact O-N 2.87Å; K116-L141 HydrophobicContact CD-CD1 4.33Å; K116-L141 HydrophobicContact CG-CB 4.35Å
117	S	53.3	Low	76.1	Confident	86 Å²	86	42.8 Å²	42.8	60%	0.601	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-76.9	-9.5	-177.6	44	0	0	0	0	113.5	S115 N119	S115-S117 PolarHBondContact O-N 3.46Å; S115-S117 PolarHBondContact OG-OG 3.39Å; S117-N119 PolarHBondContact O-N 2.04Å
118	E	54.7	Low	76	Confident	18 Å²	18	42.4 Å²	42.4	8%	0.084	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-73.4	17.7	168.3	-76.3	158.9	-130.3	0	0	114.1	V87 L114 S115 K116 K120 F121	V87-E118 HydrophobicContact CB-CG 4.18Å; L114-E118 WeakPolarHBondContact CA-OE2 3.38Å; L114-E118 WeakPolarHBondContact CB-OE2 3.29Å; L114-E118 WeakPolarHBondContact CD2-OE2 3.31Å; S115-E118 WeakPolarHBondContact CB-OE1 3.37Å; S115-E118 PolarHBondContact N-OE1 2.88Å; S115-E118 PolarHBondContact N-OE2 3.48Å; S115-E118 PolarHBondContact O-N 2.95Å; S115-E118 VanDerWaalsContact OG-CD 3.32Å; S115-E118 VanDerWaalsContact OG-CG 3.26Å; S115-E118 WeakPolarHBondContact OG-CG 3.3Å; S115-E118 PolarHBondContact OG-N 3.39Å; S115-E118 PolarHBondContact OG-OE1 3.34Å; K116-E118 VanDerWaalsContact C-N 3.26Å; K116-E118 PolarHBondContact O-N 2.87Å; E118-K120 PolarHBondContact O-N 3.3Å; E118-F121 WeakPolarHBondContact O-CD2 3.13Å; E118-F121 PolarHBondContact O-N 3.48Å
119	N	51.4	Low	76	Confident	41 Å²	41	42.3 Å²	42.3	22%	0.219	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	11.6	144.1	-87.2	-14.9	0	0	0	115.8	S117 F121 R145	S117-N119 PolarHBondContact O-N 2.04Å; N119-F121 VanDerWaalsContact C-N 3.29Å; N119-R145 VanDerWaalsContact CG-CD 3.41Å; N119-R145 PolarHBondContact ND2-NE 3.24Å; N119-R145 WeakPolarHBondContact OD1-CD 3.41Å; N119-R145 VanDerWaalsContact OD1-CG 3.27Å; N119-R145 WeakPolarHBondContact OD1-CG 3.31Å
120	K	53.3	Low	76	Confident	67 Å²	67	41.9 Å²	41.9	29%	0.291	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-14.5	165.8	-75.2	170.3	173.4	-161.7	0	113.2	S89 L90 E118 G122	S89-K120 VanDerWaalsContact CA-CD 3.49Å; S89-K120 WeakPolarHBondContact OG-CD 2.98Å; S89-K120 WeakPolarHBondContact OG-CE 3.47Å; S89-K120 PolarHBondContact OG-NZ 3.41Å; L90-K120 CarbonylContact C-O 3.56Å; L90-K120 WeakPolarHBondContact CA-O 3.22Å; L90-K120 VanDerWaalsContact CB-O 3.23Å; L90-K120 WeakPolarHBondContact CB-O 3.49Å; L90-K120 PolarHBondContact N-O 3Å; E118-K120 PolarHBondContact O-N 3.3Å; K120-G122 PolarHBondContact O-N 3.43Å
121	F	57.7	Low	75.9	Confident	6 Å²	6	37.7 Å²	37.7	3%	0.026	21%	0.212	C	C	.	.	S	Bend	trans	-72.4	123.6	167.5	-62.4	-74.1	0	0	0	109.5	V87 L90 L106 E118 N119 L125 L128 L146	V87-F121 HydrophobicContact CB-CZ 4.3Å; V87-F121 HydrophobicContact CG1-CD1 4.45Å; V87-F121 HydrophobicContact CG1-CE1 3.67Å; V87-F121 HydrophobicContact CG1-CE2 3.81Å; V87-F121 HydrophobicContact CG1-CZ 3.31Å; V87-F121 HydrophobicContact CG2-CE2 4.45Å; V87-F121 HydrophobicContact CG2-CZ 4.01Å; L90-F121 HydrophobicContact CD1-CD1 4.4Å; L106-F121 HydrophobicContact CD1-CE1 4.04Å; L106-F121 HydrophobicContact CD1-CZ 4.24Å; E118-F121 WeakPolarHBondContact O-CD2 3.13Å; E118-F121 PolarHBondContact O-N 3.48Å; N119-F121 VanDerWaalsContact C-N 3.29Å; F121-L125 HydrophobicContact CB-CD2 4.42Å; F121-L125 HydrophobicContact CD1-CD2 3.91Å; F121-L125 HydrophobicContact CG-CD2 4.4Å; F121-L128 HydrophobicContact CD1-CD1 4.27Å; F121-L128 HydrophobicContact CE1-CD1 3.53Å; F121-L128 HydrophobicContact CE1-CD2 4.18Å; F121-L128 HydrophobicContact CE2-CD2 4.26Å; F121-L128 HydrophobicContact CZ-CD1 3.9Å; F121-L128 HydrophobicContact CZ-CD2 3.96Å; F121-L146 HydrophobicContact CB-CD2 3.52Å; F121-L146 HydrophobicContact CB-CG 4.44Å; F121-L146 HydrophobicContact CG-CD2 4.3Å
122	G	59	Low	76.2	Confident	8 Å²	8	41.8 Å²	41.8	8%	0.082	23%	0.234	C	C	.	.			trans	-68.8	145.4	179.9	0	0	0	0	0	112.4	K92 K120 D124 L125	K92-G122 PolarHBondContact NZ-O 2.77Å; K120-G122 PolarHBondContact O-N 3.43Å; G122-D124 PolarHBondContact O-N 3.32Å; G122-L125 PolarHBondContact O-N 3.07Å
123	V	63.6	Low	76.3	Confident	82 Å²	82	36.6 Å²	36.6	50%	0.497	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-31.2	-168.7	-171.3	0	0	0	0	113.8	L125	V123-L125 VanDerWaalsContact C-N 3.34Å; V123-L125 PolarHBondContact O-N 2.93Å
124	D	70.6	Confident	76.5	Confident	70 Å²	70	36.6 Å²	36.6	37%	0.374	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	28.5	-175.7	-41.5	-60.8	0	0	0	115.2	K92 G122 I148	K92-D124 VanDerWaalsContact NZ-CA 3.3Å; K92-D124 VanDerWaalsContact NZ-N 3.19Å; K92-D124 PolarHBondContact NZ-O 3.38Å; G122-D124 PolarHBondContact O-N 3.32Å; D124-I148 VanDerWaalsContact CA-CD1 3.46Å; D124-I148 HydrophobicContact CB-CD1 3.99Å
125	L	76.4	Confident	76.8	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	126.2	178.8	-169.3	71.5	0	0	0	110.1	T104 F121 G122 V123 A127 L128 L146 I148 L149	T104-L125 WeakPolarHBondContact OG1-CD1 3.36Å; F121-L125 HydrophobicContact CB-CD2 4.42Å; F121-L125 HydrophobicContact CD1-CD2 3.91Å; F121-L125 HydrophobicContact CG-CD2 4.4Å; G122-L125 PolarHBondContact O-N 3.07Å; V123-L125 VanDerWaalsContact C-N 3.34Å; V123-L125 PolarHBondContact O-N 2.93Å; L125-A127 WeakPolarHBondContact CD1-O 3.5Å; L125-L128 HydrophobicContact CD2-CB 3.88Å; L125-L128 HydrophobicContact CD2-CD1 4.12Å; L125-L128 HydrophobicContact CD2-CD2 4.45Å; L125-L128 HydrophobicContact CD2-CG 4.37Å; L125-L146 HydrophobicContact CB-CD2 3.96Å; L125-L146 HydrophobicContact CD2-CD2 4.1Å; L125-I148 CarbonylContact O-C 3.44Å; L125-L149 HydrophobicContact CD2-CD1 4.23Å; L125-L149 HydrophobicContact CG-CD1 4.17Å; L125-L149 VanDerWaalsContact O-CA 3.31Å; L125-L149 WeakPolarHBondContact O-CA 3.19Å; L125-L149 PolarHBondContact O-N 3.33Å
126	I	84.4	Confident	77.5	Confident	23 Å²	23	36.6 Å²	36.6	12%	0.118	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-30.8	-176.5	-69.8	172	0	0	0	111.4	H101 G102 I148 N150 Q151	H101-I126 HydrophobicContact CB-CB 4.44Å; H101-I126 HydrophobicContact CB-CD1 3.41Å; H101-I126 VanDerWaalsContact CB-CD1 3.41Å; H101-I126 HydrophobicContact CB-CG1 4.45Å; H101-I126 VanDerWaalsContact CD2-CD1 3.42Å; H101-I126 WeakPolarHBondContact CD2-CD1 3.31Å; G102-I126 PolarHBondContact O-N 3.4Å; I126-I148 HydrophobicContact CD1-CD1 4.07Å; I126-I148 HydrophobicContact CG1-CD1 3.77Å; I126-I148 HydrophobicContact CG1-CG1 4.01Å; I126-N150 HydrophobicContact CG2-CB 3.9Å; I126-N150 PolarHBondContact O-N 3.42Å; I126-Q151 PolarHBondContact O-N 2.94Å
127	A	86.8	Confident	78.3	Confident	21 Å²	21	36.2 Å²	36.2	17%	0.174	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	133.3	175.1	0	0	0	0	0	111.7	G102 A103 T104 L125 Q151	G102-A127 PolarHBondContact O-N 3.17Å; G102-A127 VanDerWaalsContact O-N 3.16Å; A103-A127 WeakPolarHBondContact CA-O 3.29Å; A103-A127 HydrophobicContact CB-CB 4.04Å; T104-A127 PolarHBondContact N-O 3.35Å; L125-A127 WeakPolarHBondContact CD1-O 3.5Å; A127-Q151 WeakPolarHBondContact CA-O 3.38Å; A127-Q151 HydrophobicContact CB-CB 3.99Å
128	L	89.7	Confident	80.1	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	119.1	176.1	179.2	58.5	0	0	0	110	T104 F121 L125 L130 F143 L146 L149 Q151 L152 D153	T104-L128 HydrophobicContact CG2-CD1 4.4Å; T104-L128 WeakPolarHBondContact O-CA 3.22Å; F121-L128 HydrophobicContact CD1-CD1 4.27Å; F121-L128 HydrophobicContact CE1-CD1 3.53Å; F121-L128 HydrophobicContact CE1-CD2 4.18Å; F121-L128 HydrophobicContact CE2-CD2 4.26Å; F121-L128 HydrophobicContact CZ-CD1 3.9Å; F121-L128 HydrophobicContact CZ-CD2 3.96Å; L125-L128 HydrophobicContact CD2-CB 3.88Å; L125-L128 HydrophobicContact CD2-CD1 4.12Å; L125-L128 HydrophobicContact CD2-CD2 4.45Å; L125-L128 HydrophobicContact CD2-CG 4.37Å; L128-L130 HydrophobicContact CD1-CD1 4.37Å; L128-L130 HydrophobicContact CD1-CG 4.17Å; L128-L130 HydrophobicContact CD2-CD1 3.87Å; L128-L130 HydrophobicContact CG-CD1 4.06Å; L128-L130 HydrophobicContact CG-CG 4.18Å; L128-F143 HydrophobicContact CD2-CE1 4.16Å; L128-L146 HydrophobicContact CD2-CD1 4.09Å; L128-L149 HydrophobicContact CB-CD1 3.84Å; L128-Q151 PolarHBondContact N-O 3.43Å; L128-L152 HydrophobicContact CB-CD1 4.21Å; L128-L152 HydrophobicContact CD2-CD1 4.14Å; L128-L152 HydrophobicContact CG-CD1 4.24Å; L128-L152 WeakPolarHBondContact O-CA 3.3Å; L128-D153 PolarHBondContact O-N 3.16Å
129	A	91.5	Very high	81.8	Confident	20 Å²	20	35.7 Å²	35.7	17%	0.165	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.9	172	0	0	0	0	0	110.1	T104 D105 L106 D153	T104-A129 PolarHBondContact O-N 2.85Å; D105-A129 HydrophobicContact CB-CB 4.48Å; L106-A129 WeakPolarHBondContact CA-O 3.21Å; L106-A129 PolarHBondContact N-O 3.25Å; A129-D153 HydrophobicContact CB-CB 4.35Å
130	L	92.5	Very high	83.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.218	C	C	.	.			trans	-130.8	13.4	179.9	-81.9	167.6	0	0	0	110.8	L106 I111 L114 L128 N133 D153 L154	L106-L130 HydrophobicContact CB-CD2 3.89Å; L106-L130 HydrophobicContact CD1-CD2 4Å; I111-L130 HydrophobicContact CD1-CD2 3.91Å; L114-L130 HydrophobicContact CD1-CD1 3.9Å; L114-L130 HydrophobicContact CD2-CD1 4.38Å; L128-L130 HydrophobicContact CD1-CD1 4.37Å; L128-L130 HydrophobicContact CD1-CG 4.17Å; L128-L130 HydrophobicContact CD2-CD1 3.87Å; L128-L130 HydrophobicContact CG-CD1 4.06Å; L128-L130 HydrophobicContact CG-CG 4.18Å; L130-N133 WeakPolarHBondContact O-CB 2.88Å; L130-N133 PolarHBondContact O-ND2 2.8Å; L130-N133 VanDerWaalsContact O-ND2 3.14Å; L130-D153 PolarHBondContact N-O 2.93Å; L130-L154 HydrophobicContact CB-CD2 3.76Å; L130-L154 HydrophobicContact CD1-CD2 3.92Å
131	D	93.9	Very high	85.2	Confident	24 Å²	24	37.4 Å²	37.4	13%	0.128	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	159.5	-178.2	60.9	-76.4	0	0	0	112.1	S107 G108 N133 S155	S107-D131 CarbonylContact C-O 3.57Å; S107-D131 WeakPolarHBondContact CA-O 3.49Å; S107-D131 VanDerWaalsContact CB-OD1 3.23Å; S107-D131 WeakPolarHBondContact CB-OD1 3.12Å; S107-D131 WeakPolarHBondContact CB-OD2 3.35Å; G108-D131 PolarHBondContact N-O 3.4Å; D131-N133 PolarHBondContact O-N 3.2Å; D131-N133 VanDerWaalsContact O-N 3.11Å; D131-N133 PolarHBondContact O-ND2 3.08Å; D131-N133 VanDerWaalsContact O-ND2 3.14Å; D131-S155 CarbonylContact C-O 3.54Å; D131-S155 WeakPolarHBondContact CA-O 3.44Å; D131-S155 VanDerWaalsContact CB-O 3.25Å; D131-S155 WeakPolarHBondContact CB-O 3.37Å
132	N	96.4	Very high	86.5	Confident	86 Å²	86	37.3 Å²	37.3	46%	0.46	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	25.7	-179.7	-63.3	-67.3	0	0	0	114.6	S155 F156	N132-S155 PolarHBondContact N-O 3.09Å; N132-F156 WeakPolarHBondContact OD1-CB 3.31Å
133	N	94.7	Very high	87.8	Confident	3 Å²	3	37 Å²	37	2%	0.016	22%	0.215	C	C	.	.	S	Bend	trans	-102.7	149.9	170.4	-81.4	-90.9	0	0	0	111.2	L106 N109 K110 I111 L130 D131 L135	L106-N133 PolarHBondContact O-ND2 2.84Å; N109-N133 VanDerWaalsContact CA-OD1 3.27Å; N109-N133 WeakPolarHBondContact CA-OD1 3.33Å; N109-N133 WeakPolarHBondContact CB-OD1 3.4Å; N109-N133 PolarHBondContact N-OD1 3.26Å; N109-N133 PolarHBondContact O-OD1 2.91Å; N109-N133 VanDerWaalsContact O-OD1 3.1Å; K110-N133 PolarHBondContact N-OD1 3.26Å; I111-N133 HydrophobicContact CB-CB 4.31Å; I111-N133 VanDerWaalsContact CB-OD1 3.31Å; I111-N133 WeakPolarHBondContact CB-OD1 3.12Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.32Å; I111-N133 PolarHBondContact N-OD1 2.87Å; L130-N133 WeakPolarHBondContact O-CB 2.88Å; L130-N133 PolarHBondContact O-ND2 2.8Å; L130-N133 VanDerWaalsContact O-ND2 3.14Å; D131-N133 PolarHBondContact O-N 3.2Å; D131-N133 VanDerWaalsContact O-N 3.11Å; D131-N133 PolarHBondContact O-ND2 3.08Å; D131-N133 VanDerWaalsContact O-ND2 3.14Å; N133-L135 HydrophobicContact CB-CB 4.31Å; N133-L135 PolarHBondContact O-N 3.47Å
134	P	95.3	Very high	88.8	Confident	44 Å²	44	35.3 Å²	35.3	29%	0.286	21%	0.207	S	C	.	.			trans	-72.8	33.4	173.7	33.8	-36.9	0	0	0	113.2	N109 I111 K112 S136	N109-P134 WeakPolarHBondContact O-CD 3.41Å; I111-P134 CarbonylContact O-C 3.49Å; I111-P134 WeakPolarHBondContact O-CD 3.34Å; K112-P134 HydrophobicContact CG-CG 4.04Å; P134-S136 PolarHBondContact O-N 3.48Å
135	L	94.2	Very high	89.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.214	C	C	.	.			trans	-68.9	116.2	-174	178.2	63	0	0	0	110.5	I111 K112 L114 N133 V138 L154 T157 R158 I159	I111-L135 WeakPolarHBondContact O-CA 3.24Å; I111-L135 PolarHBondContact O-N 3.25Å; I111-L135 VanDerWaalsContact O-N 3.12Å; K112-L135 WeakPolarHBondContact O-CA 3.36Å; L114-L135 HydrophobicContact CD1-CD2 3.99Å; L114-L135 HydrophobicContact CD2-CD1 4.36Å; L114-L135 HydrophobicContact CG-CD1 3.75Å; L114-L135 HydrophobicContact CG-CD2 4.1Å; N133-L135 HydrophobicContact CB-CB 4.31Å; N133-L135 PolarHBondContact O-N 3.47Å; L135-V138 HydrophobicContact CD1-CG2 4.07Å; L135-V138 HydrophobicContact CD2-CG2 3.92Å; L135-V138 HydrophobicContact CG-CG2 4Å; L135-L154 HydrophobicContact CD2-CD2 4.01Å; L135-T157 HydrophobicContact CB-CG2 4.03Å; L135-T157 HydrophobicContact CD2-CG2 4.4Å; L135-R158 CarbonylContact O-C 3.35Å; L135-R158 VanDerWaalsContact O-CA 3.25Å; L135-R158 WeakPolarHBondContact O-CA 3.37Å; L135-R158 PolarHBondContact O-N 2.9Å; L135-I159 HydrophobicContact CD2-CG2 4.07Å; L135-I159 HydrophobicContact CG-CG2 3.9Å; L135-I159 PolarHBondContact O-N 2.72Å
136	S	93.4	Very high	89.4	Confident	42 Å²	42	38.4 Å²	38.4	29%	0.294	21%	0.213	S	C	.	.			trans	-118.9	-40.3	-177.8	53.4	0	0	0	0	113.1	K112 P134	K112-S136 PolarHBondContact O-N 3.01Å; K112-S136 PolarHBondContact O-OG 3.4Å; P134-S136 PolarHBondContact O-N 3.48Å
137	N	91	Very high	89.2	Confident	111 Å²	111	39.5 Å²	39.5	59%	0.594	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	112.5	-176.2	-65.9	-37.8	0	0	0	110.1	A113 L114	A113-N137 CarbonylContact C-O 3.48Å; A113-N137 WeakPolarHBondContact CA-O 3.2Å; A113-N137 HydrophobicContact CB-CB 4.08Å; L114-N137 PolarHBondContact N-O 3.01Å
138	V	91.2	Very high	89.1	Confident	26 Å²	26	40.8 Å²	40.8	16%	0.158	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119.7	173.4	-174.8	0	0	0	0	108.5	L114 L135 A142 F143 I159 P163	L114-V138 HydrophobicContact CB-CG1 4.06Å; L114-V138 HydrophobicContact CD1-CG1 3.94Å; L114-V138 HydrophobicContact CD1-CG2 4.19Å; L114-V138 HydrophobicContact CG-CG1 4.46Å; L114-V138 HydrophobicContact CG-CG2 4.41Å; L135-V138 HydrophobicContact CD1-CG2 4.07Å; L135-V138 HydrophobicContact CD2-CG2 3.92Å; L135-V138 HydrophobicContact CG-CG2 4Å; V138-A142 HydrophobicContact CG1-CB 3.72Å; V138-F143 HydrophobicContact CG1-CE2 4.05Å; V138-F143 HydrophobicContact CG1-CZ 4.16Å; V138-I159 HydrophobicContact CG2-CG2 3.58Å; V138-P163 HydrophobicContact CB-CG 4.19Å; V138-P163 HydrophobicContact CG1-CG 3.42Å; V138-P163 VanDerWaalsContact CG1-CG 3.42Å
139	H	91.2	Very high	88.9	Confident	67 Å²	67	40.6 Å²	40.6	31%	0.31	23%	0.228	S	C	.	.			trans	-62.1	141.7	178.7	-173.2	-84.8	0	0	0	110.6	L114 L141 A142	L114-H139 VanDerWaalsContact O-CB 3.22Å; L114-H139 WeakPolarHBondContact O-CB 3.33Å; L114-H139 PolarHBondContact O-N 2.96Å; H139-L141 PolarHBondContact ND1-N 2.91Å; H139-L141 VanDerWaalsContact ND1-N 3.19Å; H139-L141 PolarHBondContact O-N 3.35Å; H139-A142 HydrophobicContact CB-CB 4.4Å; H139-A142 VanDerWaalsContact O-CB 3.23Å; H139-A142 WeakPolarHBondContact O-CB 3.4Å; H139-A142 PolarHBondContact O-N 3.43Å
140	P	87.7	Confident	88.9	Confident	86 Å²	86	41.4 Å²	41.4	56%	0.558	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-24.5	-177	-30.3	36.1	0	0	0	116	P163	P140-P163 WeakPolarHBondContact O-CB 3.42Å
141	L	87.4	Confident	88.8	Confident	59 Å²	59	45.8 Å²	45.8	31%	0.309	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	12.1	-179.6	-59.9	175.5	0	0	0	113.7	K116 H139 F143 S144 E165	K116-L141 HydrophobicContact CD-CD1 4.33Å; K116-L141 HydrophobicContact CG-CB 4.35Å; H139-L141 PolarHBondContact ND1-N 2.91Å; H139-L141 VanDerWaalsContact ND1-N 3.19Å; H139-L141 PolarHBondContact O-N 3.35Å; L141-F143 VanDerWaalsContact C-N 3.25Å; L141-F143 PolarHBondContact O-N 2.91Å; L141-S144 WeakPolarHBondContact O-CB 3.48Å; L141-S144 PolarHBondContact O-N 3.2Å; L141-S144 VanDerWaalsContact O-N 3.16Å; L141-S144 PolarHBondContact O-OG 2.81Å; L141-E165 HydrophobicContact CD2-CB 4.17Å; L141-E165 HydrophobicContact CD2-CG 4.07Å
142	A	86.1	Confident	88.8	Confident	3 Å²	3	44.8 Å²	44.8	3%	0.025	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-35.3	-175.5	0	0	0	0	0	113.1	L114 V138 H139	L114-A142 HydrophobicContact CB-CB 3.98Å; V138-A142 HydrophobicContact CG1-CB 3.72Å; H139-A142 HydrophobicContact CB-CB 4.4Å; H139-A142 VanDerWaalsContact O-CB 3.23Å; H139-A142 WeakPolarHBondContact O-CB 3.4Å; H139-A142 PolarHBondContact O-N 3.43Å
143	F	86.2	Confident	88.7	Confident	1 Å²	1	42.6 Å²	42.6	0%	0.004	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	5.5	-179.7	-53.5	-51.6	0	0	0	113.8	L114 L128 V138 L141 R145 L146 L152 L154 P163 E165 G166 L167	L114-F143 HydrophobicContact CD1-CE1 3.71Å; L114-F143 HydrophobicContact CD1-CZ 3.7Å; L128-F143 HydrophobicContact CD2-CE1 4.16Å; V138-F143 HydrophobicContact CG1-CE2 4.05Å; V138-F143 HydrophobicContact CG1-CZ 4.16Å; L141-F143 VanDerWaalsContact C-N 3.25Å; L141-F143 PolarHBondContact O-N 2.91Å; F143-R145 PolarHBondContact O-N 3.3Å; F143-L146 HydrophobicContact CB-CD1 4.14Å; F143-L146 HydrophobicContact CD1-CD1 3.71Å; F143-L146 HydrophobicContact CG-CD1 4.35Å; F143-L146 WeakPolarHBondContact O-CB 3.34Å; F143-L146 PolarHBondContact O-N 3.15Å; F143-L152 HydrophobicContact CE2-CD2 4.39Å; F143-L154 HydrophobicContact CZ-CD1 4.45Å; F143-P163 HydrophobicContact CD2-CG 3.86Å; F143-P163 HydrophobicContact CE2-CG 3.81Å; F143-E165 CarbonylContact C-O 3.44Å; F143-G166 WeakPolarHBondContact O-CA 3.21Å; F143-L167 HydrophobicContact CB-CD2 3.88Å; F143-L167 HydrophobicContact CB-CG 4.28Å; F143-L167 HydrophobicContact CD2-CD1 4.14Å; F143-L167 HydrophobicContact CD2-CD2 4.21Å; F143-L167 HydrophobicContact CD2-CG 4.34Å; F143-L167 HydrophobicContact CG-CD2 4.13Å
144	S	84.6	Confident	88.7	Confident	47 Å²	47	42.5 Å²	42.5	33%	0.329	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.8	-168.5	59.6	0	0	0	0	115.3	L141 E165	L141-S144 WeakPolarHBondContact O-CB 3.48Å; L141-S144 PolarHBondContact O-N 3.2Å; L141-S144 VanDerWaalsContact O-N 3.16Å; L141-S144 PolarHBondContact O-OG 2.81Å; S144-E165 WeakPolarHBondContact CA-O 3.24Å; S144-E165 PolarHBondContact N-O 3.38Å
145	R	79.2	Confident	88.8	Confident	137 Å²	137	40.7 Å²	40.7	52%	0.517	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-6.7	177.4	-73.5	-171.5	177.3	-170.9	-6.2	115	N119 F143 A147	N119-R145 VanDerWaalsContact CG-CD 3.41Å; N119-R145 PolarHBondContact ND2-NE 3.24Å; N119-R145 WeakPolarHBondContact OD1-CD 3.41Å; N119-R145 VanDerWaalsContact OD1-CG 3.27Å; N119-R145 WeakPolarHBondContact OD1-CG 3.31Å; F143-R145 PolarHBondContact O-N 3.3Å; R145-A147 PolarHBondContact O-N 3.42Å
146	L	80.6	Confident	88.9	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.246	C	C	.	.			trans	-83.8	49.4	-174.9	-64.7	-175.5	0	0	0	112.4	F121 L125 L128 F143 I148 L149	F121-L146 HydrophobicContact CB-CD2 3.52Å; F121-L146 HydrophobicContact CB-CG 4.44Å; F121-L146 HydrophobicContact CG-CD2 4.3Å; L125-L146 HydrophobicContact CB-CD2 3.96Å; L125-L146 HydrophobicContact CD2-CD2 4.1Å; L128-L146 HydrophobicContact CD2-CD1 4.09Å; F143-L146 HydrophobicContact CB-CD1 4.14Å; F143-L146 HydrophobicContact CD1-CD1 3.71Å; F143-L146 HydrophobicContact CG-CD1 4.35Å; F143-L146 WeakPolarHBondContact O-CB 3.34Å; F143-L146 PolarHBondContact O-N 3.15Å; L146-I148 PolarHBondContact O-N 2.94Å; L146-L149 HydrophobicContact CB-CB 3.93Å; L146-L149 HydrophobicContact CB-CD2 4.42Å; L146-L149 HydrophobicContact CD1-CD1 4.49Å; L146-L149 HydrophobicContact CD1-CD2 3.93Å; L146-L149 WeakPolarHBondContact O-CB 3.36Å; L146-L149 PolarHBondContact O-N 3.13Å
147	A	79.9	Confident	89	Confident	46 Å²	46	44.6 Å²	44.6	38%	0.38	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-14	-168.1	0	0	0	0	0	115.3	R145 K169	R145-A147 PolarHBondContact O-N 3.42Å; A147-K169 VanDerWaalsContact O-CD 3.28Å; A147-K169 WeakPolarHBondContact O-CD 3.35Å; A147-K169 WeakPolarHBondContact O-CG 3.17Å
148	I	83.6	Confident	89.3	Confident	48 Å²	48	47.4 Å²	47.4	25%	0.246	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	14.3	176.5	72.7	167.6	0	0	0	113.9	D124 L125 I126 L146 N150	D124-I148 VanDerWaalsContact CA-CD1 3.46Å; D124-I148 HydrophobicContact CB-CD1 3.99Å; L125-I148 CarbonylContact O-C 3.44Å; I126-I148 HydrophobicContact CD1-CD1 4.07Å; I126-I148 HydrophobicContact CG1-CD1 3.77Å; I126-I148 HydrophobicContact CG1-CG1 4.01Å; L146-I148 PolarHBondContact O-N 2.94Å; I148-N150 PolarHBondContact O-N 3.39Å; I148-N150 PolarHBondContact O-OD1 3.32Å; I148-N150 VanDerWaalsContact O-OD1 3.14Å
149	L	87.1	Confident	89.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.228	C	C	.	.			trans	-67.8	118.6	178.8	-169.8	79.1	0	0	0	110.3	L125 L128 L146 L152 L167 K169 L170	L125-L149 HydrophobicContact CD2-CD1 4.23Å; L125-L149 HydrophobicContact CG-CD1 4.17Å; L125-L149 VanDerWaalsContact O-CA 3.31Å; L125-L149 WeakPolarHBondContact O-CA 3.19Å; L125-L149 PolarHBondContact O-N 3.33Å; L128-L149 HydrophobicContact CB-CD1 3.84Å; L146-L149 HydrophobicContact CB-CB 3.93Å; L146-L149 HydrophobicContact CB-CD2 4.42Å; L146-L149 HydrophobicContact CD1-CD1 4.49Å; L146-L149 HydrophobicContact CD1-CD2 3.93Å; L146-L149 WeakPolarHBondContact O-CB 3.36Å; L146-L149 PolarHBondContact O-N 3.13Å; L149-L152 HydrophobicContact CD2-CB 4.12Å; L149-L152 HydrophobicContact CD2-CD1 4.37Å; L149-L167 HydrophobicContact CD2-CD2 3.79Å; L149-K169 CarbonylContact O-C 3.58Å; L149-L170 HydrophobicContact CD2-CD1 4.16Å; L149-L170 HydrophobicContact CG-CD1 4.27Å; L149-L170 VanDerWaalsContact O-CA 3.29Å; L149-L170 WeakPolarHBondContact O-CA 2.97Å; L149-L170 PolarHBondContact O-N 2.92Å
150	N	90.2	Very high	89.5	Confident	37 Å²	37	47.2 Å²	47.2	20%	0.198	24%	0.239	C	C	.	.			trans	-98.6	-33	178	-68.5	1.3	0	0	0	111.5	I126 I148 L170 E171 Q172	I126-N150 HydrophobicContact CG2-CB 3.9Å; I126-N150 PolarHBondContact O-N 3.42Å; I148-N150 PolarHBondContact O-N 3.39Å; I148-N150 PolarHBondContact O-OD1 3.32Å; I148-N150 VanDerWaalsContact O-OD1 3.14Å; N150-L170 WeakPolarHBondContact O-CD1 3.25Å; N150-E171 HydrophobicContact CB-CB 4.42Å; N150-E171 HydrophobicContact CB-CG 4.28Å; N150-E171 PolarHBondContact O-N 3.47Å; N150-Q172 PolarHBondContact O-N 3.36Å
151	Q	91.3	Very high	89.7	Confident	93 Å²	93	47.9 Å²	47.9	44%	0.435	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.7	-175.4	-53.1	-171	3.1	0	0	111.7	I126 A127 L128 Q172	I126-Q151 PolarHBondContact O-N 2.94Å; A127-Q151 WeakPolarHBondContact CA-O 3.38Å; A127-Q151 HydrophobicContact CB-CB 3.99Å; L128-Q151 PolarHBondContact N-O 3.43Å; Q151-Q172 WeakPolarHBondContact CA-O 3.42Å; Q151-Q172 HydrophobicContact CG-CB 4.19Å
152	L	93.1	Very high	89.9	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	120.3	176.9	179.1	60.4	0	0	0	110.3	L128 F143 L149 L154 L167 L170 Q172 I173 V174	L128-L152 HydrophobicContact CB-CD1 4.21Å; L128-L152 HydrophobicContact CD2-CD1 4.14Å; L128-L152 HydrophobicContact CG-CD1 4.24Å; L128-L152 WeakPolarHBondContact O-CA 3.3Å; F143-L152 HydrophobicContact CE2-CD2 4.39Å; L149-L152 HydrophobicContact CD2-CB 4.12Å; L149-L152 HydrophobicContact CD2-CD1 4.37Å; L152-L154 HydrophobicContact CD1-CD1 4.26Å; L152-L154 HydrophobicContact CD1-CD2 4.31Å; L152-L154 HydrophobicContact CD1-CG 3.99Å; L152-L154 HydrophobicContact CD2-CD1 3.87Å; L152-L154 HydrophobicContact CD2-CG 4.42Å; L152-L154 HydrophobicContact CG-CD1 4.03Å; L152-L154 HydrophobicContact CG-CG 4.02Å; L152-L167 HydrophobicContact CD2-CD1 3.97Å; L152-L167 HydrophobicContact CD2-CD2 4.09Å; L152-L170 HydrophobicContact CB-CD1 3.67Å; L152-L170 HydrophobicContact CB-CD2 4.37Å; L152-Q172 PolarHBondContact N-O 3.18Å; L152-I173 WeakPolarHBondContact O-CA 3.05Å; L152-V174 PolarHBondContact O-N 2.95Å
153	D	94.2	Very high	90.2	Very high	41 Å²	41	45.8 Å²	45.8	22%	0.219	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.5	171.6	-156.3	-27.8	0	0	0	110.8	L128 A129 L130 S155 V174	L128-D153 PolarHBondContact O-N 3.16Å; A129-D153 HydrophobicContact CB-CB 4.35Å; L130-D153 PolarHBondContact N-O 2.93Å; D153-S155 WeakPolarHBondContact OD1-CB 3.46Å; D153-S155 PolarHBondContact OD1-N 3.45Å; D153-S155 PolarHBondContact OD1-OG 3.3Å; D153-V174 HydrophobicContact CB-CB 4.23Å
154	L	95.8	Very high	90.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.			trans	-125.6	24.7	176.4	-65.5	169.1	0	0	0	110.3	L130 L135 F143 L152 T157 I159 L162 V174 L175 V178	L130-L154 HydrophobicContact CB-CD2 3.76Å; L130-L154 HydrophobicContact CD1-CD2 3.92Å; L135-L154 HydrophobicContact CD2-CD2 4.01Å; F143-L154 HydrophobicContact CZ-CD1 4.45Å; L152-L154 HydrophobicContact CD1-CD1 4.26Å; L152-L154 HydrophobicContact CD1-CD2 4.31Å; L152-L154 HydrophobicContact CD1-CG 3.99Å; L152-L154 HydrophobicContact CD2-CD1 3.87Å; L152-L154 HydrophobicContact CD2-CG 4.42Å; L152-L154 HydrophobicContact CG-CD1 4.03Å; L152-L154 HydrophobicContact CG-CG 4.02Å; L154-T157 HydrophobicContact CB-CG2 4.41Å; L154-T157 WeakPolarHBondContact O-CB 3.49Å; L154-T157 VanDerWaalsContact O-CG2 3.23Å; L154-T157 WeakPolarHBondContact O-CG2 3.3Å; L154-T157 PolarHBondContact O-N 2.87Å; L154-T157 PolarHBondContact O-OG1 3.38Å; L154-I159 HydrophobicContact CD1-CD1 3.99Å; L154-L162 HydrophobicContact CD1-CD1 3.83Å; L154-V174 PolarHBondContact N-O 3.02Å; L154-L175 HydrophobicContact CB-CD2 3.8Å; L154-L175 HydrophobicContact CD1-CD2 4.22Å; L154-V178 WeakPolarHBondContact O-CG2 3.46Å
155	S	96.5	Very high	90.3	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.042	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	146.2	-178.5	-58.7	0	0	0	0	111.9	D131 N132 D153 T157 V174 R176	D131-S155 CarbonylContact C-O 3.54Å; D131-S155 WeakPolarHBondContact CA-O 3.44Å; D131-S155 VanDerWaalsContact CB-O 3.25Å; D131-S155 WeakPolarHBondContact CB-O 3.37Å; N132-S155 PolarHBondContact N-O 3.09Å; D153-S155 WeakPolarHBondContact OD1-CB 3.46Å; D153-S155 PolarHBondContact OD1-N 3.45Å; D153-S155 PolarHBondContact OD1-OG 3.3Å; S155-T157 PolarHBondContact O-N 3.04Å; S155-V174 WeakPolarHBondContact OG-CG1 3.14Å; S155-R176 CarbonylContact C-O 3.16Å; S155-R176 WeakPolarHBondContact CA-O 3.3Å; S155-R176 WeakPolarHBondContact CB-O 3.24Å; S155-R176 PolarHBondContact OG-N 2.92Å
156	F	96.4	Very high	90.5	Very high	120 Å²	120	43 Å²	43	53%	0.526	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	24	179.2	-52.1	-76.6	0	0	0	114.2	N132 R176	N132-F156 WeakPolarHBondContact OD1-CB 3.31Å; F156-R176 PolarHBondContact N-O 3Å
157	T	96.7	Very high	90.8	Very high	4 Å²	4	43 Å²	43	3%	0.025	22%	0.221	C	C	.	.			trans	-89.6	175.7	168	65.8	0	0	0	0	111.2	L135 L154 S155	L135-T157 HydrophobicContact CB-CG2 4.03Å; L135-T157 HydrophobicContact CD2-CG2 4.4Å; L154-T157 HydrophobicContact CB-CG2 4.41Å; L154-T157 WeakPolarHBondContact O-CB 3.49Å; L154-T157 VanDerWaalsContact O-CG2 3.23Å; L154-T157 WeakPolarHBondContact O-CG2 3.3Å; L154-T157 PolarHBondContact O-N 2.87Å; L154-T157 PolarHBondContact O-OG1 3.38Å; S155-T157 PolarHBondContact O-N 3.04Å
158	R	95.8	Very high	91.1	Very high	171 Å²	171	44.8 Å²	44.8	65%	0.645	22%	0.222	S	C	*	.			trans	-115.6	24.6	-178	-58.3	-177.6	-175.8	-178.3	1.5	112.6	L135 S180	L135-R158 CarbonylContact O-C 3.35Å; L135-R158 VanDerWaalsContact O-CA 3.25Å; L135-R158 WeakPolarHBondContact O-CA 3.37Å; L135-R158 PolarHBondContact O-N 2.9Å; R158-S180 WeakPolarHBondContact CA-OG 3.49Å; R158-S180 PolarHBondContact O-OG 3.37Å
159	I	95.3	Very high	91.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.231	C	C	.	.			trans	-65.2	141.7	179.9	64.8	166.4	0	0	0	110.7	L135 V138 L154 L162 L175 V178 S180 L181	L135-I159 HydrophobicContact CD2-CG2 4.07Å; L135-I159 HydrophobicContact CG-CG2 3.9Å; L135-I159 PolarHBondContact O-N 2.72Å; V138-I159 HydrophobicContact CG2-CG2 3.58Å; L154-I159 HydrophobicContact CD1-CD1 3.99Å; I159-L162 HydrophobicContact CD1-CD1 4.46Å; I159-L175 HydrophobicContact CD1-CD2 4.16Å; I159-V178 HydrophobicContact CD1-CG1 4.38Å; I159-V178 HydrophobicContact CG1-CG1 3.54Å; I159-S180 PolarHBondContact N-OG 3.21Å; I159-S180 CarbonylContact O-C 3.53Å; I159-S180 WeakPolarHBondContact O-CB 3.47Å; I159-S180 PolarHBondContact O-OG 3.24Å; I159-L181 HydrophobicContact CD1-CD2 4.49Å; I159-L181 PolarHBondContact O-N 2.93Å
160	T	92.6	Very high	91.5	Very high	88 Å²	88	47.3 Å²	47.3	54%	0.54	23%	0.231	S	C	.	.	S	Bend	trans	-103.4	-21.7	177.9	54	0	0	0	0	112.5	L181	T160-L181 WeakPolarHBondContact O-CD1 3.32Å
161	V	91.8	Very high	91.6	Very high	100 Å²	100	48.5 Å²	48.5	61%	0.606	24%	0.235	S	C	*	.			trans	-138.7	135.4	-179.7	-179.2	0	0	0	0	108.3	P163	V161-P163 WeakPolarHBondContact O-CD 3.24Å
162	L	91.8	Very high	91.7	Very high	6 Å²	6	46.2 Å²	46.2	3%	0.031	22%	0.224	C	C	.	.			trans	-95.3	109.8	171.3	177.6	67.9	0	0	0	109.1	L154 I159 L167 I173 L175 L181 P185 F190	L154-L162 HydrophobicContact CD1-CD1 3.83Å; I159-L162 HydrophobicContact CD1-CD1 4.46Å; L162-L167 HydrophobicContact CD1-CD1 4.4Å; L162-I173 HydrophobicContact CD1-CD1 4.39Å; L162-I173 HydrophobicContact CD2-CD1 3.47Å; L162-I173 VanDerWaalsContact CD2-CD1 3.47Å; L162-L175 HydrophobicContact CD2-CD1 4.28Å; L162-L181 HydrophobicContact CB-CD1 4.49Å; L162-P185 HydrophobicContact CB-CG 4.36Å; L162-P185 HydrophobicContact CD2-CG 4.15Å; L162-F190 HydrophobicContact CD2-CE1 4.45Å; L162-F190 HydrophobicContact CD2-CZ 3.83Å
163	P	90.9	Very high	91.8	Very high	12 Å²	12	46.4 Å²	46.4	8%	0.078	23%	0.225	C	C	.	.			trans	-71.4	136.4	173.6	26.9	-29.4	0	0	0	110.7	V138 P140 F143 V161 L167	V138-P163 HydrophobicContact CB-CG 4.19Å; V138-P163 HydrophobicContact CG1-CG 3.42Å; V138-P163 VanDerWaalsContact CG1-CG 3.42Å; P140-P163 WeakPolarHBondContact O-CB 3.42Å; F143-P163 HydrophobicContact CD2-CG 3.86Å; F143-P163 HydrophobicContact CE2-CG 3.81Å; V161-P163 WeakPolarHBondContact O-CD 3.24Å; P163-L167 VanDerWaalsContact O-CD1 3.22Å; P163-L167 WeakPolarHBondContact O-CD1 3.5Å
164	T	87.2	Confident	91.9	Very high	25 Å²	25	44.7 Å²	44.7	15%	0.153	22%	0.216	C	C	.	.			trans	-103.9	-13.3	-172	53.2	0	0	0	0	114.3	G166 L167 P185 V189 F190	T164-G166 PolarHBondContact O-N 3.07Å; T164-L167 PolarHBondContact O-N 3.13Å; T164-P185 HydrophobicContact CG2-CB 3.5Å; T164-P185 VanDerWaalsContact CG2-CB 3.5Å; T164-P185 HydrophobicContact CG2-CG 3.46Å; T164-P185 VanDerWaalsContact CG2-CG 3.46Å; T164-V189 HydrophobicContact CG2-CB 4.42Å; T164-V189 HydrophobicContact CG2-CG1 4.19Å; T164-F190 HydrophobicContact CG2-CE1 4.33Å; T164-F190 HydrophobicContact CG2-CZ 3.95Å
165	E	86.7	Confident	91.9	Very high	98 Å²	98	44.8 Å²	44.8	46%	0.458	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	118.9	-179.7	-66.4	-56.1	135.7	0	0	110.7	L141 F143 S144	L141-E165 HydrophobicContact CD2-CB 4.17Å; L141-E165 HydrophobicContact CD2-CG 4.07Å; F143-E165 CarbonylContact C-O 3.44Å; S144-E165 WeakPolarHBondContact CA-O 3.24Å; S144-E165 PolarHBondContact N-O 3.38Å
166	G	83.2	Confident	91.8	Very high	4 Å²	4	49.7 Å²	49.7	4%	0.041	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.8	-6.2	-176.9	0	0	0	0	0	115.2	F143 T164 Q168	F143-G166 WeakPolarHBondContact O-CA 3.21Å; T164-G166 PolarHBondContact O-N 3.07Å; G166-Q168 VanDerWaalsContact C-N 3.34Å; G166-Q168 PolarHBondContact O-N 3.44Å
167	L	87.6	Confident	91.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.			trans	-92.4	21.7	-179.3	-57.9	-174.9	0	0	0	113.7	F143 L149 L152 L162 P163 T164 K169 L170 F190	F143-L167 HydrophobicContact CB-CD2 3.88Å; F143-L167 HydrophobicContact CB-CG 4.28Å; F143-L167 HydrophobicContact CD2-CD1 4.14Å; F143-L167 HydrophobicContact CD2-CD2 4.21Å; F143-L167 HydrophobicContact CD2-CG 4.34Å; F143-L167 HydrophobicContact CG-CD2 4.13Å; L149-L167 HydrophobicContact CD2-CD2 3.79Å; L152-L167 HydrophobicContact CD2-CD1 3.97Å; L152-L167 HydrophobicContact CD2-CD2 4.09Å; L162-L167 HydrophobicContact CD1-CD1 4.4Å; P163-L167 VanDerWaalsContact O-CD1 3.22Å; P163-L167 WeakPolarHBondContact O-CD1 3.5Å; T164-L167 PolarHBondContact O-N 3.13Å; L167-K169 VanDerWaalsContact C-N 3.31Å; L167-K169 PolarHBondContact O-N 2.8Å; L167-L170 HydrophobicContact CB-CB 4.42Å; L167-L170 VanDerWaalsContact O-CB 3.28Å; L167-L170 WeakPolarHBondContact O-CB 3.22Å; L167-L170 PolarHBondContact O-N 3.32Å; L167-F190 HydrophobicContact CB-CE1 4.25Å; L167-F190 HydrophobicContact CD1-CE1 4.3Å
168	Q	85	Confident	91.6	Very high	84 Å²	84	44.8 Å²	44.8	39%	0.393	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-25.8	-172	-54.8	92.1	-3.3	0	0	113.7	G166	G166-Q168 VanDerWaalsContact C-N 3.34Å; G166-Q168 PolarHBondContact O-N 3.44Å
169	K	88.5	Confident	91.4	Very high	101 Å²	101	42.4 Å²	42.4	44%	0.439	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	3.6	177.6	-67.7	-159.7	-171	176.3	0	114.1	A147 L149 L167 E171	A147-K169 VanDerWaalsContact O-CD 3.28Å; A147-K169 WeakPolarHBondContact O-CD 3.35Å; A147-K169 WeakPolarHBondContact O-CG 3.17Å; L149-K169 CarbonylContact O-C 3.58Å; L167-K169 VanDerWaalsContact C-N 3.31Å; L167-K169 PolarHBondContact O-N 2.8Å; K169-E171 PolarHBondContact O-N 3.27Å
170	L	91	Very high	91.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.			trans	-60.9	122.3	-176.3	-164.1	73.3	0	0	0	110.9	L149 N150 L152 L167 I173 F190 N192 L193	L149-L170 HydrophobicContact CD2-CD1 4.16Å; L149-L170 HydrophobicContact CG-CD1 4.27Å; L149-L170 VanDerWaalsContact O-CA 3.29Å; L149-L170 WeakPolarHBondContact O-CA 2.97Å; L149-L170 PolarHBondContact O-N 2.92Å; N150-L170 WeakPolarHBondContact O-CD1 3.25Å; L152-L170 HydrophobicContact CB-CD1 3.67Å; L152-L170 HydrophobicContact CB-CD2 4.37Å; L167-L170 HydrophobicContact CB-CB 4.42Å; L167-L170 VanDerWaalsContact O-CB 3.28Å; L167-L170 WeakPolarHBondContact O-CB 3.22Å; L167-L170 PolarHBondContact O-N 3.32Å; L170-I173 HydrophobicContact CD2-CB 3.77Å; L170-I173 HydrophobicContact CD2-CD1 3.91Å; L170-I173 HydrophobicContact CD2-CG1 4.02Å; L170-F190 HydrophobicContact CD2-CD1 4.28Å; L170-F190 HydrophobicContact CD2-CE1 4.35Å; L170-N192 CarbonylContact O-C 3.56Å; L170-N192 VanDerWaalsContact O-C 3.26Å; L170-L193 HydrophobicContact CD2-CD1 4.38Å; L170-L193 HydrophobicContact CG-CD1 4.39Å; L170-L193 VanDerWaalsContact O-CA 3.28Å; L170-L193 WeakPolarHBondContact O-CA 3.28Å; L170-L193 PolarHBondContact O-N 3.44Å; L170-L193 VanDerWaalsContact O-N 3.14Å
171	E	92.7	Very high	91.3	Very high	63 Å²	63	40.3 Å²	40.3	29%	0.294	20%	0.203	S	C	.	.			trans	-99.4	-32.4	177.8	-62.2	-169.9	153.5	0	0	111.8	N150 K169 N192 R194 I195	N150-E171 HydrophobicContact CB-CB 4.42Å; N150-E171 HydrophobicContact CB-CG 4.28Å; N150-E171 PolarHBondContact O-N 3.47Å; K169-E171 PolarHBondContact O-N 3.27Å; E171-N192 WeakPolarHBondContact CA-O 3.47Å; E171-N192 HydrophobicContact CG-CB 4.46Å; E171-R194 PolarHBondContact O-N 3.03Å; E171-I195 PolarHBondContact O-N 3.48Å
172	Q	93.6	Very high	91.2	Very high	44 Å²	44	39.7 Å²	39.7	21%	0.206	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.5	-179.9	179.7	176.2	-28.5	0	0	111.2	N150 Q151 L152 V174 I195	N150-Q172 PolarHBondContact O-N 3.36Å; Q151-Q172 WeakPolarHBondContact CA-O 3.42Å; Q151-Q172 HydrophobicContact CG-CB 4.19Å; L152-Q172 PolarHBondContact N-O 3.18Å; Q172-V174 HydrophobicContact CG-CG2 4.2Å; Q172-I195 WeakPolarHBondContact CA-O 3.49Å; Q172-I195 HydrophobicContact CB-CB 4.3Å; Q172-I195 HydrophobicContact CG-CB 4.03Å; Q172-I195 HydrophobicContact CG-CG2 4.12Å
173	I	94.4	Very high	91	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.2	171.5	-162.8	170.6	0	0	0	111	L152 L162 L170 L175 L193 I195 A196 R197	L152-I173 WeakPolarHBondContact O-CA 3.05Å; L162-I173 HydrophobicContact CD1-CD1 4.39Å; L162-I173 HydrophobicContact CD2-CD1 3.47Å; L162-I173 VanDerWaalsContact CD2-CD1 3.47Å; L170-I173 HydrophobicContact CD2-CB 3.77Å; L170-I173 HydrophobicContact CD2-CD1 3.91Å; L170-I173 HydrophobicContact CD2-CG1 4.02Å; I173-L175 HydrophobicContact CD1-CD1 3.79Å; I173-L175 HydrophobicContact CD1-CG 4.21Å; I173-L175 HydrophobicContact CG1-CD1 4.13Å; I173-L175 HydrophobicContact CG1-CG 4.09Å; I173-L193 HydrophobicContact CB-CD1 4.26Å; I173-L193 HydrophobicContact CG2-CD1 3.96Å; I173-L193 HydrophobicContact CG2-CD2 4.33Å; I173-I195 PolarHBondContact N-O 2.94Å; I173-A196 HydrophobicContact CG2-CB 4.09Å; I173-R197 PolarHBondContact O-N 3.39Å
174	V	95.9	Very high	90.8	Very high	5 Å²	5	48 Å²	48	3%	0.03	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120.5	177.6	-164.7	0	0	0	0	109.4	L152 D153 L154 S155 Q172 R176 R197	L152-V174 PolarHBondContact O-N 2.95Å; D153-V174 HydrophobicContact CB-CB 4.23Å; L154-V174 PolarHBondContact N-O 3.02Å; S155-V174 WeakPolarHBondContact OG-CG1 3.14Å; Q172-V174 HydrophobicContact CG-CG2 4.2Å; V174-R176 HydrophobicContact CG1-CG 4.13Å; V174-R197 CarbonylContact C-O 3.25Å; V174-R197 WeakPolarHBondContact CA-O 3.44Å; V174-R197 HydrophobicContact CB-CB 4.31Å; V174-R197 HydrophobicContact CG1-CB 3.78Å; V174-R197 HydrophobicContact CG2-CB 4.33Å
175	L	96.2	Very high	90.7	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.016	23%	0.227	C	C	.	.			trans	-137.7	46	-174.1	-65.3	167.5	0	0	0	109.2	L154 I159 L162 I173 V178 L181 L184 R197 L198 T199	L154-L175 HydrophobicContact CB-CD2 3.8Å; L154-L175 HydrophobicContact CD1-CD2 4.22Å; I159-L175 HydrophobicContact CD1-CD2 4.16Å; L162-L175 HydrophobicContact CD2-CD1 4.28Å; I173-L175 HydrophobicContact CD1-CD1 3.79Å; I173-L175 HydrophobicContact CD1-CG 4.21Å; I173-L175 HydrophobicContact CG1-CD1 4.13Å; I173-L175 HydrophobicContact CG1-CG 4.09Å; L175-V178 HydrophobicContact CB-CG2 4.26Å; L175-V178 HydrophobicContact CD2-CG2 4.41Å; L175-L181 HydrophobicContact CD1-CD2 3.86Å; L175-L181 HydrophobicContact CD2-CD2 4.24Å; L175-L184 HydrophobicContact CD1-CD2 4.14Å; L175-R197 CarbonylContact C-O 3.56Å; L175-R197 PolarHBondContact N-O 3.37Å; L175-L198 HydrophobicContact CB-CD2 4.21Å; L175-L198 HydrophobicContact CD1-CD2 3.82Å; L175-L198 HydrophobicContact CG-CD2 4.47Å; L175-L198 CarbonylContact O-C 3.48Å; L175-T199 PolarHBondContact O-N 2.89Å; L175-T199 VanDerWaalsContact O-N 3.12Å; L175-T199 PolarHBondContact O-OG1 3.41Å
176	R	95.2	Very high	90.4	Very high	109 Å²	109	45.7 Å²	45.7	41%	0.411	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	139.3	179	-69.4	178.1	172.9	177.8	-3.4	110.3	S155 F156 V174 V178 R197	S155-R176 CarbonylContact C-O 3.16Å; S155-R176 WeakPolarHBondContact CA-O 3.3Å; S155-R176 WeakPolarHBondContact CB-O 3.24Å; S155-R176 PolarHBondContact OG-N 2.92Å; F156-R176 PolarHBondContact N-O 3Å; V174-R176 HydrophobicContact CG1-CG 4.13Å; R176-V178 PolarHBondContact O-N 2.95Å; R176-R197 HydrophobicContact CG-CB 4.35Å
177	G	93.3	Very high	90.5	Very high	20 Å²	20	45.9 Å²	45.9	21%	0.206	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	14	178.7	0	0	0	0	0	115.6	H179 T199	G177-H179 VanDerWaalsContact C-N 3.32Å; G177-H179 PolarHBondContact O-CD2 3.45Å; G177-H179 PolarHBondContact O-N 2.95Å; G177-T199 PolarHBondContact N-OG1 3.5Å
178	V	95.1	Very high	90.1	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	23%	0.228	C	C	.	.			trans	-90.6	64.8	178.2	-168	0	0	0	0	109.6	L154 I159 L175 R176 S180 L181 T199	L154-V178 WeakPolarHBondContact O-CG2 3.46Å; I159-V178 HydrophobicContact CD1-CG1 4.38Å; I159-V178 HydrophobicContact CG1-CG1 3.54Å; L175-V178 HydrophobicContact CB-CG2 4.26Å; L175-V178 HydrophobicContact CD2-CG2 4.41Å; R176-V178 PolarHBondContact O-N 2.95Å; V178-S180 PolarHBondContact O-N 2.87Å; V178-S180 VanDerWaalsContact O-N 3.16Å; V178-L181 HydrophobicContact CB-CB 4.41Å; V178-L181 HydrophobicContact CG1-CB 3.7Å; V178-L181 PolarHBondContact O-N 3.37Å; V178-L181 VanDerWaalsContact O-N 3.09Å; V178-T199 PolarHBondContact N-OG1 3.17Å
179	H	91.9	Very high	90	Very high	121 Å²	121	45.7 Å²	45.7	56%	0.56	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.1	-172.9	-61.5	-67.6	0	0	0	114.1	G177 L181 T199 Y200	G177-H179 VanDerWaalsContact C-N 3.32Å; G177-H179 PolarHBondContact O-CD2 3.45Å; G177-H179 PolarHBondContact O-N 2.95Å; H179-L181 VanDerWaalsContact C-N 3.31Å; H179-T199 WeakPolarHBondContact ND1-CG2 3.27Å; H179-Y200 WeakPolarHBondContact CA-OH 3.14Å; H179-Y200 PolarHBondContact O-OH 3.38Å
180	S	93	Very high	89.8	Confident	42 Å²	42	41.2 Å²	41.2	29%	0.294	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-23.2	176.1	48	0	0	0	0	113.6	R158 I159 V178 K182	R158-S180 WeakPolarHBondContact CA-OG 3.49Å; R158-S180 PolarHBondContact O-OG 3.37Å; I159-S180 PolarHBondContact N-OG 3.21Å; I159-S180 CarbonylContact O-C 3.53Å; I159-S180 WeakPolarHBondContact O-CB 3.47Å; I159-S180 PolarHBondContact O-OG 3.24Å; V178-S180 PolarHBondContact O-N 2.87Å; V178-S180 VanDerWaalsContact O-N 3.16Å; S180-K182 PolarHBondContact O-N 2.98Å; S180-K182 VanDerWaalsContact O-N 3.08Å
181	L	92.9	Very high	89.6	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.016	23%	0.229	C	C	.	.			trans	-82	87.1	178.7	-175	66.5	0	0	0	109.3	I159 T160 L162 L175 V178 H179 R183 L184 H203	I159-L181 HydrophobicContact CD1-CD2 4.49Å; I159-L181 PolarHBondContact O-N 2.93Å; T160-L181 WeakPolarHBondContact O-CD1 3.32Å; L162-L181 HydrophobicContact CB-CD1 4.49Å; L175-L181 HydrophobicContact CD1-CD2 3.86Å; L175-L181 HydrophobicContact CD2-CD2 4.24Å; V178-L181 HydrophobicContact CB-CB 4.41Å; V178-L181 HydrophobicContact CG1-CB 3.7Å; V178-L181 PolarHBondContact O-N 3.37Å; V178-L181 VanDerWaalsContact O-N 3.09Å; H179-L181 VanDerWaalsContact C-N 3.31Å; L181-R183 WeakPolarHBondContact CD1-O 3.38Å; L181-L184 HydrophobicContact CD2-CD2 4.13Å; L181-H203 PolarHBondContact O-CE1 3.09Å; L181-H203 VanDerWaalsContact O-CE1 3.31Å
182	K	89.7	Confident	89.5	Confident	87 Å²	87	47.8 Å²	47.8	38%	0.378	23%	0.234	S	C	.	.			trans	-76.4	-28	-177.3	-61	-169.4	164.1	-168.1	0	113.6	S180 H203 V383 D384	S180-K182 PolarHBondContact O-N 2.98Å; S180-K182 VanDerWaalsContact O-N 3.08Å; K182-H203 PolarHBondContact O-NE2 3.37Å; K182-H203 VanDerWaalsContact O-NE2 3.08Å; K182-V383 HydrophobicContact CB-CB 4.34Å; K182-V383 HydrophobicContact CB-CG1 4.11Å; K182-V383 HydrophobicContact CB-CG2 4.38Å; K182-V383 HydrophobicContact CD-CG1 4.22Å; K182-V383 HydrophobicContact CG-CG1 3.84Å; K182-V383 VanDerWaalsContact O-CG2 3.27Å; K182-V383 WeakPolarHBondContact O-CG2 3.17Å; K182-D384 WeakPolarHBondContact CD-OD1 3.28Å; K182-D384 IonicContact NZ-OD1 2.81Å; K182-D384 PolarHBondContact NZ-OD1 3.5Å
183	R	86.8	Confident	89.4	Confident	169 Å²	169	46 Å²	46	64%	0.638	23%	0.226	S	C	*	.			trans	-130.8	138.1	-175.1	-62.2	-178.7	-173.1	171	3.2	109.9	L181 D384	L181-R183 WeakPolarHBondContact CD1-O 3.38Å; R183-D384 IonicContact NH2-OD2 3.89Å
184	L	87.1	Confident	89.3	Confident	24 Å²	24	53.5 Å²	53.5	13%	0.126	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-85.3	149.5	168.3	-75	-175.5	0	0	0	110.8	L175 L181 L198 H203	L175-L184 HydrophobicContact CD1-CD2 4.14Å; L181-L184 HydrophobicContact CD2-CD2 4.13Å; L184-L198 HydrophobicContact CD1-CD1 3.87Å; L184-H203 HydrophobicContact CD1-CB 3.64Å; L184-H203 HydrophobicContact CG-CB 4.09Å
185	P	85.7	Confident	89.2	Confident	34 Å²	34	55.5 Å²	55.5	22%	0.221	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-65.3	169.2	165.4	29.8	-33.9	0	0	0	111.1	L162 T164 V187 F190	L162-P185 HydrophobicContact CB-CG 4.36Å; L162-P185 HydrophobicContact CD2-CG 4.15Å; T164-P185 HydrophobicContact CG2-CB 3.5Å; T164-P185 VanDerWaalsContact CG2-CB 3.5Å; T164-P185 HydrophobicContact CG2-CG 3.46Å; T164-P185 VanDerWaalsContact CG2-CG 3.46Å; P185-V187 PolarHBondContact O-N 3.27Å; P185-F190 HydrophobicContact CG-CE2 3.9Å; P185-F190 HydrophobicContact CG-CZ 3.77Å
186	A	80.3	Confident	89.2	Confident	39 Å²	39	55.3 Å²	55.3	32%	0.322	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-57.9	125.9	179.8	0	0	0	0	0	111.2	F188 V189	A186-F188 PolarHBondContact O-N 2.96Å; A186-F188 VanDerWaalsContact O-N 3.14Å; A186-V189 HydrophobicContact CB-CG2 4.44Å; A186-V189 WeakPolarHBondContact O-CG2 3.39Å; A186-V189 PolarHBondContact O-N 3.42Å; A186-V189 VanDerWaalsContact O-N 3.12Å
187	V	83.4	Confident	89.2	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.055	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-61.6	-25.3	-175.9	-66.4	0	0	0	0	113.3	P185 V189 F190 Y206 F207 L287	P185-V187 PolarHBondContact O-N 3.27Å; V187-V189 PolarHBondContact O-N 3.05Å; V187-V189 VanDerWaalsContact O-N 3.09Å; V187-F190 PolarHBondContact O-N 3.14Å; V187-Y206 HydrophobicContact CG1-CG 4.44Å; V187-F207 HydrophobicContact CB-CD1 4.42Å; V187-F207 HydrophobicContact CB-CE1 3.92Å; V187-F207 HydrophobicContact CB-CZ 4.36Å; V187-F207 HydrophobicContact CG1-CD1 4.2Å; V187-F207 HydrophobicContact CG1-CE1 3.66Å; V187-F207 HydrophobicContact CG1-CE2 4.18Å; V187-F207 HydrophobicContact CG1-CZ 3.65Å; V187-L287 HydrophobicContact CG2-CD1 4.32Å
188	F	80.3	Confident	89.3	Confident	33 Å²	33	54 Å²	54	15%	0.145	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.7	-15	177.5	-54.1	-64.8	0	0	0	114.2	A186 F190 V210 V214 I279 L287	A186-F188 PolarHBondContact O-N 2.96Å; A186-F188 VanDerWaalsContact O-N 3.14Å; F188-F190 VanDerWaalsContact C-N 3.31Å; F188-V210 HydrophobicContact CE1-CG1 3.78Å; F188-V210 HydrophobicContact CZ-CG1 4.2Å; F188-V214 HydrophobicContact CE1-CG2 4.04Å; F188-V214 HydrophobicContact CE2-CG2 4.27Å; F188-V214 HydrophobicContact CZ-CG2 3.43Å; F188-V214 VanDerWaalsContact CZ-CG2 3.43Å; F188-I279 HydrophobicContact CD1-CD1 3.84Å; F188-I279 HydrophobicContact CD1-CG1 4.45Å; F188-I279 HydrophobicContact CD1-CG2 3.96Å; F188-I279 HydrophobicContact CD2-CD1 4.1Å; F188-I279 HydrophobicContact CE1-CD1 3.63Å; F188-I279 HydrophobicContact CE1-CG2 4.07Å; F188-I279 HydrophobicContact CE2-CD1 3.89Å; F188-I279 HydrophobicContact CG-CD1 4.09Å; F188-I279 HydrophobicContact CZ-CD1 3.66Å; F188-L287 HydrophobicContact CD1-CD1 3.61Å; F188-L287 HydrophobicContact CE1-CD1 3.91Å
189	V	82.4	Confident	89.2	Confident	47 Å²	47	55.2 Å²	55.2	29%	0.285	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-73.4	-27.5	174.5	-171.9	0	0	0	0	111.5	T164 A186 V187 K191	T164-V189 HydrophobicContact CG2-CB 4.42Å; T164-V189 HydrophobicContact CG2-CG1 4.19Å; A186-V189 HydrophobicContact CB-CG2 4.44Å; A186-V189 WeakPolarHBondContact O-CG2 3.39Å; A186-V189 PolarHBondContact O-N 3.42Å; A186-V189 VanDerWaalsContact O-N 3.12Å; V187-V189 PolarHBondContact O-N 3.05Å; V187-V189 VanDerWaalsContact O-N 3.09Å; V189-K191 PolarHBondContact O-N 3.34Å
190	F	85.8	Confident	89.2	Confident	7 Å²	7	51 Å²	51	3%	0.031	24%	0.239	C	C	.	.			trans	-95.9	70.1	-178	-48	-72.9	0	0	0	111.7	L162 T164 L167 L170 P185 V187 F188 N192 L193	L162-F190 HydrophobicContact CD2-CE1 4.45Å; L162-F190 HydrophobicContact CD2-CZ 3.83Å; T164-F190 HydrophobicContact CG2-CE1 4.33Å; T164-F190 HydrophobicContact CG2-CZ 3.95Å; L167-F190 HydrophobicContact CB-CE1 4.25Å; L167-F190 HydrophobicContact CD1-CE1 4.3Å; L170-F190 HydrophobicContact CD2-CD1 4.28Å; L170-F190 HydrophobicContact CD2-CE1 4.35Å; P185-F190 HydrophobicContact CG-CE2 3.9Å; P185-F190 HydrophobicContact CG-CZ 3.77Å; V187-F190 PolarHBondContact O-N 3.14Å; F188-F190 VanDerWaalsContact C-N 3.31Å; F190-N192 PolarHBondContact O-N 2.93Å; F190-L193 HydrophobicContact CB-CB 3.77Å; F190-L193 HydrophobicContact CB-CD1 4.45Å; F190-L193 HydrophobicContact CB-CD2 4.07Å; F190-L193 HydrophobicContact CB-CG 4.32Å; F190-L193 HydrophobicContact CG-CD2 4.4Å; F190-L193 PolarHBondContact O-N 2.88Å
191	K	85.4	Confident	89.2	Confident	124 Å²	124	50 Å²	50	54%	0.539	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-31.5	-172.9	-62.8	-179.2	-179.2	-179	0	114.4	V189 L283	V189-K191 PolarHBondContact O-N 3.34Å; K191-L283 HydrophobicContact CB-CD1 4.04Å; K191-L283 HydrophobicContact CG-CD1 4.07Å; K191-L283 HydrophobicContact CG-CD2 4.4Å
192	N	90.2	Very high	89	Confident	76 Å²	76	50 Å²	50	41%	0.406	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	7.2	-175.5	-67.7	-7	0	0	0	113.3	L170 E171 F190 R194	L170-N192 CarbonylContact O-C 3.56Å; L170-N192 VanDerWaalsContact O-C 3.26Å; E171-N192 WeakPolarHBondContact CA-O 3.47Å; E171-N192 HydrophobicContact CG-CB 4.46Å; F190-N192 PolarHBondContact O-N 2.93Å; N192-R194 PolarHBondContact O-N 2.8Å
193	L	92.2	Very high	89.1	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.037	22%	0.215	C	C	.	.			trans	-62.3	136.7	-175.5	-157.9	67.6	0	0	0	110.1	L170 I173 F190 A196 F207 V290	L170-L193 HydrophobicContact CD2-CD1 4.38Å; L170-L193 HydrophobicContact CG-CD1 4.39Å; L170-L193 VanDerWaalsContact O-CA 3.28Å; L170-L193 WeakPolarHBondContact O-CA 3.28Å; L170-L193 PolarHBondContact O-N 3.44Å; L170-L193 VanDerWaalsContact O-N 3.14Å; I173-L193 HydrophobicContact CB-CD1 4.26Å; I173-L193 HydrophobicContact CG2-CD1 3.96Å; I173-L193 HydrophobicContact CG2-CD2 4.33Å; F190-L193 HydrophobicContact CB-CB 3.77Å; F190-L193 HydrophobicContact CB-CD1 4.45Å; F190-L193 HydrophobicContact CB-CD2 4.07Å; F190-L193 HydrophobicContact CB-CG 4.32Å; F190-L193 HydrophobicContact CG-CD2 4.4Å; F190-L193 PolarHBondContact O-N 2.88Å; L193-A196 HydrophobicContact CD2-CB 4.22Å; L193-F207 HydrophobicContact CD2-CE1 3.76Å; L193-F207 HydrophobicContact CD2-CZ 3.71Å; L193-V290 HydrophobicContact CB-CG2 4.28Å; L193-V290 HydrophobicContact CD2-CG1 4.28Å; L193-V290 HydrophobicContact CG-CG1 4.44Å; L193-V290 WeakPolarHBondContact O-CG2 3.5Å
194	R	92.8	Very high	89.4	Confident	164 Å²	164	38.1 Å²	38.1	62%	0.619	19%	0.185	S	C	*	.			trans	-125.1	-36.5	177	-60.6	-174.6	-178	-154	1.3	111.7	E171 N192 Q291	E171-R194 PolarHBondContact O-N 3.03Å; N192-R194 PolarHBondContact O-N 2.8Å; R194-Q291 PolarHBondContact O-N 3.03Å
195	I	94.2	Very high	89.5	Confident	46 Å²	46	37 Å²	37	24%	0.236	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	123.3	-176.1	-58.6	174.6	0	0	0	109.6	E171 Q172 I173 R197 Q291	E171-I195 PolarHBondContact O-N 3.48Å; Q172-I195 WeakPolarHBondContact CA-O 3.49Å; Q172-I195 HydrophobicContact CB-CB 4.3Å; Q172-I195 HydrophobicContact CG-CB 4.03Å; Q172-I195 HydrophobicContact CG-CG2 4.12Å; I173-I195 PolarHBondContact N-O 2.94Å; I195-R197 HydrophobicContact CG2-CG 4.25Å; I195-Q291 WeakPolarHBondContact CA-O 3.47Å
196	A	94.8	Very high	89.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.5	174.3	0	0	0	0	0	110.1	I173 L193 L198 F207 V290 Q291 C292 S293	I173-A196 HydrophobicContact CG2-CB 4.09Å; L193-A196 HydrophobicContact CD2-CB 4.22Å; A196-L198 HydrophobicContact CB-CD1 4.38Å; A196-L198 HydrophobicContact CB-CD2 4.33Å; A196-L198 HydrophobicContact CB-CG 4.21Å; A196-F207 HydrophobicContact CB-CE2 4.28Å; A196-F207 HydrophobicContact CB-CZ 4.47Å; A196-V290 HydrophobicContact CB-CG1 4.03Å; A196-Q291 PolarHBondContact N-O 3.32Å; A196-C292 HydrophobicContact CB-CB 4.39Å; A196-C292 CarbonylContact O-C 3.21Å; A196-C292 VanDerWaalsContact O-CA 3.29Å; A196-C292 WeakPolarHBondContact O-CA 3.36Å; A196-S293 PolarHBondContact O-N 3.38Å
197	R	95.9	Very high	89.8	Confident	94 Å²	94	36.5 Å²	36.5	36%	0.355	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	100.9	175.9	-71.3	177	174.8	-176.7	4.4	108.5	I173 V174 L175 R176 I195 S293	I173-R197 PolarHBondContact O-N 3.39Å; V174-R197 CarbonylContact C-O 3.25Å; V174-R197 WeakPolarHBondContact CA-O 3.44Å; V174-R197 HydrophobicContact CB-CB 4.31Å; V174-R197 HydrophobicContact CG1-CB 3.78Å; V174-R197 HydrophobicContact CG2-CB 4.33Å; L175-R197 CarbonylContact C-O 3.56Å; L175-R197 PolarHBondContact N-O 3.37Å; R176-R197 HydrophobicContact CG-CB 4.35Å; I195-R197 HydrophobicContact CG2-CG 4.25Å; R197-S293 CarbonylContact C-O 3.53Å
198	L	94.9	Very high	89.7	Confident	7 Å²	7	41 Å²	41	4%	0.037	19%	0.188	C	C	.	.			trans	-110.3	170.3	-167.6	-53.1	178.9	0	0	0	111.3	L175 L184 A196 H203 F207 C292 S293 P294	L175-L198 HydrophobicContact CB-CD2 4.21Å; L175-L198 HydrophobicContact CD1-CD2 3.82Å; L175-L198 HydrophobicContact CG-CD2 4.47Å; L175-L198 CarbonylContact O-C 3.48Å; L184-L198 HydrophobicContact CD1-CD1 3.87Å; A196-L198 HydrophobicContact CB-CD1 4.38Å; A196-L198 HydrophobicContact CB-CD2 4.33Å; A196-L198 HydrophobicContact CB-CG 4.21Å; L198-H203 HydrophobicContact CB-CB 4.43Å; L198-H203 HydrophobicContact CD1-CB 3.49Å; L198-H203 VanDerWaalsContact CD1-CB 3.49Å; L198-F207 HydrophobicContact CD1-CE2 4.38Å; L198-C292 VanDerWaalsContact CD1-SG 3.51Å; L198-S293 PolarHBondContact N-O 2.74Å; L198-P294 WeakPolarHBondContact O-CD 3.32Å
199	T	94	Very high	89.5	Confident	27 Å²	27	41.4 Å²	41.4	17%	0.166	19%	0.192	C	C	.	.	S	Bend	trans	-82.9	-37.5	176.3	-65.6	0	0	0	0	112.1	L175 G177 V178 H179	L175-T199 PolarHBondContact O-N 2.89Å; L175-T199 VanDerWaalsContact O-N 3.12Å; L175-T199 PolarHBondContact O-OG1 3.41Å; G177-T199 PolarHBondContact N-OG1 3.5Å; V178-T199 PolarHBondContact N-OG1 3.17Å; H179-T199 WeakPolarHBondContact ND1-CG2 3.27Å
200	Y	92.5	Very high	89.2	Confident	31 Å²	31	39.1 Å²	39.1	12%	0.122	18%	0.179	C	C	.	.			trans	-115.6	134.8	-171.7	-60.5	-74.6	0	0	0	112.6	H179 H202 H203 V383	H179-Y200 WeakPolarHBondContact CA-OH 3.14Å; H179-Y200 PolarHBondContact O-OH 3.38Å; Y200-H202 VanDerWaalsContact C-N 3.29Å; Y200-H202 WeakPolarHBondContact CB-CE1 3.44Å; Y200-H202 AromaticContact CD1-CE1 3.76Å; Y200-H202 AromaticContact CG-CE1 3.46Å; Y200-H202 VanDerWaalsContact CG-CE1 3.46Å; Y200-H202 AromaticContact CG-NE2 3.89Å; Y200-H202 PolarHBondContact O-N 3.17Å; Y200-H203 AromaticContact CD2-CE1 3.54Å; Y200-H203 AromaticContact CD2-NE2 3.96Å; Y200-H203 WeakPolarHBondContact O-CB 3.4Å; Y200-H203 PolarHBondContact O-N 2.8Å; Y200-H203 VanDerWaalsContact O-N 3.14Å; Y200-V383 HydrophobicContact CD1-CG2 4.49Å; Y200-V383 HydrophobicContact CD2-CG2 4.07Å; Y200-V383 HydrophobicContact CE1-CG1 4.1Å; Y200-V383 HydrophobicContact CE2-CG1 4.12Å; Y200-V383 HydrophobicContact CE2-CG2 4.11Å; Y200-V383 HydrophobicContact CG-CG2 4.27Å
201	P	91.7	Very high	88.4	Confident	22 Å²	22	43.1 Å²	43.1	14%	0.143	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-35.2	179.3	-22	29.2	0	0	0	114.5	H203 C204 P294 N300	P201-H203 PolarHBondContact O-N 3.5Å; P201-C204 WeakPolarHBondContact O-CB 3.12Å; P201-C204 PolarHBondContact O-N 2.69Å; P201-P294 WeakPolarHBondContact CA-O 3.36Å; P201-P294 HydrophobicContact CB-CG 4.25Å; P201-P294 HydrophobicContact CG-CB 4.2Å; P201-P294 HydrophobicContact CG-CG 3.73Å; P201-N300 HydrophobicContact CB-CB 4.08Å; P201-N300 HydrophobicContact CG-CB 4.27Å
202	H	90	Very high	87.4	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.014	19%	0.19	C	C	.	.	H	α-helix	trans	-71.1	-14.4	-178.8	61.7	-96.9	0	0	0	113.4	Y200 C204 C205 C379 A382 V383	Y200-H202 VanDerWaalsContact C-N 3.29Å; Y200-H202 WeakPolarHBondContact CB-CE1 3.44Å; Y200-H202 AromaticContact CD1-CE1 3.76Å; Y200-H202 AromaticContact CG-CE1 3.46Å; Y200-H202 VanDerWaalsContact CG-CE1 3.46Å; Y200-H202 AromaticContact CG-NE2 3.89Å; Y200-H202 PolarHBondContact O-N 3.17Å; H202-C204 VanDerWaalsContact C-N 3.25Å; H202-C205 VanDerWaalsContact O-CB 3.27Å; H202-C205 WeakPolarHBondContact O-CB 3.29Å; H202-C205 PolarHBondContact O-N 3.45Å; H202-C379 HydrophobicContact CB-CB 4.08Å; H202-C379 PolarHBondContact CD2-O 3.44Å; H202-A382 HydrophobicContact CB-CB 3.95Å; H202-V383 WeakPolarHBondContact CE1-CG2 3.27Å; H202-V383 WeakPolarHBondContact NE2-CG2 3.21Å
203	H	90.7	Very high	85.8	Confident	5 Å²	5	41.2 Å²	41.2	2%	0.023	19%	0.192	C	C	.	.	H	α-helix	trans	-69.9	-27.3	168.9	-71.3	174.3	0	0	0	111.6	L181 K182 L184 L198 Y200 P201 C205 Y206	L181-H203 PolarHBondContact O-CE1 3.09Å; L181-H203 VanDerWaalsContact O-CE1 3.31Å; K182-H203 PolarHBondContact O-NE2 3.37Å; K182-H203 VanDerWaalsContact O-NE2 3.08Å; L184-H203 HydrophobicContact CD1-CB 3.64Å; L184-H203 HydrophobicContact CG-CB 4.09Å; L198-H203 HydrophobicContact CB-CB 4.43Å; L198-H203 HydrophobicContact CD1-CB 3.49Å; L198-H203 VanDerWaalsContact CD1-CB 3.49Å; Y200-H203 AromaticContact CD2-CE1 3.54Å; Y200-H203 AromaticContact CD2-NE2 3.96Å; Y200-H203 WeakPolarHBondContact O-CB 3.4Å; Y200-H203 PolarHBondContact O-N 2.8Å; Y200-H203 VanDerWaalsContact O-N 3.14Å; P201-H203 PolarHBondContact O-N 3.5Å; H203-C205 VanDerWaalsContact C-N 3.25Å; H203-C205 PolarHBondContact O-N 3.06Å; H203-Y206 VanDerWaalsContact O-CD2 3.3Å; H203-Y206 WeakPolarHBondContact O-CD2 3.32Å
204	C	92.3	Very high	84.3	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-72.3	-18.3	173.6	-67.4	0	0	0	0	113.2	P201 H202 Y206 F207 L208 C292 P294	P201-C204 WeakPolarHBondContact O-CB 3.12Å; P201-C204 PolarHBondContact O-N 2.69Å; H202-C204 VanDerWaalsContact C-N 3.25Å; C204-Y206 PolarHBondContact O-N 2.84Å; C204-F207 PolarHBondContact O-N 2.9Å; C204-L208 PolarHBondContact O-N 3.09Å; C204-C292 WeakPolarHBondContact CA-SG 3.43Å; C204-C292 HydrophobicContact CB-CB 3.64Å; C204-C292 WeakPolarHBondContact CB-SG 3.06Å; C204-C292 VanDerWaalsContact SG-C 3.51Å; C204-C292 WeakPolarHBondContact SG-CB 3.47Å; C204-C292 CovalentContact SG-SG 2.03Å; C204-C292 PolarHBondContact SG-SG 2.85Å; C204-P294 PolarHBondContact SG-O 2.98Å
205	C	89.5	Confident	82.3	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-27.3	175.8	-67	0	0	0	0	113.7	H202 H203 F207 L208 N209 C302 C379	H202-C205 VanDerWaalsContact O-CB 3.27Å; H202-C205 WeakPolarHBondContact O-CB 3.29Å; H202-C205 PolarHBondContact O-N 3.45Å; H203-C205 VanDerWaalsContact C-N 3.25Å; H203-C205 PolarHBondContact O-N 3.06Å; C205-F207 VanDerWaalsContact C-N 3.27Å; C205-F207 PolarHBondContact O-N 3.08Å; C205-L208 PolarHBondContact O-N 3.18Å; C205-N209 WeakPolarHBondContact O-CB 3.35Å; C205-N209 PolarHBondContact O-N 3.05Å; C205-N209 VanDerWaalsContact O-N 3.13Å; C205-C302 VanDerWaalsContact CA-SG 3.58Å; C205-C302 HydrophobicContact CB-CB 3.66Å; C205-C302 WeakPolarHBondContact CB-SG 3.31Å; C205-C302 WeakPolarHBondContact SG-CA 3.32Å; C205-C302 WeakPolarHBondContact SG-CB 3.47Å; C205-C302 CovalentContact SG-SG 2.03Å; C205-C302 PolarHBondContact SG-SG 2.99Å; C205-C379 HydrophobicContact CB-CB 3.9Å
206	Y	85.2	Confident	80.1	Confident	56 Å²	56	38.7 Å²	38.7	22%	0.22	20%	0.204	C	C	.	.	H	α-helix	trans	-67.8	-27.1	177.4	-63	-67.4	0	0	0	112.9	V187 H203 C204 V210	V187-Y206 HydrophobicContact CG1-CG 4.44Å; H203-Y206 VanDerWaalsContact O-CD2 3.3Å; H203-Y206 WeakPolarHBondContact O-CD2 3.32Å; C204-Y206 PolarHBondContact O-N 2.84Å; Y206-V210 VanDerWaalsContact O-CG2 3.28Å; Y206-V210 WeakPolarHBondContact O-CG2 2.95Å
207	F	87.5	Confident	77.9	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-88.2	-30	177.4	-58	-77.2	0	0	0	112.4	V187 L193 A196 L198 C204 C205 V210 L287 V290 C292	V187-F207 HydrophobicContact CB-CD1 4.42Å; V187-F207 HydrophobicContact CB-CE1 3.92Å; V187-F207 HydrophobicContact CB-CZ 4.36Å; V187-F207 HydrophobicContact CG1-CD1 4.2Å; V187-F207 HydrophobicContact CG1-CE1 3.66Å; V187-F207 HydrophobicContact CG1-CE2 4.18Å; V187-F207 HydrophobicContact CG1-CZ 3.65Å; L193-F207 HydrophobicContact CD2-CE1 3.76Å; L193-F207 HydrophobicContact CD2-CZ 3.71Å; A196-F207 HydrophobicContact CB-CE2 4.28Å; A196-F207 HydrophobicContact CB-CZ 4.47Å; L198-F207 HydrophobicContact CD1-CE2 4.38Å; C204-F207 PolarHBondContact O-N 2.9Å; C205-F207 VanDerWaalsContact C-N 3.27Å; C205-F207 PolarHBondContact O-N 3.08Å; F207-V210 WeakPolarHBondContact O-CG2 3.42Å; F207-L287 HydrophobicContact CD1-CD2 4.43Å; F207-L287 HydrophobicContact CE1-CD2 4.32Å; F207-V290 HydrophobicContact CB-CB 4.41Å; F207-V290 HydrophobicContact CD1-CB 3.86Å; F207-V290 HydrophobicContact CD1-CG1 3.99Å; F207-V290 HydrophobicContact CD1-CG2 3.91Å; F207-V290 HydrophobicContact CE1-CB 4.42Å; F207-V290 HydrophobicContact CE1-CG1 4.18Å; F207-V290 HydrophobicContact CE1-CG2 4.24Å; F207-V290 HydrophobicContact CG-CB 4.21Å; F207-V290 HydrophobicContact CG-CG1 4.23Å; F207-C292 HydrophobicContact CD2-CB 4.21Å
208	L	82.3	Confident	75.8	Confident	102 Å²	102	40 Å²	40	53%	0.534	22%	0.218	S	C	.	.	H	α-helix	trans	-76.9	-28.9	177.3	-65.5	177.1	0	0	0	113.5	C204 C205 P296	C204-L208 PolarHBondContact O-N 3.09Å; C205-L208 PolarHBondContact O-N 3.18Å; L208-P296 HydrophobicContact CD1-CG 3.32Å
209	N	75	Confident	73.7	Confident	42 Å²	42	47.3 Å²	47.3	23%	0.225	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	34.2	-173.6	-72.2	-52.3	0	0	0	111.6	C205 R211 K212 A213	C205-N209 WeakPolarHBondContact O-CB 3.35Å; C205-N209 PolarHBondContact O-N 3.05Å; C205-N209 VanDerWaalsContact O-N 3.13Å; N209-R211 VanDerWaalsContact C-N 3.32Å; N209-R211 PolarHBondContact O-N 3.14Å; N209-K212 HydrophobicContact CB-CB 4.17Å; N209-K212 HydrophobicContact CB-CD 4.44Å; N209-K212 CarbonylContact O-C 3.38Å; N209-K212 PolarHBondContact O-N 2.93Å; N209-A213 PolarHBondContact O-N 2.86Å
210	V	76.6	Confident	71.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-52.6	-50.8	-178	178.3	0	0	0	0	110.5	F188 Y206 F207 K212 A213 V214 M284 L287 E288	F188-V210 HydrophobicContact CE1-CG1 3.78Å; F188-V210 HydrophobicContact CZ-CG1 4.2Å; Y206-V210 VanDerWaalsContact O-CG2 3.28Å; Y206-V210 WeakPolarHBondContact O-CG2 2.95Å; F207-V210 WeakPolarHBondContact O-CG2 3.42Å; V210-K212 PolarHBondContact O-N 3.2Å; V210-A213 WeakPolarHBondContact O-CB 3.26Å; V210-A213 PolarHBondContact O-N 3.04Å; V210-V214 WeakPolarHBondContact O-CG2 3.27Å; V210-V214 PolarHBondContact O-N 2.99Å; V210-M284 HydrophobicContact CG1-CB 4.11Å; V210-M284 HydrophobicContact CG1-CG 4.06Å; V210-L287 HydrophobicContact CG1-CB 4.41Å; V210-L287 HydrophobicContact CG1-CD1 4.37Å; V210-L287 HydrophobicContact CG2-CB 3.79Å; V210-E288 HydrophobicContact CB-CG 4.03Å; V210-E288 HydrophobicContact CG2-CG 4.07Å
211	R	68.1	Low	70.3	Confident	91 Å²	91	50.8 Å²	50.8	34%	0.343	27%	0.269	S	S	.	.	H	α-helix	trans	-53.8	-49.6	175.2	-76	163.1	-161.6	-76.3	-5	112.7	N209 A213 V214 T215 E281 M284 E288	N209-R211 VanDerWaalsContact C-N 3.32Å; N209-R211 PolarHBondContact O-N 3.14Å; R211-A213 VanDerWaalsContact C-N 3.34Å; R211-A213 PolarHBondContact O-N 3.29Å; R211-V214 CarbonylContact O-C 3.36Å; R211-V214 WeakPolarHBondContact O-CA 3.49Å; R211-V214 PolarHBondContact O-N 3.08Å; R211-T215 WeakPolarHBondContact O-CG2 3.44Å; R211-T215 PolarHBondContact O-N 3.25Å; R211-E281 IonicContact CZ-OE1 3.93Å; R211-E281 IonicContact NH1-OE1 3.88Å; R211-E281 PolarHBondContact NH1-OE1 3.27Å; R211-E281 IonicContact NH2-OE1 2.62Å; R211-E281 PolarHBondContact NH2-OE1 2.9Å; R211-M284 HydrophobicContact CB-CE 4.02Å; R211-M284 HydrophobicContact CG-CE 3.26Å; R211-E288 WeakPolarHBondContact CD-OE1 3.3Å; R211-E288 WeakPolarHBondContact CG-OE1 3.28Å; R211-E288 IonicContact CZ-OE1 3.17Å; R211-E288 IonicContact CZ-OE2 2.89Å; R211-E288 IonicContact NE-OE1 3.94Å; R211-E288 PolarHBondContact NE-OE1 2.9Å; R211-E288 IonicContact NE-OE2 3.7Å; R211-E288 PolarHBondContact NE-OE2 3.38Å; R211-E288 VanDerWaalsContact NE-OE2 3.11Å; R211-E288 IonicContact NH2-OE2 2.9Å; R211-E288 PolarHBondContact NH2-OE2 3.4Å
212	K	64.3	Low	68.7	Low	106 Å²	106	53.4 Å²	53.4	46%	0.461	28%	0.284	S	S	.	.	H	α-helix	trans	-64.6	-37.2	179.5	-69.4	-177.5	178.9	173.5	0	112.2	N209 V210 V214 T215 E303	N209-K212 HydrophobicContact CB-CB 4.17Å; N209-K212 HydrophobicContact CB-CD 4.44Å; N209-K212 CarbonylContact O-C 3.38Å; N209-K212 PolarHBondContact O-N 2.93Å; V210-K212 PolarHBondContact O-N 3.2Å; K212-V214 PolarHBondContact O-N 2.96Å; K212-T215 PolarHBondContact O-N 3.33Å; K212-T215 VanDerWaalsContact O-N 3.08Å; K212-T215 PolarHBondContact O-OG1 2.98Å; K212-E303 WeakPolarHBondContact CD-OE1 3.21Å; K212-E303 IonicContact NZ-OE1 3.19Å; K212-E303 PolarHBondContact NZ-OE1 3.21Å; K212-E303 IonicContact NZ-OE2 2.65Å
213	A	58.3	Low	67.3	Low	54 Å²	54	60.2 Å²	60.2	45%	0.446	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-26.2	174.7	0	0	0	0	0	112.2	N209 V210 R211	N209-A213 PolarHBondContact O-N 2.86Å; V210-A213 WeakPolarHBondContact O-CB 3.26Å; V210-A213 PolarHBondContact O-N 3.04Å; R211-A213 VanDerWaalsContact C-N 3.34Å; R211-A213 PolarHBondContact O-N 3.29Å
214	V	59.9	Low	65.9	Low	6 Å²	6	63 Å²	63	4%	0.036	33%	0.329	C	S	.	.	H	α-helix	trans	-93.1	-11.4	177.1	-176.2	0	0	0	0	112.7	F188 V210 R211 K212 A216 D217 L218 I279	F188-V214 HydrophobicContact CE1-CG2 4.04Å; F188-V214 HydrophobicContact CE2-CG2 4.27Å; F188-V214 HydrophobicContact CZ-CG2 3.43Å; F188-V214 VanDerWaalsContact CZ-CG2 3.43Å; V210-V214 WeakPolarHBondContact O-CG2 3.27Å; V210-V214 PolarHBondContact O-N 2.99Å; R211-V214 CarbonylContact O-C 3.36Å; R211-V214 WeakPolarHBondContact O-CA 3.49Å; R211-V214 PolarHBondContact O-N 3.08Å; K212-V214 PolarHBondContact O-N 2.96Å; V214-A216 PolarHBondContact O-N 3.35Å; V214-D217 HydrophobicContact CG1-CB 4.3Å; V214-D217 CarbonylContact O-C 3.07Å; V214-D217 WeakPolarHBondContact O-CA 3.43Å; V214-D217 PolarHBondContact O-N 3Å; V214-L218 HydrophobicContact CG1-CD1 3.91Å; V214-L218 PolarHBondContact O-N 3.03Å; V214-I279 HydrophobicContact CG1-CD1 4.2Å; V214-I279 HydrophobicContact CG2-CD1 3.69Å
215	T	51.3	Low	64.3	Low	84 Å²	84	68.3 Å²	68.3	52%	0.515	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-15.5	-168.7	47.6	0	0	0	0	116.8	R211 K212	R211-T215 WeakPolarHBondContact O-CG2 3.44Å; R211-T215 PolarHBondContact O-N 3.25Å; K212-T215 PolarHBondContact O-N 3.33Å; K212-T215 VanDerWaalsContact O-N 3.08Å; K212-T215 PolarHBondContact O-OG1 2.98Å
216	A	48.3	Very low	62.8	Low	73 Å²	73	71.7 Å²	71.7	60%	0.603	37%	0.367	S	S	*	.	H	α-helix	trans	-76.1	-30.4	168.2	0	0	0	0	0	112.9	V214	V214-A216 PolarHBondContact O-N 3.35Å
217	D	48.5	Very low	61.6	Low	53 Å²	53	72.2 Å²	72.2	28%	0.283	38%	0.378	S	S	.	.	H	α-helix	trans	-93.2	-15.3	178.4	-78.1	-17.7	0	0	0	112.5	V214 E220 C221 I271	V214-D217 HydrophobicContact CG1-CB 4.3Å; V214-D217 CarbonylContact O-C 3.07Å; V214-D217 WeakPolarHBondContact O-CA 3.43Å; V214-D217 PolarHBondContact O-N 3Å; D217-E220 PolarHBondContact O-N 3.22Å; D217-C221 WeakPolarHBondContact O-CA 3.06Å; D217-C221 WeakPolarHBondContact O-CB 3.46Å; D217-C221 PolarHBondContact O-N 2.96Å; D217-I271 WeakPolarHBondContact OD2-CD1 3.04Å
218	L	51.4	Low	60.3	Low	69 Å²	69	77.7 Å²	77.7	36%	0.361	40%	0.402	S	S	.	.	H	α-helix	trans	-68.7	-38.1	-177	-147.3	84.9	0	0	0	112.1	V214 C221 V222	V214-L218 HydrophobicContact CG1-CD1 3.91Å; V214-L218 PolarHBondContact O-N 3.03Å; L218-C221 PolarHBondContact O-N 3.4Å; L218-V222 WeakPolarHBondContact O-CB 3.43Å; L218-V222 VanDerWaalsContact O-CG2 3.23Å; L218-V222 WeakPolarHBondContact O-CG2 3.07Å; L218-V222 PolarHBondContact O-N 3.05Å
219	E	51.3	Low	58.9	Low	161 Å²	161	80.4 Å²	80.4	75%	0.752	41%	0.406	S	S	*	.	H	α-helix	trans	-66.1	-43.3	173.5	-73.3	-173.4	161.6	0	0	111.3	C221 V222 E223	E219-C221 VanDerWaalsContact C-N 3.34Å; E219-C221 PolarHBondContact O-N 3.41Å; E219-V222 PolarHBondContact O-N 3.5Å; E219-E223 PolarHBondContact O-N 2.87Å
220	E	55	Low	57.8	Low	116 Å²	116	86.6 Å²	86.6	54%	0.542	43%	0.427	S	S	.	.	H	α-helix	trans	-68.6	-33	177.4	-161.1	165.2	-174.8	0	0	111.9	D217 Q224	D217-E220 PolarHBondContact O-N 3.22Å; E220-Q224 WeakPolarHBondContact O-CB 3.33Å; E220-Q224 VanDerWaalsContact O-CG 3.27Å; E220-Q224 WeakPolarHBondContact O-CG 2.96Å; E220-Q224 PolarHBondContact O-N 3.34Å
221	C	59.8	Low	56.7	Low	15 Å²	15	90.1 Å²	90.1	10%	0.101	46%	0.456	C	S	.	.	H	α-helix	trans	-72.3	-37.9	175.2	168.5	0	0	0	0	112.5	D217 L218 E219 Q224 R225 C278	D217-C221 WeakPolarHBondContact O-CA 3.06Å; D217-C221 WeakPolarHBondContact O-CB 3.46Å; D217-C221 PolarHBondContact O-N 2.96Å; L218-C221 PolarHBondContact O-N 3.4Å; E219-C221 VanDerWaalsContact C-N 3.34Å; E219-C221 PolarHBondContact O-N 3.41Å; C221-Q224 PolarHBondContact O-N 3.43Å; C221-R225 WeakPolarHBondContact O-CB 3.31Å; C221-R225 PolarHBondContact O-N 3.14Å; C221-C278 WeakPolarHBondContact CA-SG 3.49Å; C221-C278 HydrophobicContact CB-CB 4.19Å; C221-C278 WeakPolarHBondContact CB-SG 3.44Å; C221-C278 PolarHBondContact O-SG 2.81Å; C221-C278 WeakPolarHBondContact SG-CB 3.45Å; C221-C278 CovalentContact SG-SG 2.02Å; C221-C278 PolarHBondContact SG-SG 2.7Å
222	V	58.2	Low	56	Low	76 Å²	76	92.5 Å²	92.5	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-65.1	-45.2	173.6	169.4	0	0	0	0	110.1	L218 E219 Q224 R225 L226	L218-V222 WeakPolarHBondContact O-CB 3.43Å; L218-V222 VanDerWaalsContact O-CG2 3.23Å; L218-V222 WeakPolarHBondContact O-CG2 3.07Å; L218-V222 PolarHBondContact O-N 3.05Å; E219-V222 PolarHBondContact O-N 3.5Å; V222-Q224 PolarHBondContact O-N 3.43Å; V222-R225 PolarHBondContact O-N 3.26Å; V222-L226 HydrophobicContact CG1-CD1 3.94Å; V222-L226 WeakPolarHBondContact O-CB 3.44Å; V222-L226 WeakPolarHBondContact O-CG 3.3Å; V222-L226 PolarHBondContact O-N 2.93Å
223	E	59.6	Low	55.1	Low	146 Å²	146	97 Å²	97	68%	0.682	49%	0.489	S	S	*	.	H	α-helix	trans	-57.5	-44.5	172	-79.4	-99.7	153.2	0	0	111.7	E219 L226 S227	E219-E223 PolarHBondContact O-N 2.87Å; E223-L226 PolarHBondContact O-N 3.37Å; E223-S227 WeakPolarHBondContact O-CB 3.28Å; E223-S227 PolarHBondContact O-N 3.27Å
224	Q	60.8	Low	54.3	Low	65 Å²	65	97.4 Å²	97.4	30%	0.304	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-38.2	176.6	-78.8	179.2	4.5	0	0	113.7	E220 C221 V222 S227 K228	E220-Q224 WeakPolarHBondContact O-CB 3.33Å; E220-Q224 VanDerWaalsContact O-CG 3.27Å; E220-Q224 WeakPolarHBondContact O-CG 2.96Å; E220-Q224 PolarHBondContact O-N 3.34Å; C221-Q224 PolarHBondContact O-N 3.43Å; V222-Q224 PolarHBondContact O-N 3.43Å; Q224-S227 PolarHBondContact O-N 2.95Å; Q224-S227 PolarHBondContact O-OG 2.91Å; Q224-S227 VanDerWaalsContact O-OG 3.07Å; Q224-K228 WeakPolarHBondContact O-CB 3.46Å; Q224-K228 PolarHBondContact O-N 3.43Å
225	R	59	Low	53.5	Low	112 Å²	112	102.5 Å²	102.5	42%	0.423	53%	0.534	S	S	.	.	H	α-helix	trans	-66.7	-40.2	174.6	-81.9	-176.2	178.1	168.5	4.5	111	C221 V222 R229	C221-R225 WeakPolarHBondContact O-CB 3.31Å; C221-R225 PolarHBondContact O-N 3.14Å; V222-R225 PolarHBondContact O-N 3.26Å; R225-R229 VanDerWaalsContact O-CB 3.32Å; R225-R229 WeakPolarHBondContact O-CB 3.46Å; R225-R229 PolarHBondContact O-N 3.39Å
226	L	59.4	Low	52.8	Low	72 Å²	72	106.4 Å²	106.4	38%	0.377	54%	0.544	S	S	.	.	H	α-helix	trans	-65.5	-46.5	174.5	-74.4	167.3	0	0	0	110.5	V222 E223 K228 R229 Y230	V222-L226 HydrophobicContact CG1-CD1 3.94Å; V222-L226 WeakPolarHBondContact O-CB 3.44Å; V222-L226 WeakPolarHBondContact O-CG 3.3Å; V222-L226 PolarHBondContact O-N 2.93Å; E223-L226 PolarHBondContact O-N 3.37Å; L226-K228 PolarHBondContact O-N 3.45Å; L226-R229 CarbonylContact O-C 3.16Å; L226-R229 PolarHBondContact O-N 2.87Å; L226-R229 VanDerWaalsContact O-N 3.11Å; L226-Y230 HydrophobicContact CB-CD2 4.23Å; L226-Y230 HydrophobicContact CB-CE2 4.1Å; L226-Y230 HydrophobicContact CD2-CE2 4.15Å; L226-Y230 WeakPolarHBondContact O-CD2 3.2Å; L226-Y230 PolarHBondContact O-N 3.18Å
227	S	59.6	Low	52	Low	67 Å²	67	112.1 Å²	112.1	47%	0.469	56%	0.555	S	S	.	*	H	α-helix	trans	-62.9	-40.9	179.9	79.5	0	0	0	0	112.6	E223 Q224 Y230 A231	E223-S227 WeakPolarHBondContact O-CB 3.28Å; E223-S227 PolarHBondContact O-N 3.27Å; Q224-S227 PolarHBondContact O-N 2.95Å; Q224-S227 PolarHBondContact O-OG 2.91Å; Q224-S227 VanDerWaalsContact O-OG 3.07Å; S227-Y230 PolarHBondContact O-N 3.06Å; S227-A231 VanDerWaalsContact O-CB 3.27Å; S227-A231 WeakPolarHBondContact O-CB 3.13Å; S227-A231 PolarHBondContact O-N 3.23Å
228	K	59.7	Low	51.3	Low	122 Å²	122	115.4 Å²	115.4	53%	0.53	58%	0.577	S	S	.	*	H	α-helix	trans	-63.6	-40.7	171.8	-82	-176.1	177.9	176.1	0	112	Q224 L226 A231 L232	Q224-K228 WeakPolarHBondContact O-CB 3.46Å; Q224-K228 PolarHBondContact O-N 3.43Å; L226-K228 PolarHBondContact O-N 3.45Å; K228-A231 PolarHBondContact O-N 2.96Å; K228-L232 PolarHBondContact O-N 3.38Å
229	R	53.5	Low	50.5	Low	159 Å²	159	120 Å²	120	60%	0.6	60%	0.597	S	S	*	*	H	α-helix	trans	-66.9	-41.1	178.2	-150.9	-177.1	-67.3	-170.1	-0.9	111.1	R225 L226 L232 W233	R225-R229 VanDerWaalsContact O-CB 3.32Å; R225-R229 WeakPolarHBondContact O-CB 3.46Å; R225-R229 PolarHBondContact O-N 3.39Å; L226-R229 CarbonylContact O-C 3.16Å; L226-R229 PolarHBondContact O-N 2.87Å; L226-R229 VanDerWaalsContact O-N 3.11Å; R229-L232 PolarHBondContact O-N 3.4Å; R229-W233 PolarHBondContact O-N 2.88Å
230	Y	50.5	Low	49.5	Very low	171 Å²	171	118.5 Å²	118.5	67%	0.671	59%	0.594	S	S	*	*	H	α-helix	trans	-68.4	-34.3	173.1	-73.3	-64.5	0	0	0	112.7	L226 S227 W233 G234	L226-Y230 HydrophobicContact CB-CD2 4.23Å; L226-Y230 HydrophobicContact CB-CE2 4.1Å; L226-Y230 HydrophobicContact CD2-CE2 4.15Å; L226-Y230 WeakPolarHBondContact O-CD2 3.2Å; L226-Y230 PolarHBondContact O-N 3.18Å; S227-Y230 PolarHBondContact O-N 3.06Å; Y230-W233 PolarHBondContact O-N 3.38Å; Y230-G234 WeakPolarHBondContact O-CA 3.38Å; Y230-G234 PolarHBondContact O-N 3.34Å
231	A	54.7	Low	48.6	Very low	74 Å²	74	120.6 Å²	120.6	61%	0.612	60%	0.604	S	S	*	*	H	α-helix	trans	-68.7	-35	174.4	0	0	0	0	0	112.6	S227 K228	S227-A231 VanDerWaalsContact O-CB 3.27Å; S227-A231 WeakPolarHBondContact O-CB 3.13Å; S227-A231 PolarHBondContact O-N 3.23Å; K228-A231 PolarHBondContact O-N 2.96Å
232	L	54.1	Low	47.4	Very low	141 Å²	141	124.8 Å²	124.8	74%	0.738	63%	0.633	S	S	*	*	H	α-helix	trans	-71.7	-35.1	173.3	-98.9	138.5	0	0	0	112.8	K228 R229	K228-L232 PolarHBondContact O-N 3.38Å; R229-L232 PolarHBondContact O-N 3.4Å
233	W	45	Very low	46.4	Very low	202 Å²	202	128 Å²	128	77%	0.765	65%	0.653	S	S	*	*	H	α-helix	trans	-83	-21.3	176.8	-77.3	57.2	0	0	0	113.1	R229 Y230 S235 F236	R229-W233 PolarHBondContact O-N 2.88Å; Y230-W233 PolarHBondContact O-N 3.38Å; W233-S235 PolarHBondContact O-N 3.27Å; W233-F236 PolarHBondContact O-N 3.29Å
234	G	40.3	Very low	45.3	Very low	62 Å²	62	126.4 Å²	126.4	64%	0.639	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-1.2	-180	0	0	0	0	0	115.6	Y230 F236	Y230-G234 WeakPolarHBondContact O-CA 3.38Å; Y230-G234 PolarHBondContact O-N 3.34Å; G234-F236 VanDerWaalsContact C-N 3.27Å
235	S	43.3	Very low	44.2	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	1.1	171.3	-154.4	0	0	0	0	113	W233	W233-S235 PolarHBondContact O-N 3.27Å
236	F	37.9	Very low	43.2	Very low	167 Å²	167	133 Å²	133	73%	0.732	70%	0.698	S	S	*	*	S	Bend	trans	-92.6	100.9	171	-155	-102	0	0	0	109.6	W233 G234 V238	W233-F236 PolarHBondContact O-N 3.29Å; G234-F236 VanDerWaalsContact C-N 3.27Å; F236-V238 HydrophobicContact CD1-CG2 3.81Å; F236-V238 HydrophobicContact CE1-CG2 4.1Å; F236-V238 PolarHBondContact O-N 2.95Å; F236-V238 VanDerWaalsContact O-N 3.1Å
237	K	29.6	Very low	41.8	Very low	192 Å²	192	141.6 Å²	141.6	84%	0.835	73%	0.726	S	S	*	*			trans	-54.6	111.4	170.2	-92.3	-176.9	171.4	-173.9	0	109.6
238	V	34.9	Very low	40.7	Very low	123 Å²	123	147.9 Å²	147.9	75%	0.745	74%	0.744	S	S	*	*			trans	-122.9	99.4	155	-176.6	0	0	0	0	107.3	F236	F236-V238 HydrophobicContact CD1-CG2 3.81Å; F236-V238 HydrophobicContact CE1-CG2 4.1Å; F236-V238 PolarHBondContact O-N 2.95Å; F236-V238 VanDerWaalsContact O-N 3.1Å
239	E	33.5	Very low	39.4	Very low	164 Å²	164	151.3 Å²	151.3	77%	0.766	76%	0.762	S	S	*	*			trans	-75	111.4	166.1	-139.2	161.3	-157.8	0	0	106.4
240	N	31	Very low	38.5	Very low	130 Å²	130	150.6 Å²	150.6	70%	0.695	77%	0.769	S	S	*	*				169	136.9	123.6	-93	-10.5	0	0	0	115.5
241	E	37.1	Very low	37.4	Very low	160 Å²	160	147.2 Å²	147.2	75%	0.748	77%	0.77	S	S	*	*			trans	77.4	85.2	140.3	-69	178.2	163.4	0	0	120.4
242	S	34.3	Very low	36.5	Very low	103 Å²	103	154.8 Å²	154.8	72%	0.72	78%	0.783	S	S	*	*				33.6	113.8	118.8	57.9	0	0	0	0	119.4
243	T	37.1	Very low	35.2	Very low	143 Å²	143	153.4 Å²	153.4	88%	0.877	79%	0.785	S	S	*	*				-165.6	132.2	129.3	16.7	0	0	0	0	110.7
244	P	35.9	Very low	34.6	Very low	113 Å²	113	148 Å²	148	73%	0.734	78%	0.784	S	S	*	*			trans	-102.9	150.2	-174.3	36.6	-30.5	0	0	0	115.2
245	K	37.5	Very low	34.1	Very low	199 Å²	199	152.6 Å²	152.6	87%	0.865	79%	0.793	S	S	*	*			trans	82.8	158	152.7	-75.7	178.2	-175.3	176.1	0	118.7
246	P	37.8	Very low	33.4	Very low	117 Å²	117	157.2 Å²	157.2	76%	0.76	80%	0.799	S	S	*	*			cis	-136.6	158.9	20.9	34.9	-13.4	0	0	0	119.1
247	R	30.9	Very low	33.3	Very low	252 Å²	252	156.2 Å²	156.2	95%	0.951	80%	0.8	S	S	*	*			trans	-51	129.5	164.7	-88.5	175.7	170.7	170.6	-3	111.6
248	K	37	Very low	33.1	Very low	199 Å²	199	156.3 Å²	156.3	87%	0.865	80%	0.795	S	S	*	*			trans	-113.2	115.6	154.7	-86.3	-174.7	178	177.4	0	110.4
249	Q	30.7	Very low	32.9	Very low	194 Å²	194	154.2 Å²	154.2	91%	0.907	80%	0.798	S	S	*	*			trans	-74.6	118.1	172.3	-168.4	173.8	-2.1	0	0	107.9
250	I	35.3	Very low	32.6	Very low	145 Å²	145	154.4 Å²	154.4	74%	0.744	79%	0.792	S	S	*	*			trans	-119.3	106.2	168.3	-64.4	178.3	0	0	0	108
251	S	27.8	Very low	32.6	Very low	99 Å²	99	158 Å²	158	69%	0.692	80%	0.801	S	S	*	*			trans	-65.7	125	164.4	177.2	0	0	0	0	109.6
252	R	34.6	Very low	32.2	Very low	233 Å²	233	158.8 Å²	158.8	88%	0.879	80%	0.804	S	S	*	*			trans	-131.4	89.3	155.8	-86	-171.6	174.8	170.4	-0.9	109.4	A254	R252-A254 PolarHBondContact O-N 2.9Å
253	S	28.1	Very low	32.1	Very low	112 Å²	112	162.3 Å²	162.3	78%	0.783	81%	0.81	S	S	*	*			trans	-59.4	110	155.1	38.2	0	0	0	0	110.3
254	A	32.7	Very low	31.8	Very low	90 Å²	90	163.2 Å²	163.2	74%	0.744	80%	0.804	S	S	*	*			trans	-153.4	87.8	159.8	0	0	0	0	0	110.7	R252	R252-A254 PolarHBondContact O-N 2.9Å
255	L	28.9	Very low	31.5	Very low	158 Å²	158	164 Å²	164	83%	0.827	81%	0.809	S	S	*	*			trans	47.6	77.8	133.2	-146.3	79.4	0	0	0	117.9	I257	L255-I257 HydrophobicContact CD2-CD1 4.24Å; L255-I257 HydrophobicContact CG-CD1 4.29Å; L255-I257 HydrophobicContact CG-CG1 4.17Å
256	K	30	Very low	31.4	Very low	209 Å²	209	163 Å²	163	91%	0.909	81%	0.805	S	S	*	*			trans	-100.9	87.9	162.1	-151.6	169.3	-171.4	174.9	0	109	R258	K256-R258 PolarHBondContact O-N 3.32Å
257	I	33.9	Very low	31.2	Very low	146 Å²	146	161.5 Å²	161.5	75%	0.749	80%	0.803	S	S	*	*			trans	-68.7	122.9	173.3	-65.9	174.1	0	0	0	108.3	L255	L255-I257 HydrophobicContact CD2-CD1 4.24Å; L255-I257 HydrophobicContact CG-CD1 4.29Å; L255-I257 HydrophobicContact CG-CG1 4.17Å
258	R	26.2	Very low	31.3	Very low	194 Å²	194	159 Å²	159	73%	0.732	79%	0.793	S	S	*	*			trans	-84.5	106.5	-172.3	-172.2	178	-169.7	171.2	4.4	109.8	K256	K256-R258 PolarHBondContact O-N 3.32Å
259	G	31	Very low	31.2	Very low	78 Å²	78	154.5 Å²	154.5	80%	0.804	78%	0.784	S	S	*	*			trans	-102.3	104.6	163.6	0	0	0	0	0	109.6
260	R	26.8	Very low	31.4	Very low	169 Å²	169	149.9 Å²	149.9	64%	0.638	77%	0.77	S	S	*	*			trans	-94.4	110.5	-179.6	-145.6	-166.1	-64.8	-162	2.9	107.8
261	F	31.6	Very low	31.6	Very low	206 Å²	206	145.7 Å²	145.7	90%	0.904	75%	0.748	S	S	*	*			trans	-134.7	127.2	159.1	-85.8	-80.1	0	0	0	108.2
262	H	28.8	Very low	31.9	Very low	175 Å²	175	146.2 Å²	146.2	81%	0.81	75%	0.747	S	S	*	*			trans	-67.8	129.6	-172.6	-71.8	-101.7	0	0	0	111.3
263	E	31.6	Very low	32	Very low	178 Å²	178	138 Å²	138	83%	0.832	73%	0.729	S	S	*	*			trans	-148.1	124.9	151.9	-133.2	166.2	-164.9	0	0	106.3
264	E	30.6	Very low	32.4	Very low	161 Å²	161	136.2 Å²	136.2	75%	0.752	72%	0.721	S	S	*	*			trans	-55.7	148.2	178.7	-67.8	-161.6	154.4	0	0	111.1	F266	E264-F266 VanDerWaalsContact C-N 3.26Å; E264-F266 PolarHBondContact O-N 3.01Å
265	P	29.3	Very low	32.8	Very low	130 Å²	130	137.9 Å²	137.9	84%	0.844	72%	0.717	S	S	*	*			trans	-71.5	87.1	176.1	30.5	-30.8	0	0	0	108.8	A267	P265-A267 PolarHBondContact O-N 2.99Å
266	F	36.1	Very low	33.7	Very low	177 Å²	177	134.6 Å²	134.6	78%	0.776	71%	0.708	S	S	*	*			trans	-57.1	125	162.1	-87.2	-85.5	0	0	0	108	E264 R268	E264-F266 VanDerWaalsContact C-N 3.26Å; E264-F266 PolarHBondContact O-N 3.01Å; F266-R268 PolarHBondContact O-N 3.12Å
267	A	32.5	Very low	34.9	Very low	87 Å²	87	131.3 Å²	131.3	72%	0.719	70%	0.696	S	S	*	*			trans	-37.9	126.5	-172.7	0	0	0	0	0	111.9	P265	P265-A267 PolarHBondContact O-N 2.99Å
268	R	33.7	Very low	36.4	Very low	198 Å²	198	125.8 Å²	125.8	75%	0.747	67%	0.67	S	S	*	*			trans	-43.5	144.1	158.5	-72.7	-178.2	-165.7	-179.2	4.1	107.2	F266 T270	F266-R268 PolarHBondContact O-N 3.12Å; R268-T270 PolarHBondContact O-N 3.25Å
269	P	35.8	Very low	38.4	Very low	105 Å²	105	118.1 Å²	118.1	68%	0.682	64%	0.643	S	S	*	*			trans	-51.2	114.1	166.5	23.8	-29.5	0	0	0	105.2	I271	P269-I271 PolarHBondContact O-N 3.45Å
270	T	34.5	Very low	40.5	Very low	98 Å²	98	117.4 Å²	117.4	60%	0.601	62%	0.624	S	S	*	*			trans	-64.2	97.9	-174	-39.5	0	0	0	0	105.2	R268 V272	R268-T270 PolarHBondContact O-N 3.25Å; T270-V272 HydrophobicContact CG2-CG2 3.6Å; T270-V272 PolarHBondContact O-N 2.89Å
271	I	38.8	Very low	42.8	Very low	57 Å²	57	112.3 Å²	112.3	29%	0.292	61%	0.608	S	S	.	*			trans	-62.8	91.1	152.6	-57.7	176.6	0	0	0	101.8	D217 P269 A273	D217-I271 WeakPolarHBondContact OD2-CD1 3.04Å; P269-I271 PolarHBondContact O-N 3.45Å; I271-A273 HydrophobicContact CG2-CB 4.42Å; I271-A273 PolarHBondContact O-N 3.19Å
272	V	35.3	Very low	45.2	Very low	110 Å²	110	109.3 Å²	109.3	67%	0.667	60%	0.596	S	S	*	*			trans	-69.5	81.4	163.4	-178.7	0	0	0	0	104.1	T270 A274	T270-V272 HydrophobicContact CG2-CG2 3.6Å; T270-V272 PolarHBondContact O-N 2.89Å; V272-A274 HydrophobicContact CG1-CB 4.13Å; V272-A274 PolarHBondContact O-N 3.03Å
273	A	35	Very low	47.8	Very low	60 Å²	60	102.2 Å²	102.2	50%	0.496	56%	0.564	S	S	.	*			trans	-66.1	81.1	150.9	0	0	0	0	0	104.9	I271 N275	I271-A273 HydrophobicContact CG2-CB 4.42Å; I271-A273 PolarHBondContact O-N 3.19Å; A273-N275 PolarHBondContact O-N 3.43Å
274	A	37.5	Very low	50.1	Low	75 Å²	75	93.8 Å²	93.8	62%	0.62	53%	0.525	S	S	*	.	S	Bend	trans	-62.4	99.2	157.5	0	0	0	0	0	104.5	V272	V272-A274 HydrophobicContact CG1-CB 4.13Å; V272-A274 PolarHBondContact O-N 3.03Å
275	N	41	Very low	52.6	Low	124 Å²	124	90.6 Å²	90.6	66%	0.663	51%	0.51	S	S	*	.	S	Bend	trans	81	135.2	-171.2	-46	-28.3	0	0	0	113.3	A273 E277	A273-N275 PolarHBondContact O-N 3.43Å; N275-E277 PolarHBondContact O-N 3.46Å
276	S	47.4	Very low	55.4	Low	89 Å²	89	86.2 Å²	86.2	62%	0.622	48%	0.482	S	S	*	.	S	Bend	trans	-62.6	55.3	173.2	29.8	0	0	0	0	112.7
277	E	56.3	Low	57.7	Low	141 Å²	141	77.9 Å²	77.9	66%	0.659	45%	0.446	S	S	*	.			trans	-109.8	120.7	172.2	-76.7	-173.5	150.4	0	0	109.1	N275 I279	N275-E277 PolarHBondContact O-N 3.46Å; E277-I279 PolarHBondContact O-N 2.95Å
278	C	63.7	Low	60.3	Low	30 Å²	30	77 Å²	77	20%	0.203	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-46.3	136	164.7	-69.6	0	0	0	0	111.1	C221 P280	C221-C278 WeakPolarHBondContact CA-SG 3.49Å; C221-C278 HydrophobicContact CB-CB 4.19Å; C221-C278 WeakPolarHBondContact CB-SG 3.44Å; C221-C278 PolarHBondContact O-SG 2.81Å; C221-C278 WeakPolarHBondContact SG-CB 3.45Å; C221-C278 CovalentContact SG-SG 2.02Å; C221-C278 PolarHBondContact SG-SG 2.7Å; C278-P280 WeakPolarHBondContact O-CD 3.38Å
279	I	68.5	Low	62.9	Low	32 Å²	32	74.4 Å²	74.4	16%	0.164	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-59.1	126.1	170.9	-60.6	165.1	0	0	0	108	F188 V214 E277 L283 M284	F188-I279 HydrophobicContact CD1-CD1 3.84Å; F188-I279 HydrophobicContact CD1-CG1 4.45Å; F188-I279 HydrophobicContact CD1-CG2 3.96Å; F188-I279 HydrophobicContact CD2-CD1 4.1Å; F188-I279 HydrophobicContact CE1-CD1 3.63Å; F188-I279 HydrophobicContact CE1-CG2 4.07Å; F188-I279 HydrophobicContact CE2-CD1 3.89Å; F188-I279 HydrophobicContact CG-CD1 4.09Å; F188-I279 HydrophobicContact CZ-CD1 3.66Å; V214-I279 HydrophobicContact CG1-CD1 4.2Å; V214-I279 HydrophobicContact CG2-CD1 3.69Å; E277-I279 PolarHBondContact O-N 2.95Å; I279-L283 HydrophobicContact CG2-CB 4.47Å; I279-L283 HydrophobicContact CG2-CD2 4.1Å; I279-L283 HydrophobicContact CG2-CG 4.4Å; I279-M284 HydrophobicContact CG2-CG 3.72Å; I279-M284 HydrophobicContact CG2-SD 4.28Å
280	P	74.9	Confident	65.5	Low	64 Å²	64	70 Å²	70	42%	0.416	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-60.8	140.1	177.8	-23.9	33.9	0	0	0	111.4	C278 Q282 L283 M284	C278-P280 WeakPolarHBondContact O-CD 3.38Å; P280-Q282 PolarHBondContact O-N 3.44Å; P280-L283 HydrophobicContact CB-CB 4.37Å; P280-L283 WeakPolarHBondContact O-CB 3.47Å; P280-L283 PolarHBondContact O-N 2.97Å; P280-M284 PolarHBondContact O-N 2.93Å
281	E	76.5	Confident	68.4	Low	62 Å²	62	71.9 Å²	71.9	29%	0.29	40%	0.398	S	S	.	.	H	α-helix	trans	-58.1	-39.6	-179.9	-167.9	65.7	-156.3	0	0	111.5	R211 L283 M284 E285	R211-E281 IonicContact CZ-OE1 3.93Å; R211-E281 IonicContact NH1-OE1 3.88Å; R211-E281 PolarHBondContact NH1-OE1 3.27Å; R211-E281 IonicContact NH2-OE1 2.62Å; R211-E281 PolarHBondContact NH2-OE1 2.9Å; E281-L283 PolarHBondContact O-N 3.37Å; E281-M284 WeakPolarHBondContact O-CB 3.44Å; E281-M284 PolarHBondContact O-N 3.29Å; E281-E285 PolarHBondContact O-N 2.73Å
282	Q	81.9	Confident	71	Confident	142 Å²	142	69.8 Å²	69.8	66%	0.664	39%	0.388	S	S	*	.	H	α-helix	trans	-61.9	-32.8	178	-61.4	88	-7.5	0	0	112.7	P280 S286	P280-Q282 PolarHBondContact O-N 3.44Å; Q282-S286 WeakPolarHBondContact O-CB 3.47Å; Q282-S286 PolarHBondContact O-N 3.44Å; Q282-S286 PolarHBondContact O-OG 3.34Å
283	L	83.2	Confident	73.8	Confident	26 Å²	26	66.5 Å²	66.5	14%	0.136	37%	0.37	C	S	.	.	H	α-helix	trans	-73.3	-35	176.1	176.7	59.9	0	0	0	110.9	K191 I279 P280 E281 S286 L287	K191-L283 HydrophobicContact CB-CD1 4.04Å; K191-L283 HydrophobicContact CG-CD1 4.07Å; K191-L283 HydrophobicContact CG-CD2 4.4Å; I279-L283 HydrophobicContact CG2-CB 4.47Å; I279-L283 HydrophobicContact CG2-CD2 4.1Å; I279-L283 HydrophobicContact CG2-CG 4.4Å; P280-L283 HydrophobicContact CB-CB 4.37Å; P280-L283 WeakPolarHBondContact O-CB 3.47Å; P280-L283 PolarHBondContact O-N 2.97Å; E281-L283 PolarHBondContact O-N 3.37Å; L283-S286 WeakPolarHBondContact CA-OG 3.14Å; L283-S286 PolarHBondContact O-OG 2.86Å; L283-L287 HydrophobicContact CD1-CD1 4.16Å; L283-L287 HydrophobicContact CD1-CG 4.19Å; L283-L287 HydrophobicContact CG-CD1 4.15Å; L283-L287 WeakPolarHBondContact O-CB 3.19Å; L283-L287 WeakPolarHBondContact O-CG 3.24Å; L283-L287 PolarHBondContact O-N 2.75Å
284	M	80.5	Confident	76.5	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-66.5	-46.7	175	-65.1	176.7	50.7	0	0	110.8	V210 R211 I279 P280 E281 S286 L287 E288	V210-M284 HydrophobicContact CG1-CB 4.11Å; V210-M284 HydrophobicContact CG1-CG 4.06Å; R211-M284 HydrophobicContact CB-CE 4.02Å; R211-M284 HydrophobicContact CG-CE 3.26Å; I279-M284 HydrophobicContact CG2-CG 3.72Å; I279-M284 HydrophobicContact CG2-SD 4.28Å; P280-M284 PolarHBondContact O-N 2.93Å; E281-M284 WeakPolarHBondContact O-CB 3.44Å; E281-M284 PolarHBondContact O-N 3.29Å; M284-S286 VanDerWaalsContact C-N 3.34Å; M284-S286 PolarHBondContact O-N 3.41Å; M284-L287 PolarHBondContact O-N 3.04Å; M284-E288 VanDerWaalsContact O-CG 3.32Å; M284-E288 WeakPolarHBondContact O-CG 3.37Å; M284-E288 PolarHBondContact O-N 3.31Å
285	E	83	Confident	79	Confident	94 Å²	94	69.9 Å²	69.9	44%	0.439	37%	0.368	S	S	.	.	H	α-helix	trans	-60	-41.8	174.8	-70.6	176.4	177.2	0	0	112.1	E281 L287 E288 M289	E281-E285 PolarHBondContact O-N 2.73Å; E285-L287 VanDerWaalsContact C-N 3.34Å; E285-L287 PolarHBondContact O-N 3.31Å; E285-E288 PolarHBondContact O-N 3.42Å; E285-M289 WeakPolarHBondContact O-CG 3.4Å; E285-M289 PolarHBondContact O-N 3.08Å
286	S	86.4	Confident	81.3	Confident	38 Å²	38	65.4 Å²	65.4	27%	0.266	35%	0.345	S	S	.	.	H	α-helix	trans	-65.2	-38.3	178.1	71.6	0	0	0	0	112.3	Q282 L283 M284 M289	Q282-S286 WeakPolarHBondContact O-CB 3.47Å; Q282-S286 PolarHBondContact O-N 3.44Å; Q282-S286 PolarHBondContact O-OG 3.34Å; L283-S286 WeakPolarHBondContact CA-OG 3.14Å; L283-S286 PolarHBondContact O-OG 2.86Å; M284-S286 VanDerWaalsContact C-N 3.34Å; M284-S286 PolarHBondContact O-N 3.41Å; S286-M289 PolarHBondContact O-N 3.17Å
287	L	86.3	Confident	83.2	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-70.6	-33.3	176.4	-71.5	170.9	0	0	0	112.6	V187 F188 F207 V210 L283 M284 E285 M289 V290	V187-L287 HydrophobicContact CG2-CD1 4.32Å; F188-L287 HydrophobicContact CD1-CD1 3.61Å; F188-L287 HydrophobicContact CE1-CD1 3.91Å; F207-L287 HydrophobicContact CD1-CD2 4.43Å; F207-L287 HydrophobicContact CE1-CD2 4.32Å; V210-L287 HydrophobicContact CG1-CB 4.41Å; V210-L287 HydrophobicContact CG1-CD1 4.37Å; V210-L287 HydrophobicContact CG2-CB 3.79Å; L283-L287 HydrophobicContact CD1-CD1 4.16Å; L283-L287 HydrophobicContact CD1-CG 4.19Å; L283-L287 HydrophobicContact CG-CD1 4.15Å; L283-L287 WeakPolarHBondContact O-CB 3.19Å; L283-L287 WeakPolarHBondContact O-CG 3.24Å; L283-L287 PolarHBondContact O-N 2.75Å; M284-L287 PolarHBondContact O-N 3.04Å; E285-L287 VanDerWaalsContact C-N 3.34Å; E285-L287 PolarHBondContact O-N 3.31Å; L287-M289 PolarHBondContact O-N 3.41Å; L287-V290 WeakPolarHBondContact O-CB 3.24Å; L287-V290 WeakPolarHBondContact O-CG2 3.27Å; L287-V290 PolarHBondContact O-N 2.94Å
288	E	85.2	Confident	84.5	Confident	68 Å²	68	57.9 Å²	57.9	32%	0.318	31%	0.305	S	S	.	.	H	α-helix	trans	-67.6	-24.6	174.5	-74.2	174.3	168.7	0	0	112.3	V210 R211 M284 E285	V210-E288 HydrophobicContact CB-CG 4.03Å; V210-E288 HydrophobicContact CG2-CG 4.07Å; R211-E288 WeakPolarHBondContact CD-OE1 3.3Å; R211-E288 WeakPolarHBondContact CG-OE1 3.28Å; R211-E288 IonicContact CZ-OE1 3.17Å; R211-E288 IonicContact CZ-OE2 2.89Å; R211-E288 IonicContact NE-OE1 3.94Å; R211-E288 PolarHBondContact NE-OE1 2.9Å; R211-E288 IonicContact NE-OE2 3.7Å; R211-E288 PolarHBondContact NE-OE2 3.38Å; R211-E288 VanDerWaalsContact NE-OE2 3.11Å; R211-E288 IonicContact NH2-OE2 2.9Å; R211-E288 PolarHBondContact NH2-OE2 3.4Å; M284-E288 VanDerWaalsContact O-CG 3.32Å; M284-E288 WeakPolarHBondContact O-CG 3.37Å; M284-E288 PolarHBondContact O-N 3.31Å; E285-E288 PolarHBondContact O-N 3.42Å
289	M	88.9	Confident	85.5	Confident	144 Å²	144	57.4 Å²	57.4	71%	0.709	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	1.1	176.5	-70	-170.9	-71.2	0	0	114.5	E285 S286 L287 Q291	E285-M289 WeakPolarHBondContact O-CG 3.4Å; E285-M289 PolarHBondContact O-N 3.08Å; S286-M289 PolarHBondContact O-N 3.17Å; L287-M289 PolarHBondContact O-N 3.41Å; M289-Q291 PolarHBondContact O-N 2.87Å
290	V	91.5	Very high	86.5	Confident	13 Å²	13	56.5 Å²	56.5	8%	0.079	30%	0.296	C	S	.	.			trans	-65.4	123.2	179.2	174.1	0	0	0	0	110.3	L193 A196 F207 L287 C292	L193-V290 HydrophobicContact CB-CG2 4.28Å; L193-V290 HydrophobicContact CD2-CG1 4.28Å; L193-V290 HydrophobicContact CG-CG1 4.44Å; L193-V290 WeakPolarHBondContact O-CG2 3.5Å; A196-V290 HydrophobicContact CB-CG1 4.03Å; F207-V290 HydrophobicContact CB-CB 4.41Å; F207-V290 HydrophobicContact CD1-CB 3.86Å; F207-V290 HydrophobicContact CD1-CG1 3.99Å; F207-V290 HydrophobicContact CD1-CG2 3.91Å; F207-V290 HydrophobicContact CE1-CB 4.42Å; F207-V290 HydrophobicContact CE1-CG1 4.18Å; F207-V290 HydrophobicContact CE1-CG2 4.24Å; F207-V290 HydrophobicContact CG-CB 4.21Å; F207-V290 HydrophobicContact CG-CG1 4.23Å; L287-V290 WeakPolarHBondContact O-CB 3.24Å; L287-V290 WeakPolarHBondContact O-CG2 3.27Å; L287-V290 PolarHBondContact O-N 2.94Å; V290-C292 PolarHBondContact O-N 3.45Å; V290-C292 VanDerWaalsContact O-N 3.07Å
291	Q	93.7	Very high	87.2	Confident	138 Å²	138	54.3 Å²	54.3	65%	0.645	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	99.9	171.1	-66.7	-178.3	-2.3	0	0	109.5	R194 I195 A196 M289	R194-Q291 PolarHBondContact O-N 3.03Å; I195-Q291 WeakPolarHBondContact CA-O 3.47Å; A196-Q291 PolarHBondContact N-O 3.32Å; M289-Q291 PolarHBondContact O-N 2.87Å
292	C	94.3	Very high	87.7	Confident	13 Å²	13	52.2 Å²	52.2	9%	0.088	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.5	-178	-162.2	0	0	0	0	111.6	A196 L198 C204 F207 V290 E295	A196-C292 HydrophobicContact CB-CB 4.39Å; A196-C292 CarbonylContact O-C 3.21Å; A196-C292 VanDerWaalsContact O-CA 3.29Å; A196-C292 WeakPolarHBondContact O-CA 3.36Å; L198-C292 VanDerWaalsContact CD1-SG 3.51Å; C204-C292 WeakPolarHBondContact CA-SG 3.43Å; C204-C292 HydrophobicContact CB-CB 3.64Å; C204-C292 WeakPolarHBondContact CB-SG 3.06Å; C204-C292 VanDerWaalsContact SG-C 3.51Å; C204-C292 WeakPolarHBondContact SG-CB 3.47Å; C204-C292 CovalentContact SG-SG 2.03Å; C204-C292 PolarHBondContact SG-SG 2.85Å; F207-C292 HydrophobicContact CD2-CB 4.21Å; V290-C292 PolarHBondContact O-N 3.45Å; V290-C292 VanDerWaalsContact O-N 3.07Å; C292-E295 WeakPolarHBondContact O-CG 3.39Å
293	S	93.8	Very high	87.8	Confident	41 Å²	41	49.1 Å²	49.1	29%	0.287	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	143.9	176.7	57.3	0	0	0	0	110.9	A196 R197 L198	A196-S293 PolarHBondContact O-N 3.38Å; R197-S293 CarbonylContact C-O 3.53Å; L198-S293 PolarHBondContact N-O 2.74Å
294	P	92.8	Very high	87.9	Confident	54 Å²	54	49.4 Å²	49.4	35%	0.351	26%	0.261	S	S	.	.	S	Bend	cis	-70.5	142.7	-5	29.8	-34.2	0	0	0	111.9	L198 P201 C204	L198-P294 WeakPolarHBondContact O-CD 3.32Å; P201-P294 WeakPolarHBondContact CA-O 3.36Å; P201-P294 HydrophobicContact CB-CG 4.25Å; P201-P294 HydrophobicContact CG-CB 4.2Å; P201-P294 HydrophobicContact CG-CG 3.73Å; C204-P294 PolarHBondContact SG-O 2.98Å
295	E	89.9	Confident	88.2	Confident	152 Å²	152	49.9 Å²	49.9	71%	0.71	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-70.8	143.6	176.9	-68.1	178.4	173.3	0	0	110.4	C292 D297	C292-E295 WeakPolarHBondContact O-CG 3.39Å; E295-D297 PolarHBondContact O-N 3.23Å
296	P	89.2	Confident	88.2	Confident	29 Å²	29	45.5 Å²	45.5	19%	0.188	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-66.1	133.5	173.1	27.6	-30.5	0	0	0	109.7	L208 N300	L208-P296 HydrophobicContact CD1-CG 3.32Å; P296-N300 WeakPolarHBondContact CB-O 3.21Å
297	D	87	Confident	87.9	Confident	53 Å²	53	45.3 Å²	45.3	28%	0.283	25%	0.248	S	C	.	.			trans	-114.8	-176.3	179	66.8	6.4	0	0	0	110.5	E295 L299 N300 I567	E295-D297 PolarHBondContact O-N 3.23Å; D297-L299 PolarHBondContact O-N 2.83Å; D297-L299 PolarHBondContact OD1-N 2.84Å; D297-L299 VanDerWaalsContact OD1-N 3.12Å; D297-N300 CarbonylContact O-C 3.56Å; D297-N300 PolarHBondContact O-N 3.45Å; D297-N300 VanDerWaalsContact O-N 3.12Å; D297-N300 WeakPolarHBondContact OD1-CB 3.26Å; D297-N300 PolarHBondContact OD1-N 3.44Å; D297-N300 PolarHBondContact OD1-ND2 3.39Å; D297-N300 VanDerWaalsContact OD1-ND2 3.14Å; D297-I567 HydrophobicContact CB-CD1 4.32Å; D297-I567 HydrophobicContact CB-CG2 4.2Å
298	A	83.8	Confident	87.8	Confident	20 Å²	20	50.5 Å²	50.5	17%	0.165	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.7	-179.6	0	0	0	0	0	112.9	N300 P301 I567 K571	A298-N300 VanDerWaalsContact C-N 3.3Å; A298-P301 WeakPolarHBondContact O-CD 3.24Å; A298-I567 HydrophobicContact CB-CG2 4.21Å; A298-K571 HydrophobicContact CB-CB 4.19Å; A298-K571 HydrophobicContact CB-CD 4.04Å; A298-K571 WeakPolarHBondContact O-CD 3.42Å; A298-K571 WeakPolarHBondContact O-CE 3.06Å; A298-K571 PolarHBondContact O-NZ 3.16Å
299	L	85.4	Confident	87.9	Confident	20 Å²	20	52 Å²	52	11%	0.105	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-14	178.2	-67.6	172.8	0	0	0	113	D297 T476 S477 V478 L482 I567 K571	D297-L299 PolarHBondContact O-N 2.83Å; D297-L299 PolarHBondContact OD1-N 2.84Å; D297-L299 VanDerWaalsContact OD1-N 3.12Å; L299-T476 HydrophobicContact CB-CG2 4.14Å; L299-T476 HydrophobicContact CD1-CG2 4.27Å; L299-S477 WeakPolarHBondContact O-CB 3.29Å; L299-S477 PolarHBondContact O-N 2.71Å; L299-S477 PolarHBondContact O-OG 3.33Å; L299-S477 VanDerWaalsContact O-OG 3.12Å; L299-V478 HydrophobicContact CD2-CG2 4.31Å; L299-L482 HydrophobicContact CD1-CD1 4.09Å; L299-I567 HydrophobicContact CD1-CG2 4.03Å; L299-I567 HydrophobicContact CG-CG2 3.96Å; L299-K571 HydrophobicContact CD2-CB 4.11Å
300	N	89.1	Confident	87.8	Confident	12 Å²	12	51.8 Å²	51.8	6%	0.064	28%	0.281	C	S	.	.	S	Bend	trans	-131.4	64.9	175	-64.5	-75.1	0	0	0	111	P201 P296 D297 A298 Q386 V475	P201-N300 HydrophobicContact CB-CB 4.08Å; P201-N300 HydrophobicContact CG-CB 4.27Å; P296-N300 WeakPolarHBondContact CB-O 3.21Å; D297-N300 CarbonylContact O-C 3.56Å; D297-N300 PolarHBondContact O-N 3.45Å; D297-N300 VanDerWaalsContact O-N 3.12Å; D297-N300 WeakPolarHBondContact OD1-CB 3.26Å; D297-N300 PolarHBondContact OD1-N 3.44Å; D297-N300 PolarHBondContact OD1-ND2 3.39Å; D297-N300 VanDerWaalsContact OD1-ND2 3.14Å; A298-N300 VanDerWaalsContact C-N 3.3Å; N300-Q386 PolarHBondContact OD1-NE2 3.44Å; N300-V475 PolarHBondContact ND2-O 3.23Å; N300-V475 PolarHBondContact OD1-O 3.24Å; N300-V475 VanDerWaalsContact OD1-O 3.11Å
301	P	89.2	Confident	87.5	Confident	18 Å²	18	51.3 Å²	51.3	12%	0.117	28%	0.278	C	S	.	.			trans	-72.4	159.2	-173.8	31.1	-35.3	0	0	0	112.2	A298 D304 Y378	A298-P301 WeakPolarHBondContact O-CD 3.24Å; P301-D304 WeakPolarHBondContact CB-O 3.29Å; P301-D304 WeakPolarHBondContact CG-O 3.33Å; P301-Y378 HydrophobicContact CG-CD1 4Å; P301-Y378 HydrophobicContact CG-CE1 4.23Å; P301-Y378 VanDerWaalsContact O-CD1 3.28Å; P301-Y378 WeakPolarHBondContact O-CD1 3.34Å
302	C	86.1	Confident	87.3	Confident	19 Å²	19	47.4 Å²	47.4	13%	0.128	26%	0.257	C	S	.	.	S	Bend	trans	-80.1	-42.2	177.2	-63	0	0	0	0	113.9	C205 C379	C205-C302 VanDerWaalsContact CA-SG 3.58Å; C205-C302 HydrophobicContact CB-CB 3.66Å; C205-C302 WeakPolarHBondContact CB-SG 3.31Å; C205-C302 WeakPolarHBondContact SG-CA 3.32Å; C205-C302 WeakPolarHBondContact SG-CB 3.47Å; C205-C302 CovalentContact SG-SG 2.03Å; C205-C302 PolarHBondContact SG-SG 2.99Å; C302-C379 WeakPolarHBondContact O-CB 3.5Å; C302-C379 PolarHBondContact O-N 3.23Å
303	E	84.3	Confident	87.2	Confident	77 Å²	77	51.8 Å²	51.8	36%	0.36	28%	0.279	S	S	.	.	S	Bend	trans	-101.2	-67.5	-168.4	-66	-176.8	164.9	0	0	112.7	K212 G376 R377 Y378	K212-E303 WeakPolarHBondContact CD-OE1 3.21Å; K212-E303 IonicContact NZ-OE1 3.19Å; K212-E303 PolarHBondContact NZ-OE1 3.21Å; K212-E303 IonicContact NZ-OE2 2.65Å; E303-G376 CarbonylContact O-C 3.41Å; E303-G376 PolarHBondContact O-N 2.71Å; E303-R377 PolarHBondContact O-N 3.35Å; E303-Y378 WeakPolarHBondContact O-CB 3.48Å; E303-Y378 PolarHBondContact O-N 2.83Å
304	D	85.8	Confident	86.9	Confident	32 Å²	32	52.2 Å²	52.2	17%	0.171	28%	0.276	C	S	.	.			trans	-119.4	135.8	-173.5	-77.4	-39.9	0	0	0	111	P301 A306 G307 R312 A375 G376	P301-D304 WeakPolarHBondContact CB-O 3.29Å; P301-D304 WeakPolarHBondContact CG-O 3.33Å; D304-A306 VanDerWaalsContact C-N 3.33Å; D304-A306 PolarHBondContact O-N 3.3Å; D304-G307 PolarHBondContact O-N 3.45Å; D304-R312 IonicContact OD1-CZ 3.22Å; D304-R312 IonicContact OD1-NH1 3.9Å; D304-R312 IonicContact OD1-NH2 3.49Å; D304-R312 PolarHBondContact OD1-NH2 2.88Å; D304-R312 IonicContact OD2-NH1 3.07Å; D304-R312 IonicContact OD2-NH2 3.32Å; D304-R312 PolarHBondContact OD2-NH2 2.79Å; D304-A375 WeakPolarHBondContact OD1-CA 3.42Å; D304-G376 PolarHBondContact OD1-N 2.92Å
305	M	86.3	Confident	86.8	Confident	11 Å²	11	50 Å²	50	5%	0.054	26%	0.261	C	S	.	.	S	Bend	trans	-63.1	-42.9	174.7	-61.1	-174.6	-160	0	0	110.8	G307 Q370 D371 T374 Y378 W385 K571	M305-G307 VanDerWaalsContact C-N 3.29Å; M305-G307 PolarHBondContact O-N 3.1Å; M305-Q370 HydrophobicContact CE-CB 4.14Å; M305-Q370 HydrophobicContact CE-CG 3.45Å; M305-Q370 VanDerWaalsContact CE-CG 3.45Å; M305-Q370 HydrophobicContact SD-CB 4.4Å; M305-Q370 HydrophobicContact SD-CG 4.17Å; M305-D371 HydrophobicContact CB-CB 4.1Å; M305-D371 PolarHBondContact N-OD1 2.94Å; M305-D371 VanDerWaalsContact N-OD1 3.14Å; M305-D371 HydrophobicContact SD-CB 4.48Å; M305-T374 HydrophobicContact CE-CG2 4.33Å; M305-T374 WeakPolarHBondContact CE-OG1 3.4Å; M305-Y378 HydrophobicContact CE-CD2 3.21Å; M305-Y378 HydrophobicContact CE-CE2 3.1Å; M305-Y378 HydrophobicContact CE-CG 4.16Å; M305-Y378 HydrophobicContact CG-CD1 4.09Å; M305-Y378 HydrophobicContact CG-CD2 3.86Å; M305-Y378 HydrophobicContact CG-CE1 4.19Å; M305-Y378 HydrophobicContact CG-CE2 3.96Å; M305-Y378 HydrophobicContact CG-CG 3.91Å; M305-Y378 HydrophobicContact SD-CD2 4.35Å; M305-Y378 HydrophobicContact SD-CE2 4.09Å; M305-W385 HydrophobicContact CE-CG 4.44Å; M305-K571 WeakPolarHBondContact O-CE 3.47Å; M305-K571 PolarHBondContact O-NZ 3.02Å
306	A	83.3	Confident	86.9	Confident	3 Å²	3	47.3 Å²	47.3	3%	0.025	25%	0.245	C	C	.	.	S	Bend	trans	-68.9	-29.1	176	0	0	0	0	0	112.6	D304 H308 V311 R312 M315 D371	D304-A306 VanDerWaalsContact C-N 3.33Å; D304-A306 PolarHBondContact O-N 3.3Å; A306-H308 PolarHBondContact O-N 3.02Å; A306-V311 HydrophobicContact CB-CB 4.28Å; A306-V311 HydrophobicContact CB-CG1 4.22Å; A306-R312 HydrophobicContact CB-CB 4.04Å; A306-M315 HydrophobicContact CB-CE 3.52Å; A306-D371 PolarHBondContact N-OD1 3.26Å
307	G	80.8	Confident	87	Confident	34 Å²	34	51.1 Å²	51.1	35%	0.351	26%	0.263	S	S	.	.			trans	71.8	-50.4	-172.9	0	0	0	0	0	114	D304 M305	D304-G307 PolarHBondContact O-N 3.45Å; M305-G307 VanDerWaalsContact C-N 3.29Å; M305-G307 PolarHBondContact O-N 3.1Å
308	H	83.5	Confident	87.2	Confident	109 Å²	109	48.7 Å²	48.7	51%	0.505	25%	0.25	S	S	.	.	S	Bend	trans	-117	145	-179	-71.4	-44.8	0	0	0	113.1	A306 F310 V311 R312 Y572	A306-H308 PolarHBondContact O-N 3.02Å; H308-F310 PolarHBondContact O-N 2.85Å; H308-V311 HydrophobicContact CB-CG2 4.37Å; H308-V311 PolarHBondContact O-N 3.19Å; H308-V311 VanDerWaalsContact O-N 3.1Å; H308-R312 PolarHBondContact O-N 3.14Å; H308-R312 VanDerWaalsContact O-N 3.07Å; H308-Y572 AromaticContact CD2-CE1 3.75Å; H308-Y572 AromaticContact CD2-CZ 3.57Å; H308-Y572 PolarHBondContact CD2-OH 3.46Å; H308-Y572 PolarHBondContact NE2-OH 3.4Å; H308-Y572 VanDerWaalsContact NE2-OH 3.11Å
309	T	87.4	Confident	87.6	Confident	100 Å²	100	50.4 Å²	50.4	61%	0.613	25%	0.253	S	S	*	.	H	α-helix	trans	-55.7	-36.5	175.3	-45.7	0	0	0	0	112.3	R312 L313	T309-R312 WeakPolarHBondContact O-CB 3.33Å; T309-R312 PolarHBondContact O-N 2.88Å; T309-L313 HydrophobicContact CG2-CD1 4.38Å; T309-L313 HydrophobicContact CG2-CG 4.48Å; T309-L313 WeakPolarHBondContact O-CG 3.34Å; T309-L313 PolarHBondContact O-N 3.45Å
310	F	87.9	Confident	88.1	Confident	139 Å²	139	52.9 Å²	52.9	61%	0.61	27%	0.265	S	S	*	.	H	α-helix	trans	-59.6	-48	176.4	175.6	-101.4	0	0	0	112.3	H308 R312 L313 F314 L576	H308-F310 PolarHBondContact O-N 2.85Å; F310-R312 VanDerWaalsContact C-N 3.33Å; F310-R312 PolarHBondContact O-N 3.11Å; F310-L313 PolarHBondContact O-N 3.22Å; F310-F314 WeakPolarHBondContact O-CB 3.23Å; F310-F314 PolarHBondContact O-N 3.07Å; F310-L576 HydrophobicContact CE1-CD1 4.45Å
311	V	85	Confident	88.2	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-41.4	177.9	-179.2	0	0	0	0	110.5	A306 H308 F314 M315 Y572 V575 L576	A306-V311 HydrophobicContact CB-CB 4.28Å; A306-V311 HydrophobicContact CB-CG1 4.22Å; H308-V311 HydrophobicContact CB-CG2 4.37Å; H308-V311 PolarHBondContact O-N 3.19Å; H308-V311 VanDerWaalsContact O-N 3.1Å; V311-F314 PolarHBondContact O-N 3.1Å; V311-M315 HydrophobicContact CG1-CG 4.39Å; V311-M315 WeakPolarHBondContact O-CG 3.2Å; V311-M315 PolarHBondContact O-N 3.03Å; V311-Y572 HydrophobicContact CG2-CD1 3.63Å; V311-Y572 HydrophobicContact CG2-CE1 3.68Å; V311-V575 HydrophobicContact CG1-CB 4.42Å; V311-V575 HydrophobicContact CG1-CG1 3.51Å; V311-L576 HydrophobicContact CG2-CD2 4.5Å
312	R	89.5	Confident	88.4	Confident	56 Å²	56	55 Å²	55	21%	0.211	28%	0.275	C	S	.	.	H	α-helix	trans	-56.6	-51.9	174.7	179	174.9	-72.4	161.9	1.8	111.4	D304 A306 H308 T309 F310 F314 M315 W316 D371	D304-R312 IonicContact OD1-CZ 3.22Å; D304-R312 IonicContact OD1-NH1 3.9Å; D304-R312 IonicContact OD1-NH2 3.49Å; D304-R312 PolarHBondContact OD1-NH2 2.88Å; D304-R312 IonicContact OD2-NH1 3.07Å; D304-R312 IonicContact OD2-NH2 3.32Å; D304-R312 PolarHBondContact OD2-NH2 2.79Å; A306-R312 HydrophobicContact CB-CB 4.04Å; H308-R312 PolarHBondContact O-N 3.14Å; H308-R312 VanDerWaalsContact O-N 3.07Å; T309-R312 WeakPolarHBondContact O-CB 3.33Å; T309-R312 PolarHBondContact O-N 2.88Å; F310-R312 VanDerWaalsContact C-N 3.33Å; F310-R312 PolarHBondContact O-N 3.11Å; R312-F314 VanDerWaalsContact C-N 3.32Å; R312-F314 PolarHBondContact O-N 3.43Å; R312-M315 PolarHBondContact O-N 2.95Å; R312-W316 VanDerWaalsContact O-CD1 3.25Å; R312-W316 PolarHBondContact O-N 3.11Å; R312-W316 VanDerWaalsContact O-N 3.15Å; R312-D371 IonicContact CZ-OD2 3.83Å; R312-D371 IonicContact NE-OD2 4Å; R312-D371 PolarHBondContact NE-OD2 2.96Å; R312-D371 IonicContact NH2-OD1 3.11Å; R312-D371 PolarHBondContact NH2-OD1 3.48Å; R312-D371 IonicContact NH2-OD2 2.8Å; R312-D371 PolarHBondContact NH2-OD2 2.96Å
313	L	90.8	Very high	88.8	Confident	105 Å²	105	55.4 Å²	55.4	55%	0.55	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-43	177.5	-69.4	174	0	0	0	111.8	T309 F310 W316 L317	T309-L313 HydrophobicContact CG2-CD1 4.38Å; T309-L313 HydrophobicContact CG2-CG 4.48Å; T309-L313 WeakPolarHBondContact O-CG 3.34Å; T309-L313 PolarHBondContact O-N 3.45Å; F310-L313 PolarHBondContact O-N 3.22Å; L313-W316 PolarHBondContact O-N 2.91Å; L313-L317 WeakPolarHBondContact O-CG 3.4Å; L313-L317 PolarHBondContact O-N 3.31Å
314	F	88.9	Confident	89.2	Confident	51 Å²	51	56.3 Å²	56.3	22%	0.224	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-45.6	177.5	-178.5	-96.9	0	0	0	112.2	F310 V311 R312 W316 L317 A318 L576 P579 I580	F310-F314 WeakPolarHBondContact O-CB 3.23Å; F310-F314 PolarHBondContact O-N 3.07Å; V311-F314 PolarHBondContact O-N 3.1Å; R312-F314 VanDerWaalsContact C-N 3.32Å; R312-F314 PolarHBondContact O-N 3.43Å; F314-W316 VanDerWaalsContact C-N 3.31Å; F314-W316 PolarHBondContact O-N 3.15Å; F314-L317 PolarHBondContact O-N 3.33Å; F314-A318 HydrophobicContact CD1-CB 4.41Å; F314-A318 HydrophobicContact CE1-CB 4.14Å; F314-A318 HydrophobicContact CZ-CB 4.35Å; F314-A318 WeakPolarHBondContact O-CB 3.16Å; F314-A318 PolarHBondContact O-N 3.27Å; F314-L576 HydrophobicContact CB-CD2 4.14Å; F314-L576 HydrophobicContact CD1-CD2 3.36Å; F314-L576 HydrophobicContact CE1-CB 4.48Å; F314-L576 HydrophobicContact CE1-CD2 3.82Å; F314-L576 HydrophobicContact CG-CD2 3.76Å; F314-P579 HydrophobicContact CE1-CB 3.93Å; F314-P579 HydrophobicContact CE1-CG 3.9Å; F314-P579 HydrophobicContact CZ-CB 4.35Å; F314-I580 HydrophobicContact CZ-CG1 3.93Å
315	M	88.8	Confident	89.4	Confident	7 Å²	7	55.8 Å²	55.8	3%	0.034	29%	0.288	C	S	.	.	H	α-helix	trans	-57.2	-45.1	176.5	-72.9	-170.4	-59.8	0	0	111.3	A306 V311 R312 A318 W319 A368 D371 V575	A306-M315 HydrophobicContact CB-CE 3.52Å; V311-M315 HydrophobicContact CG1-CG 4.39Å; V311-M315 WeakPolarHBondContact O-CG 3.2Å; V311-M315 PolarHBondContact O-N 3.03Å; R312-M315 PolarHBondContact O-N 2.95Å; M315-A318 PolarHBondContact O-N 2.94Å; M315-W319 PolarHBondContact O-N 3.33Å; M315-A368 HydrophobicContact CB-CB 4.31Å; M315-D371 HydrophobicContact CE-CB 4.3Å; M315-V575 HydrophobicContact CG-CG1 4.01Å; M315-V575 HydrophobicContact SD-CG1 3.94Å
316	W	92.4	Very high	89.7	Confident	96 Å²	96	55.3 Å²	55.3	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-60.5	-46.9	177.4	-83.9	97	0	0	0	112.8	R312 L313 F314 W319 I320 A372	R312-W316 VanDerWaalsContact O-CD1 3.25Å; R312-W316 PolarHBondContact O-N 3.11Å; R312-W316 VanDerWaalsContact O-N 3.15Å; L313-W316 PolarHBondContact O-N 2.91Å; F314-W316 VanDerWaalsContact C-N 3.31Å; F314-W316 PolarHBondContact O-N 3.15Å; W316-W319 VanDerWaalsContact CA-CD1 3.49Å; W316-W319 AromaticContact CD2-NE1 3.67Å; W316-W319 AromaticContact CE3-CE2 3.74Å; W316-W319 AromaticContact CE3-CZ2 3.67Å; W316-W319 HydrophobicContact CE3-CZ2 3.67Å; W316-W319 AromaticContact CE3-NE1 3.23Å; W316-W319 AromaticContact CZ3-CZ2 3.58Å; W316-W319 HydrophobicContact CZ3-CZ2 3.58Å; W316-W319 AromaticContact CZ3-NE1 3.82Å; W316-W319 PolarHBondContact O-NE1 3.27Å; W316-I320 VanDerWaalsContact O-CD1 3.31Å; W316-I320 WeakPolarHBondContact O-CD1 3.47Å; W316-I320 WeakPolarHBondContact O-CG1 3.46Å; W316-I320 PolarHBondContact O-N 3.37Å; W316-A372 HydrophobicContact CZ2-CB 4.22Å
317	L	92	Very high	90.2	Very high	109 Å²	109	59 Å²	59	57%	0.571	30%	0.304	S	S	*	.	H	α-helix	trans	-64.2	-45.2	176.6	-69.4	172.8	0	0	0	111.4	L313 F314 I320 L321	L313-L317 WeakPolarHBondContact O-CG 3.4Å; L313-L317 PolarHBondContact O-N 3.31Å; F314-L317 PolarHBondContact O-N 3.33Å; L317-I320 PolarHBondContact O-N 3.47Å; L317-L321 WeakPolarHBondContact O-CB 3.26Å; L317-L321 VanDerWaalsContact O-CG 3.27Å; L317-L321 WeakPolarHBondContact O-CG 3.48Å; L317-L321 PolarHBondContact O-N 3.36Å
318	A	90.7	Very high	90.6	Very high	2 Å²	2	59.2 Å²	59.2	2%	0.017	31%	0.307	C	S	.	.	H	α-helix	trans	-67.5	-44.3	-172.7	0	0	0	0	0	112.5	F314 M315 I320 L321 A322 L364 P579 T583	F314-A318 HydrophobicContact CD1-CB 4.41Å; F314-A318 HydrophobicContact CE1-CB 4.14Å; F314-A318 HydrophobicContact CZ-CB 4.35Å; F314-A318 WeakPolarHBondContact O-CB 3.16Å; F314-A318 PolarHBondContact O-N 3.27Å; M315-A318 PolarHBondContact O-N 2.94Å; A318-I320 VanDerWaalsContact C-N 3.33Å; A318-I320 PolarHBondContact O-N 3Å; A318-L321 PolarHBondContact O-N 2.8Å; A318-A322 VanDerWaalsContact O-CB 3.24Å; A318-A322 WeakPolarHBondContact O-CB 3.45Å; A318-A322 PolarHBondContact O-N 2.85Å; A318-L364 HydrophobicContact CB-CD1 4.49Å; A318-P579 HydrophobicContact CB-CB 3.63Å; A318-P579 HydrophobicContact CB-CG 4.44Å; A318-T583 HydrophobicContact CB-CG2 3.93Å; A318-T583 WeakPolarHBondContact O-CG2 3.22Å
319	W	93.3	Very high	90.8	Very high	56 Å²	56	54.7 Å²	54.7	21%	0.212	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-38.1	178.7	79.7	-110.7	0	0	0	111.6	M315 W316 I323 L364 A365	M315-W319 PolarHBondContact O-N 3.33Å; W316-W319 VanDerWaalsContact CA-CD1 3.49Å; W316-W319 AromaticContact CD2-NE1 3.67Å; W316-W319 AromaticContact CE3-CE2 3.74Å; W316-W319 AromaticContact CE3-CZ2 3.67Å; W316-W319 HydrophobicContact CE3-CZ2 3.67Å; W316-W319 AromaticContact CE3-NE1 3.23Å; W316-W319 AromaticContact CZ3-CZ2 3.58Å; W316-W319 HydrophobicContact CZ3-CZ2 3.58Å; W316-W319 AromaticContact CZ3-NE1 3.82Å; W316-W319 PolarHBondContact O-NE1 3.27Å; W319-I323 HydrophobicContact CE3-CD1 3.74Å; W319-I323 HydrophobicContact CE3-CG1 4.42Å; W319-I323 HydrophobicContact CZ3-CD1 4.12Å; W319-I323 WeakPolarHBondContact O-CB 3.48Å; W319-I323 VanDerWaalsContact O-CG1 3.32Å; W319-I323 WeakPolarHBondContact O-CG1 3.46Å; W319-I323 PolarHBondContact O-N 3.44Å; W319-L364 HydrophobicContact CB-CB 3.66Å; W319-A365 HydrophobicContact CB-CB 4.18Å; W319-A365 HydrophobicContact CD2-CB 3.88Å; W319-A365 HydrophobicContact CE3-CB 3.89Å; W319-A365 HydrophobicContact CG-CB 4.01Å
320	I	94.4	Very high	91	Very high	71 Å²	71	52.2 Å²	52.2	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-50.2	177.2	-66.8	170	0	0	0	109.9	W316 L317 A318 I323 V324	W316-I320 VanDerWaalsContact O-CD1 3.31Å; W316-I320 WeakPolarHBondContact O-CD1 3.47Å; W316-I320 WeakPolarHBondContact O-CG1 3.46Å; W316-I320 PolarHBondContact O-N 3.37Å; L317-I320 PolarHBondContact O-N 3.47Å; A318-I320 VanDerWaalsContact C-N 3.33Å; A318-I320 PolarHBondContact O-N 3Å; I320-I323 PolarHBondContact O-N 2.88Å; I320-V324 HydrophobicContact CG2-CG2 4.18Å; I320-V324 VanDerWaalsContact O-CB 3.29Å; I320-V324 WeakPolarHBondContact O-CB 3.24Å; I320-V324 VanDerWaalsContact O-CG2 3.26Å; I320-V324 WeakPolarHBondContact O-CG2 3.4Å; I320-V324 PolarHBondContact O-N 2.89Å
321	L	92.1	Very high	91	Very high	76 Å²	76	48.1 Å²	48.1	40%	0.398	26%	0.262	S	S	.	.	H	α-helix	trans	-63.6	-42.9	-179.2	-70.2	177.1	0	0	0	112	L317 A318 G325 T583 F587	L317-L321 WeakPolarHBondContact O-CB 3.26Å; L317-L321 VanDerWaalsContact O-CG 3.27Å; L317-L321 WeakPolarHBondContact O-CG 3.48Å; L317-L321 PolarHBondContact O-N 3.36Å; A318-L321 PolarHBondContact O-N 2.8Å; L321-G325 WeakPolarHBondContact O-CA 3.39Å; L321-G325 PolarHBondContact O-N 3.44Å; L321-T583 HydrophobicContact CB-CG2 3.98Å; L321-F587 HydrophobicContact CD2-CZ 4.24Å
322	A	92.2	Very high	91	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.1	-47.4	177.6	0	0	0	0	0	111.4	A318 N326 A582 T583	A318-A322 VanDerWaalsContact O-CB 3.24Å; A318-A322 WeakPolarHBondContact O-CB 3.45Å; A318-A322 PolarHBondContact O-N 2.85Å; A322-N326 VanDerWaalsContact O-CB 3.24Å; A322-N326 WeakPolarHBondContact O-CB 3.28Å; A322-N326 PolarHBondContact O-N 2.94Å; A322-N326 VanDerWaalsContact O-N 3.14Å; A322-N326 PolarHBondContact O-ND2 2.83Å; A322-A582 HydrophobicContact CB-CB 4.12Å; A322-T583 HydrophobicContact CB-CG2 4.01Å
323	I	94.6	Very high	90.8	Very high	26 Å²	26	48.6 Å²	48.6	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-66.4	-54.3	179.4	-69.3	-174.8	0	0	0	110.9	W319 I320 G325 I327 F358 L362 A365	W319-I323 HydrophobicContact CE3-CD1 3.74Å; W319-I323 HydrophobicContact CE3-CG1 4.42Å; W319-I323 HydrophobicContact CZ3-CD1 4.12Å; W319-I323 WeakPolarHBondContact O-CB 3.48Å; W319-I323 VanDerWaalsContact O-CG1 3.32Å; W319-I323 WeakPolarHBondContact O-CG1 3.46Å; W319-I323 PolarHBondContact O-N 3.44Å; I320-I323 PolarHBondContact O-N 2.88Å; I323-G325 PolarHBondContact O-N 3.44Å; I323-I327 HydrophobicContact CG2-CD1 3.56Å; I323-I327 HydrophobicContact CG2-CG1 4.38Å; I323-I327 VanDerWaalsContact O-CB 3.29Å; I323-I327 WeakPolarHBondContact O-CB 3.43Å; I323-I327 WeakPolarHBondContact O-CG1 3.48Å; I323-I327 PolarHBondContact O-N 3.32Å; I323-F358 HydrophobicContact CG1-CD2 4.33Å; I323-F358 HydrophobicContact CG1-CE2 4.45Å; I323-F358 HydrophobicContact CG2-CD2 4.26Å; I323-F358 HydrophobicContact CG2-CE2 4.11Å; I323-L362 HydrophobicContact CD1-CD2 3.9Å; I323-A365 HydrophobicContact CD1-CB 4.37Å
324	V	93.2	Very high	90.6	Very high	97 Å²	97	46 Å²	46	59%	0.588	26%	0.261	S	S	*	.	H	α-helix	trans	-64.6	-45.2	-174.8	174.3	0	0	0	0	111	I320 G328	I320-V324 HydrophobicContact CG2-CG2 4.18Å; I320-V324 VanDerWaalsContact O-CB 3.29Å; I320-V324 WeakPolarHBondContact O-CB 3.24Å; I320-V324 VanDerWaalsContact O-CG2 3.26Å; I320-V324 WeakPolarHBondContact O-CG2 3.4Å; I320-V324 PolarHBondContact O-N 2.89Å; V324-G328 PolarHBondContact O-N 2.97Å
325	G	90.3	Very high	90.4	Very high	21 Å²	21	46.6 Å²	46.6	22%	0.216	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-50.2	-179.8	0	0	0	0	0	112	L321 I323 G328 V329	L321-G325 WeakPolarHBondContact O-CA 3.39Å; L321-G325 PolarHBondContact O-N 3.44Å; I323-G325 PolarHBondContact O-N 3.44Å; G325-G328 PolarHBondContact O-N 2.9Å; G325-V329 WeakPolarHBondContact O-CG2 3.23Å; G325-V329 PolarHBondContact O-N 2.95Å
326	N	92.1	Very high	90.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-74.1	-35.1	-176.7	-71.4	-63.4	0	0	0	113.2	A322 G328 V329 L330 A354 D357 F358 A582 P586	A322-N326 VanDerWaalsContact O-CB 3.24Å; A322-N326 WeakPolarHBondContact O-CB 3.28Å; A322-N326 PolarHBondContact O-N 2.94Å; A322-N326 VanDerWaalsContact O-N 3.14Å; A322-N326 PolarHBondContact O-ND2 2.83Å; N326-G328 VanDerWaalsContact C-N 3.27Å; N326-G328 PolarHBondContact O-N 3.5Å; N326-V329 PolarHBondContact O-N 3.38Å; N326-L330 WeakPolarHBondContact O-CG 3.28Å; N326-L330 PolarHBondContact O-N 2.87Å; N326-A354 HydrophobicContact CB-CB 4.28Å; N326-A354 VanDerWaalsContact CB-O 3.28Å; N326-A354 WeakPolarHBondContact CB-O 3.35Å; N326-A354 WeakPolarHBondContact OD1-CA 3.24Å; N326-D357 WeakPolarHBondContact ND2-CB 3.32Å; N326-F358 HydrophobicContact CB-CB 4.04Å; N326-A582 PolarHBondContact ND2-O 2.89Å; N326-P586 HydrophobicContact CB-CG 4.49Å; N326-P586 WeakPolarHBondContact OD1-CG 3.03Å
327	I	93.6	Very high	89.6	Confident	80 Å²	80	44.7 Å²	44.7	41%	0.41	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-41.8	168.2	-71.3	175.3	0	0	0	110.2	I323 V329 L330 A331 F358	I323-I327 HydrophobicContact CG2-CD1 3.56Å; I323-I327 HydrophobicContact CG2-CG1 4.38Å; I323-I327 VanDerWaalsContact O-CB 3.29Å; I323-I327 WeakPolarHBondContact O-CB 3.43Å; I323-I327 WeakPolarHBondContact O-CG1 3.48Å; I323-I327 PolarHBondContact O-N 3.32Å; I327-V329 VanDerWaalsContact C-N 3.33Å; I327-V329 PolarHBondContact O-N 3.42Å; I327-L330 PolarHBondContact O-N 3.49Å; I327-A331 VanDerWaalsContact O-CB 3.24Å; I327-A331 WeakPolarHBondContact O-CB 3.46Å; I327-A331 PolarHBondContact O-N 3.4Å; I327-F358 HydrophobicContact CD1-CD2 4.13Å; I327-F358 HydrophobicContact CD1-CE2 3.85Å; I327-F358 HydrophobicContact CG1-CD2 3.85Å; I327-F358 HydrophobicContact CG1-CE2 4.04Å
328	G	89.1	Confident	89.4	Confident	40 Å²	40	46.4 Å²	46.4	41%	0.412	28%	0.276	S	S	.	.	H	α-helix	trans	-58.4	-42.9	176	0	0	0	0	0	112.8	V324 G325 N326 L332	V324-G328 PolarHBondContact O-N 2.97Å; G325-G328 PolarHBondContact O-N 2.9Å; N326-G328 VanDerWaalsContact C-N 3.27Å; N326-G328 PolarHBondContact O-N 3.5Å; G328-L332 VanDerWaalsContact O-CB 3.27Å; G328-L332 WeakPolarHBondContact O-CB 3.35Å; G328-L332 PolarHBondContact O-N 3.45Å
329	V	88.1	Confident	89.1	Confident	14 Å²	14	48.9 Å²	48.9	9%	0.085	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-47.4	176	175.3	0	0	0	0	111.2	G325 N326 I327 L332 F333 V350 A354 P586 Y589	G325-V329 WeakPolarHBondContact O-CG2 3.23Å; G325-V329 PolarHBondContact O-N 2.95Å; N326-V329 PolarHBondContact O-N 3.38Å; I327-V329 VanDerWaalsContact C-N 3.33Å; I327-V329 PolarHBondContact O-N 3.42Å; V329-L332 WeakPolarHBondContact O-CB 3.32Å; V329-L332 PolarHBondContact O-N 2.82Å; V329-F333 HydrophobicContact CG1-CD2 3.83Å; V329-F333 HydrophobicContact CG1-CE2 3.71Å; V329-F333 VanDerWaalsContact O-CD2 3.28Å; V329-F333 WeakPolarHBondContact O-CD2 3.49Å; V329-F333 PolarHBondContact O-N 3.32Å; V329-V350 HydrophobicContact CG1-CG1 3.99Å; V329-A354 HydrophobicContact CB-CB 4.1Å; V329-A354 HydrophobicContact CG1-CB 3.82Å; V329-P586 HydrophobicContact CG2-CB 4.32Å; V329-Y589 HydrophobicContact CG1-CD2 4.17Å; V329-Y589 HydrophobicContact CG2-CD2 3.89Å
330	L	91.3	Very high	88.4	Confident	47 Å²	47	49.4 Å²	49.4	25%	0.246	32%	0.319	C	S	.	.	H	α-helix	trans	-61.6	-46	177.8	-69.6	172.8	0	0	0	111.8	N326 I327 L332 F333 A334 S351 A354 F355	N326-L330 WeakPolarHBondContact O-CG 3.28Å; N326-L330 PolarHBondContact O-N 2.87Å; I327-L330 PolarHBondContact O-N 3.49Å; L330-L332 VanDerWaalsContact C-N 3.32Å; L330-L332 PolarHBondContact O-N 2.88Å; L330-F333 PolarHBondContact O-N 3.38Å; L330-A334 WeakPolarHBondContact O-CB 3.46Å; L330-A334 PolarHBondContact O-N 2.97Å; L330-S351 VanDerWaalsContact CD2-O 3.27Å; L330-S351 WeakPolarHBondContact CD2-O 3.33Å; L330-A354 HydrophobicContact CD2-CB 4.14Å; L330-A354 HydrophobicContact CG-CB 4.12Å; L330-F355 HydrophobicContact CD2-CB 4.49Å
331	A	89.2	Confident	87.5	Confident	54 Å²	54	51 Å²	51	45%	0.446	32%	0.32	S	S	.	.	H	α-helix	trans	-62.8	-39	177.3	0	0	0	0	0	111.6	I327 W335	I327-A331 VanDerWaalsContact O-CB 3.24Å; I327-A331 WeakPolarHBondContact O-CB 3.46Å; I327-A331 PolarHBondContact O-N 3.4Å; A331-W335 WeakPolarHBondContact O-CB 3Å; A331-W335 PolarHBondContact O-N 2.89Å
332	L	85.2	Confident	86.5	Confident	43 Å²	43	59.3 Å²	59.3	23%	0.225	35%	0.347	C	S	.	.	H	α-helix	trans	-61.8	-49.5	175.6	177.9	61.8	0	0	0	111.3	G328 V329 L330 W335 L336 L596	G328-L332 VanDerWaalsContact O-CB 3.27Å; G328-L332 WeakPolarHBondContact O-CB 3.35Å; G328-L332 PolarHBondContact O-N 3.45Å; V329-L332 WeakPolarHBondContact O-CB 3.32Å; V329-L332 PolarHBondContact O-N 2.82Å; L330-L332 VanDerWaalsContact C-N 3.32Å; L330-L332 PolarHBondContact O-N 2.88Å; L332-W335 HydrophobicContact CD1-CE3 4.49Å; L332-W335 PolarHBondContact O-N 3.35Å; L332-L336 HydrophobicContact CD1-CD1 4.33Å; L332-L336 HydrophobicContact CD1-CG 4.36Å; L332-L336 HydrophobicContact CG-CD1 4.21Å; L332-L336 WeakPolarHBondContact O-CB 3.29Å; L332-L336 VanDerWaalsContact O-CG 3.24Å; L332-L336 WeakPolarHBondContact O-CG 3.44Å; L332-L336 PolarHBondContact O-N 2.88Å; L332-L596 HydrophobicContact CD2-CD2 3.42Å; L332-L596 VanDerWaalsContact CD2-CD2 3.42Å; L332-L596 HydrophobicContact CD2-CG 4.16Å; L332-L596 HydrophobicContact CG-CD2 4.44Å
333	F	85.1	Confident	85.7	Confident	25 Å²	25	61 Å²	61	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-68	-37.7	179	-77.2	-64	0	0	0	113	V329 L330 L336 A337 V343 V350 S351 L596	V329-F333 HydrophobicContact CG1-CD2 3.83Å; V329-F333 HydrophobicContact CG1-CE2 3.71Å; V329-F333 VanDerWaalsContact O-CD2 3.28Å; V329-F333 WeakPolarHBondContact O-CD2 3.49Å; V329-F333 PolarHBondContact O-N 3.32Å; L330-F333 PolarHBondContact O-N 3.38Å; F333-L336 HydrophobicContact CD1-CD1 4.22Å; F333-L336 PolarHBondContact O-N 3.01Å; F333-A337 WeakPolarHBondContact O-CB 3.38Å; F333-A337 PolarHBondContact O-N 3.15Å; F333-V343 HydrophobicContact CD1-CG1 3.79Å; F333-V343 HydrophobicContact CD1-CG2 4.31Å; F333-V343 HydrophobicContact CE1-CG1 4.33Å; F333-V350 HydrophobicContact CE2-CB 4.13Å; F333-V350 HydrophobicContact CE2-CG1 3.58Å; F333-V350 HydrophobicContact CZ-CB 4.39Å; F333-V350 HydrophobicContact CZ-CG1 4.15Å; F333-S351 WeakPolarHBondContact CD2-OG 3.31Å; F333-L596 HydrophobicContact CE1-CD1 4.48Å
334	A	87	Confident	84.9	Confident	51 Å²	51	61.5 Å²	61.5	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-62.4	-43.4	173.5	0	0	0	0	0	111.5	L330 A337 N338	L330-A334 WeakPolarHBondContact O-CB 3.46Å; L330-A334 PolarHBondContact O-N 2.97Å; A334-A337 PolarHBondContact O-N 3.01Å; A334-N338 WeakPolarHBondContact O-CB 3.36Å; A334-N338 VanDerWaalsContact O-CG 3.3Å; A334-N338 PolarHBondContact O-N 3.28Å; A334-N338 PolarHBondContact O-ND2 3.43Å
335	W	84.9	Confident	84.5	Confident	64 Å²	64	57.4 Å²	57.4	24%	0.242	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-44.1	175.8	178.4	80	0	0	0	112.2	A331 L332 A337 N338 A339 S603	A331-W335 WeakPolarHBondContact O-CB 3Å; A331-W335 PolarHBondContact O-N 2.89Å; L332-W335 HydrophobicContact CD1-CE3 4.49Å; L332-W335 PolarHBondContact O-N 3.35Å; W335-A337 VanDerWaalsContact C-N 3.32Å; W335-A337 PolarHBondContact O-N 3.48Å; W335-N338 PolarHBondContact O-N 3.16Å; W335-A339 WeakPolarHBondContact O-CB 3.08Å; W335-A339 PolarHBondContact O-N 3.26Å; W335-S603 WeakPolarHBondContact CH2-OG 3.44Å; W335-S603 WeakPolarHBondContact CZ3-OG 3.3Å
336	L	82.1	Confident	84	Confident	9 Å²	9	59.2 Å²	59.2	5%	0.047	35%	0.353	C	S	.	.	H	α-helix	trans	-59.8	-42.5	175.8	-71.6	171.8	0	0	0	111.6	L332 F333 A339 R341 V343 L596	L332-L336 HydrophobicContact CD1-CD1 4.33Å; L332-L336 HydrophobicContact CD1-CG 4.36Å; L332-L336 HydrophobicContact CG-CD1 4.21Å; L332-L336 WeakPolarHBondContact O-CB 3.29Å; L332-L336 VanDerWaalsContact O-CG 3.24Å; L332-L336 WeakPolarHBondContact O-CG 3.44Å; L332-L336 PolarHBondContact O-N 2.88Å; F333-L336 HydrophobicContact CD1-CD1 4.22Å; F333-L336 PolarHBondContact O-N 3.01Å; L336-A339 PolarHBondContact O-N 3.37Å; L336-R341 HydrophobicContact CB-CB 4.49Å; L336-R341 WeakPolarHBondContact O-CB 3.42Å; L336-R341 PolarHBondContact O-N 3.49Å; L336-V343 HydrophobicContact CB-CG2 4.07Å; L336-L596 HydrophobicContact CD1-CD1 3.98Å
337	A	82.3	Confident	83.4	Confident	53 Å²	53	59.5 Å²	59.5	44%	0.438	36%	0.357	S	S	.	.	H	α-helix	trans	-63	-46.3	175.9	0	0	0	0	0	111.7	F333 A334 W335 A339 G340 V343	F333-A337 WeakPolarHBondContact O-CB 3.38Å; F333-A337 PolarHBondContact O-N 3.15Å; A334-A337 PolarHBondContact O-N 3.01Å; W335-A337 VanDerWaalsContact C-N 3.32Å; W335-A337 PolarHBondContact O-N 3.48Å; A337-A339 VanDerWaalsContact C-N 3.29Å; A337-A339 PolarHBondContact O-N 3.39Å; A337-G340 PolarHBondContact O-N 3Å; A337-V343 HydrophobicContact CB-CG2 4.13Å
338	N	86.6	Confident	83.2	Confident	145 Å²	145	58.4 Å²	58.4	78%	0.775	35%	0.349	S	S	*	.	H	α-helix	trans	-64.6	-32.1	177.6	-72.8	-15.3	0	0	0	112.9	A334 W335 G340	A334-N338 WeakPolarHBondContact O-CB 3.36Å; A334-N338 VanDerWaalsContact O-CG 3.3Å; A334-N338 PolarHBondContact O-N 3.28Å; A334-N338 PolarHBondContact O-ND2 3.43Å; W335-N338 PolarHBondContact O-N 3.16Å; N338-G340 PolarHBondContact O-N 3.19Å
339	A	83.8	Confident	83.1	Confident	55 Å²	55	56.6 Å²	56.6	46%	0.455	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	6.8	174.5	0	0	0	0	0	113.6	W335 L336 A337 R341	W335-A339 WeakPolarHBondContact O-CB 3.08Å; W335-A339 PolarHBondContact O-N 3.26Å; L336-A339 PolarHBondContact O-N 3.37Å; A337-A339 VanDerWaalsContact C-N 3.29Å; A337-A339 PolarHBondContact O-N 3.39Å; A339-R341 VanDerWaalsContact C-N 3.25Å; A339-R341 PolarHBondContact O-N 3.19Å
340	G	79.6	Confident	82.9	Confident	67 Å²	67	56.6 Å²	56.6	69%	0.691	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	12.2	-179.5	0	0	0	0	0	114.2	A337 N338	A337-G340 PolarHBondContact O-N 3Å; N338-G340 PolarHBondContact O-N 3.19Å
341	R	75.9	Confident	82.9	Confident	103 Å²	103	55.7 Å²	55.7	39%	0.389	33%	0.327	S	S	.	.			trans	-81.5	138.3	177.2	-61.4	-177.3	179.1	-146.1	-0.6	109.7	L336 A339 V343 Q599	L336-R341 HydrophobicContact CB-CB 4.49Å; L336-R341 WeakPolarHBondContact O-CB 3.42Å; L336-R341 PolarHBondContact O-N 3.49Å; A339-R341 VanDerWaalsContact C-N 3.25Å; A339-R341 PolarHBondContact O-N 3.19Å; R341-V343 PolarHBondContact O-N 3.46Å; R341-Q599 VanDerWaalsContact NH1-OE1 3.09Å
342	R	69.7	Low	83.1	Confident	251 Å²	251	53.9 Å²	53.9	95%	0.947	31%	0.31	S	S	*	.			trans	-70.5	98.1	178.5	-65.6	-174.3	-172.3	174.5	2.9	110.3	G344	R342-G344 PolarHBondContact O-N 3.22Å
343	V	75.1	Confident	83.3	Confident	35 Å²	35	51.9 Å²	51.9	21%	0.212	30%	0.299	C	S	.	.			trans	-70.7	105.8	163.8	-178.6	0	0	0	0	106.7	F333 L336 A337 R341 W445	F333-V343 HydrophobicContact CD1-CG1 3.79Å; F333-V343 HydrophobicContact CD1-CG2 4.31Å; F333-V343 HydrophobicContact CE1-CG1 4.33Å; L336-V343 HydrophobicContact CB-CG2 4.07Å; A337-V343 HydrophobicContact CB-CG2 4.13Å; R341-V343 PolarHBondContact O-N 3.46Å; V343-W445 WeakPolarHBondContact O-CH2 3.08Å; V343-W445 WeakPolarHBondContact O-CZ2 3.48Å
344	G	79.5	Confident	83.7	Confident	38 Å²	38	50.7 Å²	50.7	39%	0.392	29%	0.294	S	S	.	.			trans	-69.3	175.9	178.3	0	0	0	0	0	112.8	R342 S346 G347 F348 W445	R342-G344 PolarHBondContact O-N 3.22Å; G344-S346 PolarHBondContact O-N 3.29Å; G344-S346 VanDerWaalsContact O-N 3.09Å; G344-G347 PolarHBondContact O-N 3.1Å; G344-F348 PolarHBondContact O-N 3.47Å; G344-W445 VanDerWaalsContact C-CZ2 3.42Å
345	V	83.7	Confident	84.1	Confident	10 Å²	10	51.3 Å²	51.3	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-52.4	-35.8	177.3	-180	0	0	0	0	112.5	G347 F348 L349 F443 W445 A448	V345-G347 VanDerWaalsContact C-N 3.34Å; V345-G347 PolarHBondContact O-N 2.99Å; V345-F348 WeakPolarHBondContact O-CB 3.36Å; V345-F348 PolarHBondContact O-N 3.26Å; V345-L349 HydrophobicContact CG1-CD1 4.24Å; V345-L349 HydrophobicContact CG1-CG 4.35Å; V345-L349 WeakPolarHBondContact O-CG 3.37Å; V345-L349 PolarHBondContact O-N 3.47Å; V345-F443 HydrophobicContact CG1-CD1 3.69Å; V345-F443 HydrophobicContact CG1-CE1 3.67Å; V345-W445 HydrophobicContact CG2-CD2 3.6Å; V345-W445 HydrophobicContact CG2-CE3 4.12Å; V345-W445 HydrophobicContact CG2-CG 3.8Å; V345-W445 HydrophobicContact CG2-CZ2 4.2Å; V345-A448 HydrophobicContact CG1-CB 3.47Å; V345-A448 VanDerWaalsContact CG1-CB 3.47Å
346	S	79.3	Confident	84.5	Confident	59 Å²	59	48.2 Å²	48.2	41%	0.413	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-41.6	176.3	-49.6	0	0	0	0	112.3	G344 F348 L349 V350	G344-S346 PolarHBondContact O-N 3.29Å; G344-S346 VanDerWaalsContact O-N 3.09Å; S346-F348 VanDerWaalsContact C-N 3.35Å; S346-L349 PolarHBondContact O-N 3.04Å; S346-V350 WeakPolarHBondContact O-CB 3.49Å; S346-V350 VanDerWaalsContact O-CG2 3.22Å; S346-V350 WeakPolarHBondContact O-CG2 3.42Å; S346-V350 PolarHBondContact O-N 3.31Å
347	G	80.9	Confident	85	Confident	7 Å²	7	47.8 Å²	47.8	7%	0.072	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-37.3	176.1	0	0	0	0	0	112.1	G344 V345 V350 S351	G344-G347 PolarHBondContact O-N 3.1Å; V345-G347 VanDerWaalsContact C-N 3.34Å; V345-G347 PolarHBondContact O-N 2.99Å; G347-V350 PolarHBondContact O-N 2.87Å; G347-S351 WeakPolarHBondContact O-CB 3.43Å; G347-S351 PolarHBondContact O-N 3.46Å; G347-S351 PolarHBondContact O-OG 3.17Å
348	F	88	Confident	85.6	Confident	57 Å²	57	47.4 Å²	47.4	25%	0.25	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-45.6	173.3	170.3	-104.1	0	0	0	112.7	G344 V345 S346 S351 N352 W445 A448 I449 Q452	G344-F348 PolarHBondContact O-N 3.47Å; V345-F348 WeakPolarHBondContact O-CB 3.36Å; V345-F348 PolarHBondContact O-N 3.26Å; S346-F348 VanDerWaalsContact C-N 3.35Å; F348-S351 PolarHBondContact O-N 3.43Å; F348-N352 WeakPolarHBondContact CE2-ND2 3.39Å; F348-N352 PolarHBondContact O-N 3.31Å; F348-N352 VanDerWaalsContact O-N 3.14Å; F348-N352 PolarHBondContact O-ND2 3.33Å; F348-W445 HydrophobicContact CB-CH2 4.07Å; F348-W445 HydrophobicContact CB-CZ3 3.68Å; F348-W445 HydrophobicContact CG-CZ3 4.04Å; F348-A448 HydrophobicContact CD1-CB 4.27Å; F348-A448 HydrophobicContact CE1-CB 4.32Å; F348-I449 HydrophobicContact CE1-CG1 4.46Å; F348-I449 HydrophobicContact CZ-CG1 4.35Å; F348-Q452 HydrophobicContact CD1-CG 4.49Å; F348-Q452 HydrophobicContact CE1-CB 4.09Å; F348-Q452 HydrophobicContact CE1-CG 3.54Å; F348-Q452 HydrophobicContact CZ-CB 4.09Å; F348-Q452 HydrophobicContact CZ-CG 3.97Å
349	L	87.8	Confident	86.1	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-42.4	177.4	-66.7	175.9	0	0	0	111.7	V345 S346 S351 N352 L353 T408 A411 I412 K415 F443 Q452	V345-L349 HydrophobicContact CG1-CD1 4.24Å; V345-L349 HydrophobicContact CG1-CG 4.35Å; V345-L349 WeakPolarHBondContact O-CG 3.37Å; V345-L349 PolarHBondContact O-N 3.47Å; S346-L349 PolarHBondContact O-N 3.04Å; L349-S351 VanDerWaalsContact C-N 3.33Å; L349-S351 PolarHBondContact O-N 3.11Å; L349-N352 PolarHBondContact O-N 3.49Å; L349-L353 PolarHBondContact O-N 3.49Å; L349-T408 VanDerWaalsContact O-CG2 3.28Å; L349-T408 WeakPolarHBondContact O-CG2 3.45Å; L349-A411 HydrophobicContact CD2-CB 4Å; L349-I412 HydrophobicContact CB-CD1 4.43Å; L349-I412 HydrophobicContact CB-CG1 3.84Å; L349-I412 HydrophobicContact CD1-CG1 4.1Å; L349-K415 HydrophobicContact CD1-CB 4.08Å; L349-K415 HydrophobicContact CD1-CG 4.37Å; L349-F443 HydrophobicContact CD1-CE1 4.35Å; L349-Q452 HydrophobicContact CD2-CG 3.9Å
350	V	85	Confident	86.4	Confident	14 Å²	14	38.2 Å²	38.2	9%	0.085	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-39.3	175.6	170.2	0	0	0	0	111.5	V329 F333 S346 G347 N352 L353 A354 Y589	V329-V350 HydrophobicContact CG1-CG1 3.99Å; F333-V350 HydrophobicContact CE2-CB 4.13Å; F333-V350 HydrophobicContact CE2-CG1 3.58Å; F333-V350 HydrophobicContact CZ-CB 4.39Å; F333-V350 HydrophobicContact CZ-CG1 4.15Å; S346-V350 WeakPolarHBondContact O-CB 3.49Å; S346-V350 VanDerWaalsContact O-CG2 3.22Å; S346-V350 WeakPolarHBondContact O-CG2 3.42Å; S346-V350 PolarHBondContact O-N 3.31Å; G347-V350 PolarHBondContact O-N 2.87Å; V350-N352 VanDerWaalsContact C-N 3.33Å; V350-N352 PolarHBondContact O-N 3.34Å; V350-L353 PolarHBondContact O-N 3.26Å; V350-A354 WeakPolarHBondContact O-CB 3.33Å; V350-A354 PolarHBondContact O-N 2.95Å; V350-Y589 HydrophobicContact CB-CD1 4.49Å; V350-Y589 HydrophobicContact CB-CE1 4.2Å; V350-Y589 HydrophobicContact CG1-CD1 3.55Å; V350-Y589 HydrophobicContact CG1-CD2 4.05Å; V350-Y589 HydrophobicContact CG1-CE1 3.49Å; V350-Y589 VanDerWaalsContact CG1-CE1 3.49Å; V350-Y589 HydrophobicContact CG1-CE2 4.03Å; V350-Y589 HydrophobicContact CG1-CG 3.85Å; V350-Y589 HydrophobicContact CG2-CD1 4.08Å; V350-Y589 HydrophobicContact CG2-CE1 3.75Å
351	S	89.5	Confident	87.1	Confident	27 Å²	27	35 Å²	35	19%	0.189	17%	0.173	C	C	.	.	H	α-helix	trans	-63.3	-37.7	174.5	-66.5	0	0	0	0	112.5	L330 F333 G347 F348 L349 F355	L330-S351 VanDerWaalsContact CD2-O 3.27Å; L330-S351 WeakPolarHBondContact CD2-O 3.33Å; F333-S351 WeakPolarHBondContact CD2-OG 3.31Å; G347-S351 WeakPolarHBondContact O-CB 3.43Å; G347-S351 PolarHBondContact O-N 3.46Å; G347-S351 PolarHBondContact O-OG 3.17Å; F348-S351 PolarHBondContact O-N 3.43Å; L349-S351 VanDerWaalsContact C-N 3.33Å; L349-S351 PolarHBondContact O-N 3.11Å; S351-F355 WeakPolarHBondContact O-CB 3.46Å; S351-F355 PolarHBondContact O-N 2.92Å
352	N	93.4	Very high	88.1	Confident	17 Å²	17	33 Å²	33	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-40.8	174.9	-81.8	-97.3	0	0	0	111.6	F348 L349 V350 F355 A356 T408 Q452 W456	F348-N352 WeakPolarHBondContact CE2-ND2 3.39Å; F348-N352 PolarHBondContact O-N 3.31Å; F348-N352 VanDerWaalsContact O-N 3.14Å; F348-N352 PolarHBondContact O-ND2 3.33Å; L349-N352 PolarHBondContact O-N 3.49Å; V350-N352 VanDerWaalsContact C-N 3.33Å; V350-N352 PolarHBondContact O-N 3.34Å; N352-F355 PolarHBondContact O-N 3.04Å; N352-A356 PolarHBondContact O-N 2.89Å; N352-T408 HydrophobicContact CB-CG2 4.03Å; N352-Q452 VanDerWaalsContact CG-NE2 3.32Å; N352-Q452 PolarHBondContact OD1-NE2 2.86Å; N352-W456 PolarHBondContact OD1-NE1 2.92Å
353	L	90.4	Very high	89.3	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.4	-45.8	176.9	-173.2	48.8	0	0	0	111	L349 V350 F355 A356 D357 T408 I412 L540 Y589	L349-L353 PolarHBondContact O-N 3.49Å; V350-L353 PolarHBondContact O-N 3.26Å; L353-F355 VanDerWaalsContact C-N 3.29Å; L353-F355 PolarHBondContact O-N 3.5Å; L353-A356 WeakPolarHBondContact O-CB 3.46Å; L353-A356 PolarHBondContact O-N 2.71Å; L353-A356 VanDerWaalsContact O-N 3.1Å; L353-D357 PolarHBondContact O-N 2.95Å; L353-T408 HydrophobicContact CB-CG2 3.87Å; L353-I412 HydrophobicContact CD2-CD1 3.76Å; L353-L540 HydrophobicContact CD2-CD2 3.94Å; L353-Y589 WeakPolarHBondContact CD2-OH 3.18Å; L353-Y589 WeakPolarHBondContact CG-OH 3.49Å
354	A	92.7	Very high	90.1	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.3	-37.6	174.4	0	0	0	0	0	112.5	N326 V329 L330 V350 F358	N326-A354 HydrophobicContact CB-CB 4.28Å; N326-A354 VanDerWaalsContact CB-O 3.28Å; N326-A354 WeakPolarHBondContact CB-O 3.35Å; N326-A354 WeakPolarHBondContact OD1-CA 3.24Å; V329-A354 HydrophobicContact CB-CB 4.1Å; V329-A354 HydrophobicContact CG1-CB 3.82Å; L330-A354 HydrophobicContact CD2-CB 4.14Å; L330-A354 HydrophobicContact CG-CB 4.12Å; V350-A354 WeakPolarHBondContact O-CB 3.33Å; V350-A354 PolarHBondContact O-N 2.95Å; A354-F358 VanDerWaalsContact O-CB 3.3Å; A354-F358 WeakPolarHBondContact O-CB 3.4Å; A354-F358 PolarHBondContact O-N 3.43Å
355	F	95.4	Very high	90.8	Very high	64 Å²	64	19 Å²	19	28%	0.281	11%	0.105	S	C	.	.	H	α-helix	trans	-64.8	-43.9	174.4	177.3	-95.8	0	0	0	112.3	L330 S351 N352 L353 F358 C359 F400 L404 W456	L330-F355 HydrophobicContact CD2-CB 4.49Å; S351-F355 WeakPolarHBondContact O-CB 3.46Å; S351-F355 PolarHBondContact O-N 2.92Å; N352-F355 PolarHBondContact O-N 3.04Å; L353-F355 VanDerWaalsContact C-N 3.29Å; L353-F355 PolarHBondContact O-N 3.5Å; F355-F358 HydrophobicContact CD2-CD1 4.46Å; F355-F358 HydrophobicContact CE2-CD1 4.49Å; F355-F358 WeakPolarHBondContact O-CB 3.29Å; F355-F358 PolarHBondContact O-N 2.96Å; F355-C359 PolarHBondContact O-N 3.49Å; F355-F400 AromaticContact CE1-CE1 3.9Å; F355-F400 HydrophobicContact CE1-CE1 3.9Å; F355-F400 HydrophobicContact CE1-CZ 4.07Å; F355-L404 HydrophobicContact CD1-CD2 4.08Å; F355-L404 HydrophobicContact CE1-CD2 4.5Å; F355-W456 AromaticContact CD1-CH2 3.69Å; F355-W456 HydrophobicContact CD1-CH2 3.69Å; F355-W456 AromaticContact CD1-CZ2 3.69Å; F355-W456 HydrophobicContact CD1-CZ2 3.69Å; F355-W456 AromaticContact CE1-CH2 3.2Å; F355-W456 HydrophobicContact CE1-CH2 3.2Å; F355-W456 AromaticContact CE1-CZ2 3.73Å; F355-W456 HydrophobicContact CE1-CZ2 3.73Å; F355-W456 HydrophobicContact CE1-CZ3 4.07Å; F355-W456 AromaticContact CZ-CH2 3.84Å; F355-W456 HydrophobicContact CZ-CH2 3.84Å
356	A	94.4	Very high	91.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.3	-43.4	176.8	0	0	0	0	0	111.6	N352 L353 F358 C359 T360 S401 L404 S405	N352-A356 PolarHBondContact O-N 2.89Å; L353-A356 WeakPolarHBondContact O-CB 3.46Å; L353-A356 PolarHBondContact O-N 2.71Å; L353-A356 VanDerWaalsContact O-N 3.1Å; A356-F358 VanDerWaalsContact C-N 3.35Å; A356-F358 PolarHBondContact O-N 3.39Å; A356-C359 WeakPolarHBondContact O-CA 3.36Å; A356-C359 WeakPolarHBondContact O-CB 3.35Å; A356-C359 PolarHBondContact O-N 3.47Å; A356-C359 VanDerWaalsContact O-N 3.1Å; A356-T360 PolarHBondContact O-N 3.26Å; A356-S401 WeakPolarHBondContact O-CB 3.36Å; A356-L404 HydrophobicContact CB-CB 4Å; A356-L404 HydrophobicContact CB-CD2 3.93Å; A356-L404 HydrophobicContact CB-CG 3.92Å; A356-S405 WeakPolarHBondContact CB-OG 3.23Å
357	D	92.9	Very high	92	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-70.4	-30.1	178	-64.1	-24.3	0	0	0	112.9	N326 L353 T360 G361 S405 A582	N326-D357 WeakPolarHBondContact ND2-CB 3.32Å; L353-D357 PolarHBondContact O-N 2.95Å; D357-T360 WeakPolarHBondContact O-CB 3.37Å; D357-T360 PolarHBondContact O-N 3.41Å; D357-G361 PolarHBondContact O-N 3.07Å; D357-S405 PolarHBondContact OD1-OG 3.01Å; D357-A582 HydrophobicContact CB-CB 3.75Å
358	F	94.5	Very high	92.6	Very high	45 Å²	45	18.2 Å²	18.2	20%	0.197	9%	0.094	C	C	.	.	H	α-helix	trans	-61.2	-44	166.8	162.2	-102.1	0	0	0	111.5	I323 N326 I327 A354 F355 A356 T360 G361 L362	I323-F358 HydrophobicContact CG1-CD2 4.33Å; I323-F358 HydrophobicContact CG1-CE2 4.45Å; I323-F358 HydrophobicContact CG2-CD2 4.26Å; I323-F358 HydrophobicContact CG2-CE2 4.11Å; N326-F358 HydrophobicContact CB-CB 4.04Å; I327-F358 HydrophobicContact CD1-CD2 4.13Å; I327-F358 HydrophobicContact CD1-CE2 3.85Å; I327-F358 HydrophobicContact CG1-CD2 3.85Å; I327-F358 HydrophobicContact CG1-CE2 4.04Å; A354-F358 VanDerWaalsContact O-CB 3.3Å; A354-F358 WeakPolarHBondContact O-CB 3.4Å; A354-F358 PolarHBondContact O-N 3.43Å; F355-F358 HydrophobicContact CD2-CD1 4.46Å; F355-F358 HydrophobicContact CE2-CD1 4.49Å; F355-F358 WeakPolarHBondContact O-CB 3.29Å; F355-F358 PolarHBondContact O-N 2.96Å; A356-F358 VanDerWaalsContact C-N 3.35Å; A356-F358 PolarHBondContact O-N 3.39Å; F358-T360 VanDerWaalsContact C-N 3.31Å; F358-T360 PolarHBondContact O-N 3.01Å; F358-G361 CarbonylContact O-C 3.26Å; F358-G361 WeakPolarHBondContact O-CA 3.34Å; F358-G361 PolarHBondContact O-N 3Å; F358-L362 HydrophobicContact CD1-CD1 4.39Å; F358-L362 HydrophobicContact CE1-CD1 3.61Å; F358-L362 HydrophobicContact CE1-CG 4.19Å; F358-L362 HydrophobicContact CE2-CD1 4.35Å; F358-L362 HydrophobicContact CE2-CD2 4.22Å; F358-L362 HydrophobicContact CE2-CG 4.11Å; F358-L362 HydrophobicContact CZ-CD1 3.6Å; F358-L362 HydrophobicContact CZ-CD2 4.08Å; F358-L362 HydrophobicContact CZ-CG 3.85Å; F358-L362 PolarHBondContact O-N 3.25Å
359	C	95.8	Very high	92.9	Very high	6 Å²	6	18.2 Å²	18.2	4%	0.041	10%	0.098	C	C	.	.	H	α-helix	trans	-62.3	-37.1	174.1	-70.7	0	0	0	0	112.2	F355 A356 G361 L362 Y363 L397	F355-C359 PolarHBondContact O-N 3.49Å; A356-C359 WeakPolarHBondContact O-CA 3.36Å; A356-C359 WeakPolarHBondContact O-CB 3.35Å; A356-C359 PolarHBondContact O-N 3.47Å; A356-C359 VanDerWaalsContact O-N 3.1Å; C359-G361 VanDerWaalsContact C-N 3.32Å; C359-G361 PolarHBondContact O-N 2.89Å; C359-L362 PolarHBondContact O-N 2.89Å; C359-Y363 PolarHBondContact O-N 3.47Å; C359-L397 HydrophobicContact CB-CD2 4.24Å
360	T	92	Very high	93.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.4	-43.5	169.4	-65.4	0	0	0	0	111.2	A356 D357 F358 L362 Y363 L364 S401 Y578 A582	A356-T360 PolarHBondContact O-N 3.26Å; D357-T360 WeakPolarHBondContact O-CB 3.37Å; D357-T360 PolarHBondContact O-N 3.41Å; F358-T360 VanDerWaalsContact C-N 3.31Å; F358-T360 PolarHBondContact O-N 3.01Å; T360-L362 VanDerWaalsContact C-N 3.34Å; T360-L362 PolarHBondContact O-N 3.22Å; T360-Y363 WeakPolarHBondContact O-CB 3.35Å; T360-Y363 PolarHBondContact O-N 2.92Å; T360-L364 HydrophobicContact CG2-CD1 4.18Å; T360-L364 WeakPolarHBondContact O-CG 3.39Å; T360-L364 PolarHBondContact O-N 3.34Å; T360-S401 VanDerWaalsContact OG1-CB 3.28Å; T360-S401 WeakPolarHBondContact OG1-CB 3.31Å; T360-S401 PolarHBondContact OG1-OG 3.12Å; T360-S401 VanDerWaalsContact OG1-OG 3.1Å; T360-Y578 HydrophobicContact CG2-CD1 3.94Å; T360-Y578 HydrophobicContact CG2-CE1 3.58Å; T360-A582 HydrophobicContact CG2-CB 3.59Å
361	G	94	Very high	93.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.9	-42.1	173.4	0	0	0	0	0	113.3	D357 F358 C359 L364 A365	D357-G361 PolarHBondContact O-N 3.07Å; F358-G361 CarbonylContact O-C 3.26Å; F358-G361 WeakPolarHBondContact O-CA 3.34Å; F358-G361 PolarHBondContact O-N 3Å; C359-G361 VanDerWaalsContact C-N 3.32Å; C359-G361 PolarHBondContact O-N 2.89Å; G361-L364 PolarHBondContact O-N 3.05Å; G361-A365 WeakPolarHBondContact O-CB 3.4Å; G361-A365 PolarHBondContact O-N 3.5Å
362	L	96.2	Very high	93.7	Very high	61 Å²	61	19.7 Å²	19.7	32%	0.319	11%	0.11	S	C	.	.	H	α-helix	trans	-63.9	-42.9	174.9	-70.1	178.5	0	0	0	112.5	I323 F358 C359 T360 L364 A365 I366 L397	I323-L362 HydrophobicContact CD1-CD2 3.9Å; F358-L362 HydrophobicContact CD1-CD1 4.39Å; F358-L362 HydrophobicContact CE1-CD1 3.61Å; F358-L362 HydrophobicContact CE1-CG 4.19Å; F358-L362 HydrophobicContact CE2-CD1 4.35Å; F358-L362 HydrophobicContact CE2-CD2 4.22Å; F358-L362 HydrophobicContact CE2-CG 4.11Å; F358-L362 HydrophobicContact CZ-CD1 3.6Å; F358-L362 HydrophobicContact CZ-CD2 4.08Å; F358-L362 HydrophobicContact CZ-CG 3.85Å; F358-L362 PolarHBondContact O-N 3.25Å; C359-L362 PolarHBondContact O-N 2.89Å; T360-L362 VanDerWaalsContact C-N 3.34Å; T360-L362 PolarHBondContact O-N 3.22Å; L362-L364 VanDerWaalsContact C-N 3.33Å; L362-L364 PolarHBondContact O-N 3.42Å; L362-A365 PolarHBondContact O-N 3.06Å; L362-I366 VanDerWaalsContact O-CG1 3.31Å; L362-I366 WeakPolarHBondContact O-CG1 3.5Å; L362-I366 PolarHBondContact O-N 3.45Å; L362-L397 HydrophobicContact CB-CD1 4.18Å
363	Y	94.5	Very high	93.6	Very high	10 Å²	10	27.1 Å²	27.1	4%	0.039	14%	0.136	C	C	.	.	H	α-helix	trans	-56	-47.7	174.5	162.6	-113.3	0	0	0	111.5	C359 T360 A365 I366 L367 A394 A398 V478 Y578	C359-Y363 PolarHBondContact O-N 3.47Å; T360-Y363 WeakPolarHBondContact O-CB 3.35Å; T360-Y363 PolarHBondContact O-N 2.92Å; Y363-A365 PolarHBondContact O-N 3.3Å; Y363-I366 WeakPolarHBondContact O-CB 3.05Å; Y363-I366 PolarHBondContact O-N 2.99Å; Y363-L367 HydrophobicContact CD2-CG 4.44Å; Y363-L367 HydrophobicContact CE1-CD1 3.97Å; Y363-L367 HydrophobicContact CE2-CD1 3.79Å; Y363-L367 HydrophobicContact CE2-CD2 4.32Å; Y363-L367 HydrophobicContact CE2-CG 4Å; Y363-L367 VanDerWaalsContact CZ-CD1 3.48Å; Y363-L367 PolarHBondContact O-N 3.1Å; Y363-L367 VanDerWaalsContact O-N 3.12Å; Y363-L367 WeakPolarHBondContact OH-CD1 3.45Å; Y363-A394 HydrophobicContact CD2-CB 3.92Å; Y363-A394 WeakPolarHBondContact CD2-O 3.25Å; Y363-A394 HydrophobicContact CE2-CB 4.16Å; Y363-A398 HydrophobicContact CD1-CB 4.15Å; Y363-A398 HydrophobicContact CD2-CB 3.87Å; Y363-A398 HydrophobicContact CE1-CB 4.11Å; Y363-A398 HydrophobicContact CE2-CB 3.82Å; Y363-A398 HydrophobicContact CG-CB 4.02Å; Y363-V478 PolarHBondContact OH-O 3.5Å; Y363-Y578 HydrophobicContact CD1-CD1 4.18Å; Y363-Y578 AromaticContact CD1-CE1 3.86Å; Y363-Y578 HydrophobicContact CD1-CE1 3.86Å; Y363-Y578 HydrophobicContact CE1-CD1 4.03Å; Y363-Y578 HydrophobicContact CE1-CE1 4Å
364	L	92.8	Very high	93.6	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-67.8	-35.4	179.1	-63.4	171.1	0	0	0	113	A318 W319 T360 G361 L362 I366 L367 A368 P579	A318-L364 HydrophobicContact CB-CD1 4.49Å; W319-L364 HydrophobicContact CB-CB 3.66Å; T360-L364 HydrophobicContact CG2-CD1 4.18Å; T360-L364 WeakPolarHBondContact O-CG 3.39Å; T360-L364 PolarHBondContact O-N 3.34Å; G361-L364 PolarHBondContact O-N 3.05Å; L362-L364 VanDerWaalsContact C-N 3.33Å; L362-L364 PolarHBondContact O-N 3.42Å; L364-I366 VanDerWaalsContact C-N 3.33Å; L364-L367 PolarHBondContact O-N 2.92Å; L364-A368 WeakPolarHBondContact O-CB 3.47Å; L364-A368 PolarHBondContact O-N 3.48Å; L364-P579 HydrophobicContact CD1-CB 3.44Å; L364-P579 VanDerWaalsContact CD1-CB 3.44Å; L364-P579 HydrophobicContact CD1-CG 3.55Å; L364-P579 HydrophobicContact CD2-CG 3.68Å; L364-P579 HydrophobicContact CG-CG 4.25Å
365	A	94.8	Very high	93.2	Very high	16 Å²	16	29.2 Å²	29.2	13%	0.132	15%	0.153	C	C	.	.	H	α-helix	trans	-62.3	-42.2	173.8	0	0	0	0	0	111.1	W319 I323 G361 L362 Y363 L367 A368 V369	W319-A365 HydrophobicContact CB-CB 4.18Å; W319-A365 HydrophobicContact CD2-CB 3.88Å; W319-A365 HydrophobicContact CE3-CB 3.89Å; W319-A365 HydrophobicContact CG-CB 4.01Å; I323-A365 HydrophobicContact CD1-CB 4.37Å; G361-A365 WeakPolarHBondContact O-CB 3.4Å; G361-A365 PolarHBondContact O-N 3.5Å; L362-A365 PolarHBondContact O-N 3.06Å; Y363-A365 PolarHBondContact O-N 3.3Å; A365-L367 PolarHBondContact O-N 3.04Å; A365-A368 PolarHBondContact O-N 2.92Å; A365-V369 WeakPolarHBondContact O-CB 3.23Å; A365-V369 VanDerWaalsContact O-CG2 3.24Å; A365-V369 WeakPolarHBondContact O-CG2 3.03Å; A365-V369 PolarHBondContact O-N 3.14Å
366	I	95.1	Very high	92.6	Very high	51 Å²	51	28.5 Å²	28.5	26%	0.262	16%	0.164	S	C	.	.	H	α-helix	trans	-59.4	-47.8	175.7	-67.7	164	0	0	0	110.4	L362 Y363 L364 Q370 W385 A394 L397	L362-I366 VanDerWaalsContact O-CG1 3.31Å; L362-I366 WeakPolarHBondContact O-CG1 3.5Å; L362-I366 PolarHBondContact O-N 3.45Å; Y363-I366 WeakPolarHBondContact O-CB 3.05Å; Y363-I366 PolarHBondContact O-N 2.99Å; L364-I366 VanDerWaalsContact C-N 3.33Å; I366-Q370 VanDerWaalsContact O-CB 3.23Å; I366-Q370 WeakPolarHBondContact O-CB 3.49Å; I366-Q370 PolarHBondContact O-N 2.87Å; I366-W385 HydrophobicContact CG2-CH2 3.51Å; I366-W385 HydrophobicContact CG2-CZ2 4.16Å; I366-A394 HydrophobicContact CD1-CB 4.49Å; I366-A394 HydrophobicContact CG2-CB 4Å; I366-L397 HydrophobicContact CD1-CD1 3.83Å
367	L	92.6	Very high	92.1	Very high	10 Å²	10	34.3 Å²	34.3	5%	0.052	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-44.7	177.9	-66.6	-172.4	0	0	0	112.7	Y363 L364 A365 V369 Q370 D371 W385 V478	Y363-L367 HydrophobicContact CD2-CG 4.44Å; Y363-L367 HydrophobicContact CE1-CD1 3.97Å; Y363-L367 HydrophobicContact CE2-CD1 3.79Å; Y363-L367 HydrophobicContact CE2-CD2 4.32Å; Y363-L367 HydrophobicContact CE2-CG 4Å; Y363-L367 VanDerWaalsContact CZ-CD1 3.48Å; Y363-L367 PolarHBondContact O-N 3.1Å; Y363-L367 VanDerWaalsContact O-N 3.12Å; Y363-L367 WeakPolarHBondContact OH-CD1 3.45Å; L364-L367 PolarHBondContact O-N 2.92Å; A365-L367 PolarHBondContact O-N 3.04Å; L367-V369 PolarHBondContact O-N 3.47Å; L367-Q370 PolarHBondContact O-N 3.33Å; L367-D371 WeakPolarHBondContact O-CB 3.27Å; L367-D371 PolarHBondContact O-N 3.18Å; L367-W385 HydrophobicContact CD2-CZ2 4.31Å; L367-V478 HydrophobicContact CD1-CB 4.44Å
368	A	92.8	Very high	91.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.1	-40.6	-179.4	0	0	0	0	0	112.4	M315 L364 A365 Q370 A372	M315-A368 HydrophobicContact CB-CB 4.31Å; L364-A368 WeakPolarHBondContact O-CB 3.47Å; L364-A368 PolarHBondContact O-N 3.48Å; A365-A368 PolarHBondContact O-N 2.92Å; A368-Q370 VanDerWaalsContact C-N 3.34Å; A368-A372 WeakPolarHBondContact O-CB 2.85Å; A368-A372 PolarHBondContact O-N 3.28Å
369	V	94.2	Very high	91.4	Very high	56 Å²	56	33.2 Å²	33.2	34%	0.339	18%	0.183	S	C	.	.	H	α-helix	trans	-64.4	-41.9	175.1	169.1	0	0	0	0	110.6	A365 L367 A372 R373	A365-V369 WeakPolarHBondContact O-CB 3.23Å; A365-V369 VanDerWaalsContact O-CG2 3.24Å; A365-V369 WeakPolarHBondContact O-CG2 3.03Å; A365-V369 PolarHBondContact O-N 3.14Å; L367-V369 PolarHBondContact O-N 3.47Å; V369-A372 PolarHBondContact O-N 3.38Å; V369-R373 HydrophobicContact CG1-CG 4.45Å; V369-R373 WeakPolarHBondContact O-CB 3.34Å; V369-R373 VanDerWaalsContact O-CG 3.32Å; V369-R373 WeakPolarHBondContact O-CG 3.3Å; V369-R373 PolarHBondContact O-N 3.22Å
370	Q	94.1	Very high	90.9	Very high	24 Å²	24	35.3 Å²	35.3	11%	0.112	20%	0.198	C	C	.	.	H	α-helix	trans	-74	-38.1	-175.8	-167.3	40.6	34.4	0	0	112.4	M305 I366 L367 A368 R373 T374 W385	M305-Q370 HydrophobicContact CE-CB 4.14Å; M305-Q370 HydrophobicContact CE-CG 3.45Å; M305-Q370 VanDerWaalsContact CE-CG 3.45Å; M305-Q370 HydrophobicContact SD-CB 4.4Å; M305-Q370 HydrophobicContact SD-CG 4.17Å; I366-Q370 VanDerWaalsContact O-CB 3.23Å; I366-Q370 WeakPolarHBondContact O-CB 3.49Å; I366-Q370 PolarHBondContact O-N 2.87Å; L367-Q370 PolarHBondContact O-N 3.33Å; A368-Q370 VanDerWaalsContact C-N 3.34Å; Q370-R373 PolarHBondContact O-N 3.39Å; Q370-T374 PolarHBondContact O-N 3.44Å; Q370-T374 VanDerWaalsContact O-N 3.07Å; Q370-T374 PolarHBondContact O-OG1 2.8Å; Q370-W385 HydrophobicContact CB-CH2 4.17Å; Q370-W385 HydrophobicContact CB-CZ2 4.2Å; Q370-W385 HydrophobicContact CB-CZ3 4.35Å; Q370-W385 HydrophobicContact CG-CD2 3.37Å; Q370-W385 HydrophobicContact CG-CE3 3.41Å; Q370-W385 VanDerWaalsContact CG-CE3 3.41Å; Q370-W385 HydrophobicContact CG-CG 4.05Å; Q370-W385 HydrophobicContact CG-CH2 3.75Å; Q370-W385 HydrophobicContact CG-CZ2 3.71Å; Q370-W385 HydrophobicContact CG-CZ3 3.6Å
371	D	92.4	Very high	90.7	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-45.6	167.6	178.1	69.7	0	0	0	111	M305 A306 R312 M315 L367 R373 T374 A375	M305-D371 HydrophobicContact CB-CB 4.1Å; M305-D371 PolarHBondContact N-OD1 2.94Å; M305-D371 VanDerWaalsContact N-OD1 3.14Å; M305-D371 HydrophobicContact SD-CB 4.48Å; A306-D371 PolarHBondContact N-OD1 3.26Å; R312-D371 IonicContact CZ-OD2 3.83Å; R312-D371 IonicContact NE-OD2 4Å; R312-D371 PolarHBondContact NE-OD2 2.96Å; R312-D371 IonicContact NH2-OD1 3.11Å; R312-D371 PolarHBondContact NH2-OD1 3.48Å; R312-D371 IonicContact NH2-OD2 2.8Å; R312-D371 PolarHBondContact NH2-OD2 2.96Å; M315-D371 HydrophobicContact CE-CB 4.3Å; L367-D371 WeakPolarHBondContact O-CB 3.27Å; L367-D371 PolarHBondContact O-N 3.18Å; D371-R373 PolarHBondContact O-N 3.34Å; D371-T374 PolarHBondContact O-N 2.96Å; D371-A375 WeakPolarHBondContact O-CA 3.28Å; D371-A375 WeakPolarHBondContact O-CB 3.41Å; D371-A375 PolarHBondContact O-N 3.07Å
372	A	92.6	Very high	90.6	Very high	50 Å²	50	39.5 Å²	39.5	41%	0.413	22%	0.215	S	C	.	.	H	α-helix	trans	-64.8	-38.4	177.9	0	0	0	0	0	113.2	W316 A368 V369	W316-A372 HydrophobicContact CZ2-CB 4.22Å; A368-A372 WeakPolarHBondContact O-CB 2.85Å; A368-A372 PolarHBondContact O-N 3.28Å; V369-A372 PolarHBondContact O-N 3.38Å
373	R	92.3	Very high	90.4	Very high	172 Å²	172	36.9 Å²	36.9	65%	0.649	20%	0.201	S	C	*	.	H	α-helix	trans	-68	-34.4	178	-78	178.2	177.3	-178.6	-1.8	113.2	V369 Q370 D371	V369-R373 HydrophobicContact CG1-CG 4.45Å; V369-R373 WeakPolarHBondContact O-CB 3.34Å; V369-R373 VanDerWaalsContact O-CG 3.32Å; V369-R373 WeakPolarHBondContact O-CG 3.3Å; V369-R373 PolarHBondContact O-N 3.22Å; Q370-R373 PolarHBondContact O-N 3.39Å; D371-R373 PolarHBondContact O-N 3.34Å
374	T	89.2	Confident	90.3	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-106.6	8.3	-173.2	60.6	0	0	0	0	113.7	M305 Q370 D371 G376 R377 Y378 Y381	M305-T374 HydrophobicContact CE-CG2 4.33Å; M305-T374 WeakPolarHBondContact CE-OG1 3.4Å; Q370-T374 PolarHBondContact O-N 3.44Å; Q370-T374 VanDerWaalsContact O-N 3.07Å; Q370-T374 PolarHBondContact O-OG1 2.8Å; D371-T374 PolarHBondContact O-N 2.96Å; T374-G376 PolarHBondContact O-N 2.79Å; T374-R377 CarbonylContact O-C 3.46Å; T374-R377 PolarHBondContact O-N 3.03Å; T374-Y378 PolarHBondContact O-N 3.49Å; T374-Y378 VanDerWaalsContact O-N 3.1Å; T374-Y381 HydrophobicContact CG2-CD2 4.01Å; T374-Y381 HydrophobicContact CG2-CG 3.84Å
375	A	85.8	Confident	90.3	Very high	41 Å²	41	40.3 Å²	40.3	34%	0.339	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	128.9	-174.8	0	0	0	0	0	112.6	D304 D371 R377	D304-A375 WeakPolarHBondContact OD1-CA 3.42Å; D371-A375 WeakPolarHBondContact O-CA 3.28Å; D371-A375 WeakPolarHBondContact O-CB 3.41Å; D371-A375 PolarHBondContact O-N 3.07Å; A375-R377 PolarHBondContact O-N 2.95Å
376	G	81.8	Confident	90.3	Very high	49 Å²	49	39.8 Å²	39.8	51%	0.505	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	-2.9	-178.7	0	0	0	0	0	115.8	E303 D304 T374	E303-G376 CarbonylContact O-C 3.41Å; E303-G376 PolarHBondContact O-N 2.71Å; D304-G376 PolarHBondContact OD1-N 2.92Å; T374-G376 PolarHBondContact O-N 2.79Å
377	R	83.4	Confident	90.1	Very high	123 Å²	123	39.1 Å²	39.1	46%	0.464	21%	0.213	S	C	.	.			trans	-144.6	27.2	-174.4	60.5	-178.4	-178.9	163.9	1.2	113.2	E303 T374 A375 C379 S380 Y381	E303-R377 PolarHBondContact O-N 3.35Å; T374-R377 CarbonylContact O-C 3.46Å; T374-R377 PolarHBondContact O-N 3.03Å; A375-R377 PolarHBondContact O-N 2.95Å; R377-C379 VanDerWaalsContact C-N 3.28Å; R377-C379 PolarHBondContact O-N 3.19Å; R377-S380 PolarHBondContact O-N 3.21Å; R377-Y381 HydrophobicContact CG-CD2 4.32Å; R377-Y381 HydrophobicContact CG-CE2 3.9Å; R377-Y381 PolarHBondContact NH1-OH 2.85Å; R377-Y381 WeakPolarHBondContact O-CD2 3.39Å
378	Y	87.3	Confident	90.2	Very high	1 Å²	1	39.7 Å²	39.7	0%	0.004	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-57.9	-37.2	-174.1	175.4	-123.9	0	0	0	113.3	P301 E303 M305 T374 S380 Y381 A382 W385 Q386 S477	P301-Y378 HydrophobicContact CG-CD1 4Å; P301-Y378 HydrophobicContact CG-CE1 4.23Å; P301-Y378 VanDerWaalsContact O-CD1 3.28Å; P301-Y378 WeakPolarHBondContact O-CD1 3.34Å; E303-Y378 WeakPolarHBondContact O-CB 3.48Å; E303-Y378 PolarHBondContact O-N 2.83Å; M305-Y378 HydrophobicContact CE-CD2 3.21Å; M305-Y378 HydrophobicContact CE-CE2 3.1Å; M305-Y378 HydrophobicContact CE-CG 4.16Å; M305-Y378 HydrophobicContact CG-CD1 4.09Å; M305-Y378 HydrophobicContact CG-CD2 3.86Å; M305-Y378 HydrophobicContact CG-CE1 4.19Å; M305-Y378 HydrophobicContact CG-CE2 3.96Å; M305-Y378 HydrophobicContact CG-CG 3.91Å; M305-Y378 HydrophobicContact SD-CD2 4.35Å; M305-Y378 HydrophobicContact SD-CE2 4.09Å; T374-Y378 PolarHBondContact O-N 3.49Å; T374-Y378 VanDerWaalsContact O-N 3.1Å; Y378-S380 PolarHBondContact O-N 3.2Å; Y378-S380 VanDerWaalsContact O-N 3.08Å; Y378-Y381 CarbonylContact O-C 3.59Å; Y378-Y381 PolarHBondContact O-N 3.46Å; Y378-A382 HydrophobicContact CD1-CB 4.47Å; Y378-A382 HydrophobicContact CD2-CB 4.47Å; Y378-A382 HydrophobicContact CE1-CB 4.04Å; Y378-A382 HydrophobicContact CE2-CB 4.04Å; Y378-A382 PolarHBondContact O-N 3Å; Y378-W385 HydrophobicContact CE2-CB 4.36Å; Y378-W385 HydrophobicContact CE2-CG 4.43Å; Y378-Q386 PolarHBondContact OH-NE2 3.47Å; Y378-S477 WeakPolarHBondContact OH-CA 3.46Å; Y378-S477 WeakPolarHBondContact OH-CB 3.21Å
379	C	86.5	Confident	90.3	Very high	21 Å²	21	46.4 Å²	46.4	14%	0.142	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-53.5	-33.7	-179.9	62.5	0	0	0	0	114	H202 C205 C302 R377 Y381	H202-C379 HydrophobicContact CB-CB 4.08Å; H202-C379 PolarHBondContact CD2-O 3.44Å; C205-C379 HydrophobicContact CB-CB 3.9Å; C302-C379 WeakPolarHBondContact O-CB 3.5Å; C302-C379 PolarHBondContact O-N 3.23Å; R377-C379 VanDerWaalsContact C-N 3.28Å; R377-C379 PolarHBondContact O-N 3.19Å; C379-Y381 VanDerWaalsContact C-N 3.29Å; C379-Y381 PolarHBondContact O-N 3.41Å
380	S	83.8	Confident	90.3	Very high	50 Å²	50	44.9 Å²	44.9	35%	0.35	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-73.3	-20.8	178.9	-56.3	0	0	0	0	113.4	R377 Y378	R377-S380 PolarHBondContact O-N 3.21Å; Y378-S380 PolarHBondContact O-N 3.2Å; Y378-S380 VanDerWaalsContact O-N 3.08Å
381	Y	89.2	Confident	90.4	Very high	87 Å²	87	43.8 Å²	43.8	34%	0.341	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-5	-178.3	-62.7	-88.3	0	0	0	112.8	T374 R377 Y378 C379 V383 D384 W385	T374-Y381 HydrophobicContact CG2-CD2 4.01Å; T374-Y381 HydrophobicContact CG2-CG 3.84Å; R377-Y381 HydrophobicContact CG-CD2 4.32Å; R377-Y381 HydrophobicContact CG-CE2 3.9Å; R377-Y381 PolarHBondContact NH1-OH 2.85Å; R377-Y381 WeakPolarHBondContact O-CD2 3.39Å; Y378-Y381 CarbonylContact O-C 3.59Å; Y378-Y381 PolarHBondContact O-N 3.46Å; C379-Y381 VanDerWaalsContact C-N 3.29Å; C379-Y381 PolarHBondContact O-N 3.41Å; Y381-V383 PolarHBondContact O-N 3.39Å; Y381-D384 PolarHBondContact O-N 2.99Å; Y381-W385 WeakPolarHBondContact O-CB 3.19Å; Y381-W385 PolarHBondContact O-N 3.49Å
382	A	91.2	Very high	90.6	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-48.3	-169.8	0	0	0	0	0	112.9	H202 Y378 D384 W385 Q386	H202-A382 HydrophobicContact CB-CB 3.95Å; Y378-A382 HydrophobicContact CD1-CB 4.47Å; Y378-A382 HydrophobicContact CD2-CB 4.47Å; Y378-A382 HydrophobicContact CE1-CB 4.04Å; Y378-A382 HydrophobicContact CE2-CB 4.04Å; Y378-A382 PolarHBondContact O-N 3Å; A382-D384 PolarHBondContact O-N 3.33Å; A382-W385 PolarHBondContact O-N 2.83Å; A382-Q386 WeakPolarHBondContact O-CB 3.25Å; A382-Q386 WeakPolarHBondContact O-CG 2.95Å; A382-Q386 PolarHBondContact O-N 3.18Å
383	V	91.3	Very high	90.8	Very high	6 Å²	6	49.9 Å²	49.9	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-48.4	176.9	-168.9	0	0	0	0	111.1	K182 Y200 H202 Y381 W385 Q386 S387	K182-V383 HydrophobicContact CB-CB 4.34Å; K182-V383 HydrophobicContact CB-CG1 4.11Å; K182-V383 HydrophobicContact CB-CG2 4.38Å; K182-V383 HydrophobicContact CD-CG1 4.22Å; K182-V383 HydrophobicContact CG-CG1 3.84Å; K182-V383 VanDerWaalsContact O-CG2 3.27Å; K182-V383 WeakPolarHBondContact O-CG2 3.17Å; Y200-V383 HydrophobicContact CD1-CG2 4.49Å; Y200-V383 HydrophobicContact CD2-CG2 4.07Å; Y200-V383 HydrophobicContact CE1-CG1 4.1Å; Y200-V383 HydrophobicContact CE2-CG1 4.12Å; Y200-V383 HydrophobicContact CE2-CG2 4.11Å; Y200-V383 HydrophobicContact CG-CG2 4.27Å; H202-V383 WeakPolarHBondContact CE1-CG2 3.27Å; H202-V383 WeakPolarHBondContact NE2-CG2 3.21Å; Y381-V383 PolarHBondContact O-N 3.39Å; V383-W385 VanDerWaalsContact C-N 3.31Å; V383-W385 PolarHBondContact O-N 3.38Å; V383-Q386 PolarHBondContact O-N 2.96Å; V383-S387 VanDerWaalsContact O-CB 3.25Å; V383-S387 WeakPolarHBondContact O-CB 3.48Å; V383-S387 PolarHBondContact O-N 2.83Å; V383-S387 PolarHBondContact O-OG 3.5Å
384	D	92.3	Very high	90.9	Very high	59 Å²	59	41.7 Å²	41.7	32%	0.316	24%	0.236	S	C	.	.	H	α-helix	trans	-67.2	-35.9	-174.5	-74	-37.8	0	0	0	111.1	K182 R183 Y381 A382 G388	K182-D384 WeakPolarHBondContact CD-OD1 3.28Å; K182-D384 IonicContact NZ-OD1 2.81Å; K182-D384 PolarHBondContact NZ-OD1 3.5Å; R183-D384 IonicContact NH2-OD2 3.89Å; Y381-D384 PolarHBondContact O-N 2.99Å; A382-D384 PolarHBondContact O-N 3.33Å; D384-G388 WeakPolarHBondContact O-CA 3.38Å; D384-G388 PolarHBondContact O-N 2.93Å; D384-G388 VanDerWaalsContact O-N 3.13Å
385	W	94.1	Very high	91.2	Very high	25 Å²	25	41.5 Å²	41.5	10%	0.095	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-58.3	171.4	175.3	-118.7	0	0	0	111.8	M305 I366 L367 Q370 Y378 Y381 A382 V383 S387 G388 C391 S477	M305-W385 HydrophobicContact CE-CG 4.44Å; I366-W385 HydrophobicContact CG2-CH2 3.51Å; I366-W385 HydrophobicContact CG2-CZ2 4.16Å; L367-W385 HydrophobicContact CD2-CZ2 4.31Å; Q370-W385 HydrophobicContact CB-CH2 4.17Å; Q370-W385 HydrophobicContact CB-CZ2 4.2Å; Q370-W385 HydrophobicContact CB-CZ3 4.35Å; Q370-W385 HydrophobicContact CG-CD2 3.37Å; Q370-W385 HydrophobicContact CG-CE3 3.41Å; Q370-W385 VanDerWaalsContact CG-CE3 3.41Å; Q370-W385 HydrophobicContact CG-CG 4.05Å; Q370-W385 HydrophobicContact CG-CH2 3.75Å; Q370-W385 HydrophobicContact CG-CZ2 3.71Å; Q370-W385 HydrophobicContact CG-CZ3 3.6Å; Y378-W385 HydrophobicContact CE2-CB 4.36Å; Y378-W385 HydrophobicContact CE2-CG 4.43Å; Y381-W385 WeakPolarHBondContact O-CB 3.19Å; Y381-W385 PolarHBondContact O-N 3.49Å; A382-W385 PolarHBondContact O-N 2.83Å; V383-W385 VanDerWaalsContact C-N 3.31Å; V383-W385 PolarHBondContact O-N 3.38Å; W385-S387 PolarHBondContact O-N 2.71Å; W385-G388 PolarHBondContact O-N 2.94Å; W385-C391 HydrophobicContact CD2-CB 4.31Å; W385-C391 HydrophobicContact CZ2-CB 4.26Å; W385-C391 WeakPolarHBondContact O-CB 2.92Å; W385-S477 PolarHBondContact NE1-O 3.21Å; W385-S477 VanDerWaalsContact NE1-O 3.12Å
386	Q	94	Very high	91.8	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.028	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-39.9	-172.2	-71.8	176.8	-20.2	0	0	112.5	N300 Y378 A382 V383 S474 T476	N300-Q386 PolarHBondContact OD1-NE2 3.44Å; Y378-Q386 PolarHBondContact OH-NE2 3.47Å; A382-Q386 WeakPolarHBondContact O-CB 3.25Å; A382-Q386 WeakPolarHBondContact O-CG 2.95Å; A382-Q386 PolarHBondContact O-N 3.18Å; V383-Q386 PolarHBondContact O-N 2.96Å; Q386-S474 WeakPolarHBondContact O-CA 3.27Å; Q386-S474 WeakPolarHBondContact O-CB 3.13Å; Q386-S474 PolarHBondContact O-OG 2.88Å; Q386-T476 VanDerWaalsContact NE2-C 3.33Å
387	S	92	Very high	92.4	Very high	37 Å²	37	41.3 Å²	41.3	26%	0.259	21%	0.214	S	C	.	.	H	α-helix	trans	-79.8	-19	177.8	66.5	0	0	0	0	113.7	V383 W385 R392	V383-S387 VanDerWaalsContact O-CB 3.25Å; V383-S387 WeakPolarHBondContact O-CB 3.48Å; V383-S387 PolarHBondContact O-N 2.83Å; V383-S387 PolarHBondContact O-OG 3.5Å; W385-S387 PolarHBondContact O-N 2.71Å; S387-R392 PolarHBondContact O-NH2 3.39Å
388	G	93.8	Very high	92.9	Very high	22 Å²	22	35.5 Å²	35.5	23%	0.227	19%	0.192	C	C	.	.	S	Bend	trans	-77.2	168.1	-173.8	0	0	0	0	0	114.7	D384 W385 G390 C391 R392	D384-G388 WeakPolarHBondContact O-CA 3.38Å; D384-G388 PolarHBondContact O-N 2.93Å; D384-G388 VanDerWaalsContact O-N 3.13Å; W385-G388 PolarHBondContact O-N 2.94Å; G388-G390 VanDerWaalsContact C-N 3.27Å; G388-G390 PolarHBondContact O-N 3.05Å; G388-C391 PolarHBondContact O-N 3.19Å; G388-R392 PolarHBondContact O-N 3.42Å
389	I	94.3	Very high	93.2	Very high	140 Å²	140	35.9 Å²	35.9	72%	0.718	19%	0.194	S	C	*	.	H	α-helix	trans	-65.9	-30.3	-178.8	-161.6	159.5	0	0	0	112.6	C391 R392 S393	I389-C391 PolarHBondContact O-N 3.04Å; I389-R392 PolarHBondContact O-N 3.29Å; I389-S393 PolarHBondContact O-N 3.1Å; I389-S393 PolarHBondContact O-OG 3.47Å; I389-S393 VanDerWaalsContact O-OG 3.12Å
390	G	94.7	Very high	93.7	Very high	25 Å²	25	35.4 Å²	35.4	26%	0.258	19%	0.19	S	C	.	.	H	α-helix	trans	-59.3	-45.6	179.2	0	0	0	0	0	112.5	G388 S393 A394	G388-G390 VanDerWaalsContact C-N 3.27Å; G388-G390 PolarHBondContact O-N 3.05Å; G390-S393 PolarHBondContact O-N 3.12Å; G390-A394 WeakPolarHBondContact O-CB 3.2Å; G390-A394 PolarHBondContact O-N 2.63Å
391	C	95.9	Very high	94.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-69.4	-38.7	177.6	-170.1	0	0	0	0	112.2	W385 G388 I389 S393 A394 G395 Y473 C479	W385-C391 HydrophobicContact CD2-CB 4.31Å; W385-C391 HydrophobicContact CZ2-CB 4.26Å; W385-C391 WeakPolarHBondContact O-CB 2.92Å; G388-C391 PolarHBondContact O-N 3.19Å; I389-C391 PolarHBondContact O-N 3.04Å; C391-S393 PolarHBondContact O-N 2.95Å; C391-A394 PolarHBondContact O-N 3.46Å; C391-G395 PolarHBondContact O-N 3.4Å; C391-Y473 PolarHBondContact SG-O 2.95Å; C391-C479 WeakPolarHBondContact CA-SG 3.44Å; C391-C479 HydrophobicContact CB-CB 4.12Å; C391-C479 WeakPolarHBondContact CB-SG 3.49Å; C391-C479 VanDerWaalsContact O-CB 3.31Å; C391-C479 WeakPolarHBondContact O-CB 3.37Å; C391-C479 VanDerWaalsContact SG-CA 3.53Å; C391-C479 WeakPolarHBondContact SG-CB 3.31Å; C391-C479 CovalentContact SG-SG 2.03Å; C391-C479 PolarHBondContact SG-SG 2.84Å
392	R	96.8	Very high	94.2	Very high	124 Å²	124	29 Å²	29	47%	0.468	16%	0.158	S	C	.	.	H	α-helix	trans	-61.7	-42.8	174.5	-63.4	-176.8	-161.1	-171.4	4.3	112.5	S387 G388 I389 F396 L467	S387-R392 PolarHBondContact O-NH2 3.39Å; G388-R392 PolarHBondContact O-N 3.42Å; I389-R392 PolarHBondContact O-N 3.29Å; R392-F396 WeakPolarHBondContact O-CB 3.45Å; R392-F396 PolarHBondContact O-N 3.44Å; R392-L467 HydrophobicContact CB-CD2 3.93Å; R392-L467 HydrophobicContact CG-CD2 4.41Å
393	S	96.4	Very high	94.3	Very high	55 Å²	55	29 Å²	29	39%	0.385	16%	0.158	S	C	.	.	H	α-helix	trans	-66.6	-41.1	175.7	-62.1	0	0	0	0	112	I389 G390 C391 F396 L397	I389-S393 PolarHBondContact O-N 3.1Å; I389-S393 PolarHBondContact O-OG 3.47Å; I389-S393 VanDerWaalsContact O-OG 3.12Å; G390-S393 PolarHBondContact O-N 3.12Å; C391-S393 PolarHBondContact O-N 2.95Å; S393-F396 PolarHBondContact O-N 2.86Å; S393-L397 WeakPolarHBondContact O-CB 3.48Å; S393-L397 WeakPolarHBondContact O-CG 3.48Å; S393-L397 PolarHBondContact O-N 2.93Å
394	A	95.7	Very high	94.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61	-48.7	175.4	0	0	0	0	0	111.4	Y363 I366 G390 C391 F396 L397 A398 C479	Y363-A394 HydrophobicContact CD2-CB 3.92Å; Y363-A394 WeakPolarHBondContact CD2-O 3.25Å; Y363-A394 HydrophobicContact CE2-CB 4.16Å; I366-A394 HydrophobicContact CD1-CB 4.49Å; I366-A394 HydrophobicContact CG2-CB 4Å; G390-A394 WeakPolarHBondContact O-CB 3.2Å; G390-A394 PolarHBondContact O-N 2.63Å; C391-A394 PolarHBondContact O-N 3.46Å; A394-F396 PolarHBondContact O-N 3.5Å; A394-L397 PolarHBondContact O-N 3.01Å; A394-A398 WeakPolarHBondContact O-CB 3.18Å; A394-A398 PolarHBondContact O-N 3.17Å; A394-C479 HydrophobicContact CB-CB 4.13Å
395	G	95.1	Very high	94.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-43	177.6	0	0	0	0	0	113.1	C391 A398 I399 Y473 C479	C391-G395 PolarHBondContact O-N 3.4Å; G395-A398 PolarHBondContact O-N 2.9Å; G395-I399 PolarHBondContact O-N 3.37Å; G395-Y473 VanDerWaalsContact C-CZ 3.48Å; G395-C479 WeakPolarHBondContact CA-O 3.46Å
396	F	97.6	Very high	94.1	Very high	54 Å²	54	24.8 Å²	24.8	24%	0.237	14%	0.137	C	C	.	.	H	α-helix	trans	-57.5	-50.6	172.8	176.7	-87.6	0	0	0	111.4	R392 S393 A394 A398 I399 F400 A463 T464 L467 Y473	R392-F396 WeakPolarHBondContact O-CB 3.45Å; R392-F396 PolarHBondContact O-N 3.44Å; S393-F396 PolarHBondContact O-N 2.86Å; A394-F396 PolarHBondContact O-N 3.5Å; F396-A398 VanDerWaalsContact C-N 3.31Å; F396-A398 PolarHBondContact O-N 3.28Å; F396-I399 PolarHBondContact O-N 3.42Å; F396-F400 HydrophobicContact CD1-CB 4.38Å; F396-F400 HydrophobicContact CE1-CB 4.05Å; F396-F400 HydrophobicContact CE1-CG 4.22Å; F396-F400 HydrophobicContact CZ-CB 4.31Å; F396-F400 HydrophobicContact CZ-CG 4.46Å; F396-F400 WeakPolarHBondContact O-CB 3.47Å; F396-F400 PolarHBondContact O-N 3.2Å; F396-A463 HydrophobicContact CD2-CB 3.6Å; F396-A463 WeakPolarHBondContact CD2-O 3.42Å; F396-A463 HydrophobicContact CE2-CB 3.59Å; F396-A463 HydrophobicContact CG-CB 4.27Å; F396-A463 HydrophobicContact CZ-CB 4.26Å; F396-T464 HydrophobicContact CD2-CG2 4.39Å; F396-T464 HydrophobicContact CE2-CG2 3.76Å; F396-L467 HydrophobicContact CD2-CD1 4.03Å; F396-Y473 HydrophobicContact CB-CE2 4.37Å
397	L	96	Very high	94.1	Very high	31 Å²	31	25.9 Å²	25.9	16%	0.162	14%	0.142	C	C	.	.	H	α-helix	trans	-60.6	-40.3	179.4	-76.7	172.1	0	0	0	111.8	C359 L362 I366 S393 A394 S401	C359-L397 HydrophobicContact CB-CD2 4.24Å; L362-L397 HydrophobicContact CB-CD1 4.18Å; I366-L397 HydrophobicContact CD1-CD1 3.83Å; S393-L397 WeakPolarHBondContact O-CB 3.48Å; S393-L397 WeakPolarHBondContact O-CG 3.48Å; S393-L397 PolarHBondContact O-N 2.93Å; A394-L397 PolarHBondContact O-N 3.01Å; L397-S401 WeakPolarHBondContact O-CB 3.46Å; L397-S401 PolarHBondContact O-N 3.42Å; L397-S401 PolarHBondContact O-OG 3.28Å
398	A	92.8	Very high	94.1	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-56.1	176.7	0	0	0	0	0	111.2	Y363 A394 G395 F396 F400 S401 S402 L480 Y578	Y363-A398 HydrophobicContact CD1-CB 4.15Å; Y363-A398 HydrophobicContact CD2-CB 3.87Å; Y363-A398 HydrophobicContact CE1-CB 4.11Å; Y363-A398 HydrophobicContact CE2-CB 3.82Å; Y363-A398 HydrophobicContact CG-CB 4.02Å; A394-A398 WeakPolarHBondContact O-CB 3.18Å; A394-A398 PolarHBondContact O-N 3.17Å; G395-A398 PolarHBondContact O-N 2.9Å; F396-A398 VanDerWaalsContact C-N 3.31Å; F396-A398 PolarHBondContact O-N 3.28Å; A398-F400 PolarHBondContact O-N 2.84Å; A398-S401 PolarHBondContact O-OG 3.09Å; A398-S402 WeakPolarHBondContact O-CB 3.41Å; A398-S402 PolarHBondContact O-N 2.72Å; A398-S402 PolarHBondContact O-OG 2.99Å; A398-L480 HydrophobicContact CB-CD2 3.93Å; A398-Y578 PolarHBondContact O-OH 2.71Å
399	I	93.8	Very high	93.7	Very high	9 Å²	9	23.1 Å²	23.1	5%	0.046	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-50.9	-179.5	-59.7	-55	0	0	0	110.6	G395 F396 S401 S402 E403 L462 A463 Y473 P481 L496	G395-I399 PolarHBondContact O-N 3.37Å; F396-I399 PolarHBondContact O-N 3.42Å; I399-S401 PolarHBondContact O-N 3.02Å; I399-S402 PolarHBondContact O-N 3.16Å; I399-S402 VanDerWaalsContact O-N 3.16Å; I399-S402 PolarHBondContact O-OG 2.62Å; I399-E403 HydrophobicContact CG2-CG 3.97Å; I399-E403 WeakPolarHBondContact O-CG 3.23Å; I399-E403 PolarHBondContact O-N 3.1Å; I399-L462 HydrophobicContact CG2-CB 4.37Å; I399-A463 HydrophobicContact CB-CB 4.04Å; I399-A463 HydrophobicContact CG2-CB 4Å; I399-Y473 HydrophobicContact CG1-CE1 3.8Å; I399-P481 HydrophobicContact CD1-CG 3.96Å; I399-P481 HydrophobicContact CG1-CG 4.17Å; I399-L496 HydrophobicContact CD1-CD1 4.28Å; I399-L496 HydrophobicContact CG2-CD2 4.47Å
400	F	96.7	Very high	93.4	Very high	12 Å²	12	17.9 Å²	17.9	5%	0.053	9%	0.092	C	C	.	.	H	α-helix	trans	-54.2	-49	-179.2	169.7	-103.8	0	0	0	112.7	F355 F396 A398 L404 W456 I460 A463	F355-F400 AromaticContact CE1-CE1 3.9Å; F355-F400 HydrophobicContact CE1-CE1 3.9Å; F355-F400 HydrophobicContact CE1-CZ 4.07Å; F396-F400 HydrophobicContact CD1-CB 4.38Å; F396-F400 HydrophobicContact CE1-CB 4.05Å; F396-F400 HydrophobicContact CE1-CG 4.22Å; F396-F400 HydrophobicContact CZ-CB 4.31Å; F396-F400 HydrophobicContact CZ-CG 4.46Å; F396-F400 WeakPolarHBondContact O-CB 3.47Å; F396-F400 PolarHBondContact O-N 3.2Å; A398-F400 PolarHBondContact O-N 2.84Å; F400-L404 HydrophobicContact CE1-CD2 4.22Å; F400-L404 HydrophobicContact CE2-CD2 4.3Å; F400-L404 HydrophobicContact CZ-CD2 3.73Å; F400-L404 VanDerWaalsContact O-CB 3.25Å; F400-L404 WeakPolarHBondContact O-CB 3.32Å; F400-L404 PolarHBondContact O-N 2.92Å; F400-W456 HydrophobicContact CE2-CE3 4.02Å; F400-W456 HydrophobicContact CE2-CZ3 4.16Å; F400-W456 AromaticContact CZ-CE3 3.88Å; F400-W456 HydrophobicContact CZ-CE3 3.88Å; F400-W456 HydrophobicContact CZ-CH2 4.1Å; F400-W456 AromaticContact CZ-CZ3 3.6Å; F400-W456 HydrophobicContact CZ-CZ3 3.6Å; F400-I460 HydrophobicContact CD2-CG1 3.92Å; F400-I460 HydrophobicContact CE2-CD1 4.5Å; F400-I460 HydrophobicContact CE2-CG1 3.75Å; F400-A463 HydrophobicContact CB-CB 3.81Å
401	S	94.1	Very high	93.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.7	-46.1	178.5	55.9	0	0	0	0	111.8	A356 T360 L397 A398 I399 E403 L404 S405 Y578	A356-S401 WeakPolarHBondContact O-CB 3.36Å; T360-S401 VanDerWaalsContact OG1-CB 3.28Å; T360-S401 WeakPolarHBondContact OG1-CB 3.31Å; T360-S401 PolarHBondContact OG1-OG 3.12Å; T360-S401 VanDerWaalsContact OG1-OG 3.1Å; L397-S401 WeakPolarHBondContact O-CB 3.46Å; L397-S401 PolarHBondContact O-N 3.42Å; L397-S401 PolarHBondContact O-OG 3.28Å; A398-S401 PolarHBondContact O-OG 3.09Å; I399-S401 PolarHBondContact O-N 3.02Å; S401-E403 PolarHBondContact O-N 3.32Å; S401-L404 PolarHBondContact O-N 3.41Å; S401-S405 WeakPolarHBondContact O-CB 3.34Å; S401-S405 PolarHBondContact O-N 3.3Å; S401-S405 PolarHBondContact O-OG 3.03Å; S401-Y578 PolarHBondContact OG-OH 3.35Å; S401-Y578 VanDerWaalsContact OG-OH 3.09Å
402	S	90	Very high	92.7	Very high	3 Å²	3	17.1 Å²	17.1	2%	0.021	8%	0.083	C	C	.	.	H	α-helix	trans	-62.7	-43.3	-179.1	69.8	0	0	0	0	113.1	A398 I399 M406 K500 Y578	A398-S402 WeakPolarHBondContact O-CB 3.41Å; A398-S402 PolarHBondContact O-N 2.72Å; A398-S402 PolarHBondContact O-OG 2.99Å; I399-S402 PolarHBondContact O-N 3.16Å; I399-S402 VanDerWaalsContact O-N 3.16Å; I399-S402 PolarHBondContact O-OG 2.62Å; S402-M406 WeakPolarHBondContact O-CB 3.35Å; S402-M406 PolarHBondContact O-N 3.02Å; S402-K500 PolarHBondContact OG-NZ 3.18Å; S402-Y578 WeakPolarHBondContact CB-OH 3.21Å
403	E	92.3	Very high	92	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-69.6	-41.3	-180	-60.6	-45.8	131.8	0	0	110.7	I399 S401 M406 F407 L462 K500	I399-E403 HydrophobicContact CG2-CG 3.97Å; I399-E403 WeakPolarHBondContact O-CG 3.23Å; I399-E403 PolarHBondContact O-N 3.1Å; S401-E403 PolarHBondContact O-N 3.32Å; E403-M406 WeakPolarHBondContact O-CB 3.43Å; E403-M406 PolarHBondContact O-N 2.8Å; E403-M406 WeakPolarHBondContact OE2-CE 3.32Å; E403-F407 HydrophobicContact CB-CD2 4.41Å; E403-F407 HydrophobicContact CB-CE2 4.14Å; E403-F407 WeakPolarHBondContact O-CD2 3.38Å; E403-F407 WeakPolarHBondContact O-CG 3.01Å; E403-F407 PolarHBondContact O-N 3.4Å; E403-L462 HydrophobicContact CG-CB 4.32Å; E403-L462 HydrophobicContact CG-CD1 4Å; E403-K500 WeakPolarHBondContact OE1-CE 3.35Å; E403-K500 IonicContact OE1-NZ 2.71Å; E403-K500 PolarHBondContact OE1-NZ 3.43Å
404	L	94.8	Very high	91.5	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-66.3	-42.5	179.1	-176.8	60.8	0	0	0	111.7	F355 A356 F400 S401 M406 T408 A455 W456 S459	F355-L404 HydrophobicContact CD1-CD2 4.08Å; F355-L404 HydrophobicContact CE1-CD2 4.5Å; A356-L404 HydrophobicContact CB-CB 4Å; A356-L404 HydrophobicContact CB-CD2 3.93Å; A356-L404 HydrophobicContact CB-CG 3.92Å; F400-L404 HydrophobicContact CE1-CD2 4.22Å; F400-L404 HydrophobicContact CE2-CD2 4.3Å; F400-L404 HydrophobicContact CZ-CD2 3.73Å; F400-L404 VanDerWaalsContact O-CB 3.25Å; F400-L404 WeakPolarHBondContact O-CB 3.32Å; F400-L404 PolarHBondContact O-N 2.92Å; S401-L404 PolarHBondContact O-N 3.41Å; L404-M406 VanDerWaalsContact C-N 3.32Å; L404-M406 PolarHBondContact O-N 3.49Å; L404-T408 VanDerWaalsContact O-CB 3.23Å; L404-T408 WeakPolarHBondContact O-CB 3.49Å; L404-T408 PolarHBondContact O-N 3.02Å; L404-T408 PolarHBondContact O-OG1 3.49Å; L404-A455 HydrophobicContact CD1-CB 4.15Å; L404-W456 HydrophobicContact CD1-CD2 4.41Å; L404-W456 HydrophobicContact CD1-CG 4.1Å; L404-W456 HydrophobicContact CD2-CD2 4.32Å; L404-W456 HydrophobicContact CD2-CZ2 4.03Å; L404-S459 VanDerWaalsContact CA-OG 3.3Å; L404-S459 WeakPolarHBondContact CA-OG 3.37Å; L404-S459 PolarHBondContact N-OG 3.43Å; L404-S459 VanDerWaalsContact N-OG 3.1Å
405	S	90.8	Very high	90.9	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.3	-41.5	174.2	-69	0	0	0	0	111.1	A356 D357 S401 T408 T409	A356-S405 WeakPolarHBondContact CB-OG 3.23Å; D357-S405 PolarHBondContact OD1-OG 3.01Å; S401-S405 WeakPolarHBondContact O-CB 3.34Å; S401-S405 PolarHBondContact O-N 3.3Å; S401-S405 PolarHBondContact O-OG 3.03Å; S405-T408 PolarHBondContact O-N 2.72Å; S405-T409 WeakPolarHBondContact O-CB 3.34Å; S405-T409 PolarHBondContact O-N 2.91Å; S405-T409 PolarHBondContact O-OG1 2.65Å
406	M	89.8	Confident	90	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-61.9	-54.1	176.7	179.1	-170.1	69.3	0	0	112.8	S402 E403 L404 T408 T409 I410 L499 K500 A503 W548	S402-M406 WeakPolarHBondContact O-CB 3.35Å; S402-M406 PolarHBondContact O-N 3.02Å; E403-M406 WeakPolarHBondContact O-CB 3.43Å; E403-M406 PolarHBondContact O-N 2.8Å; E403-M406 WeakPolarHBondContact OE2-CE 3.32Å; L404-M406 VanDerWaalsContact C-N 3.32Å; L404-M406 PolarHBondContact O-N 3.49Å; M406-T408 VanDerWaalsContact C-N 3.3Å; M406-T408 PolarHBondContact O-N 3.12Å; M406-T409 WeakPolarHBondContact O-CB 3.49Å; M406-T409 PolarHBondContact O-N 2.78Å; M406-T409 VanDerWaalsContact O-N 3.16Å; M406-I410 WeakPolarHBondContact O-CG1 3.45Å; M406-I410 PolarHBondContact O-N 3.24Å; M406-L499 HydrophobicContact CE-CD1 4.44Å; M406-L499 HydrophobicContact CE-CD2 3.64Å; M406-L499 HydrophobicContact CE-CG 3.61Å; M406-L499 HydrophobicContact SD-CG 4.42Å; M406-K500 HydrophobicContact SD-CB 4.31Å; M406-K500 HydrophobicContact SD-CG 3.72Å; M406-A503 HydrophobicContact CG-CB 3.41Å; M406-A503 VanDerWaalsContact CG-CB 3.41Å; M406-A503 HydrophobicContact SD-CB 3.39Å; M406-A503 WeakPolarHBondContact SD-CB 3.44Å; M406-W548 VanDerWaalsContact CA-CH2 3.41Å; M406-W548 HydrophobicContact CB-CH2 3.79Å; M406-W548 HydrophobicContact CB-CZ2 4.38Å; M406-W548 HydrophobicContact CB-CZ3 3.95Å; M406-W548 HydrophobicContact CG-CH2 4.3Å; M406-W548 HydrophobicContact CG-CZ3 3.94Å
407	F	92.8	Very high	89.1	Confident	29 Å²	29	11.5 Å²	11.5	13%	0.127	6%	0.056	C	C	.	.	H	α-helix	trans	-63.3	-37.5	179.2	-68.1	-55.9	0	0	0	112.3	E403 T409 I410 A411 A455 L458 L499	E403-F407 HydrophobicContact CB-CD2 4.41Å; E403-F407 HydrophobicContact CB-CE2 4.14Å; E403-F407 WeakPolarHBondContact O-CD2 3.38Å; E403-F407 WeakPolarHBondContact O-CG 3.01Å; E403-F407 PolarHBondContact O-N 3.4Å; F407-T409 VanDerWaalsContact C-N 3.33Å; F407-T409 PolarHBondContact O-N 3.32Å; F407-I410 HydrophobicContact CD1-CD1 4.39Å; F407-I410 WeakPolarHBondContact O-CB 3.31Å; F407-I410 PolarHBondContact O-N 3.48Å; F407-A411 PolarHBondContact O-N 3.49Å; F407-A455 HydrophobicContact CB-CB 3.44Å; F407-A455 VanDerWaalsContact CB-CB 3.44Å; F407-A455 HydrophobicContact CD2-CB 4.27Å; F407-A455 HydrophobicContact CG-CB 4.11Å; F407-L458 HydrophobicContact CD2-CB 4.48Å; F407-L458 HydrophobicContact CE1-CD1 4.09Å; F407-L458 HydrophobicContact CE2-CB 3.63Å; F407-L458 HydrophobicContact CE2-CD1 4.32Å; F407-L458 HydrophobicContact CZ-CB 3.82Å; F407-L458 HydrophobicContact CZ-CD1 3.77Å; F407-L458 HydrophobicContact CZ-CG 4.46Å; F407-L499 HydrophobicContact CE1-CD1 4.26Å; F407-L499 HydrophobicContact CE1-CD2 4.28Å; F407-L499 HydrophobicContact CZ-CD1 4.48Å; F407-L499 HydrophobicContact CZ-CD2 3.75Å
408	T	91.5	Very high	88.4	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.5	-38.7	175.6	-56.2	0	0	0	0	111.2	L349 N352 L353 L404 S405 M406 I410 A411 I412 Q452	L349-T408 VanDerWaalsContact O-CG2 3.28Å; L349-T408 WeakPolarHBondContact O-CG2 3.45Å; N352-T408 HydrophobicContact CB-CG2 4.03Å; L353-T408 HydrophobicContact CB-CG2 3.87Å; L404-T408 VanDerWaalsContact O-CB 3.23Å; L404-T408 WeakPolarHBondContact O-CB 3.49Å; L404-T408 PolarHBondContact O-N 3.02Å; L404-T408 PolarHBondContact O-OG1 3.49Å; S405-T408 PolarHBondContact O-N 2.72Å; M406-T408 VanDerWaalsContact C-N 3.3Å; M406-T408 PolarHBondContact O-N 3.12Å; T408-I410 VanDerWaalsContact C-N 3.35Å; T408-I410 PolarHBondContact O-N 2.85Å; T408-A411 WeakPolarHBondContact O-CB 3.22Å; T408-A411 PolarHBondContact O-N 3.12Å; T408-I412 HydrophobicContact CG2-CD1 4.21Å; T408-I412 VanDerWaalsContact O-CG1 3.31Å; T408-I412 WeakPolarHBondContact O-CG1 3.49Å; T408-I412 PolarHBondContact O-N 3.25Å; T408-Q452 PolarHBondContact OG1-NE2 2.99Å
409	T	86	Confident	87.5	Confident	2 Å²	2	17.1 Å²	17.1	1%	0.012	8%	0.081	C	C	.	.	H	α-helix	trans	-63.8	-38.8	174.8	-60.5	0	0	0	0	111.9	S405 M406 F407 I412 S413 V507 V541	S405-T409 WeakPolarHBondContact O-CB 3.34Å; S405-T409 PolarHBondContact O-N 2.91Å; S405-T409 PolarHBondContact O-OG1 2.65Å; M406-T409 WeakPolarHBondContact O-CB 3.49Å; M406-T409 PolarHBondContact O-N 2.78Å; M406-T409 VanDerWaalsContact O-N 3.16Å; F407-T409 VanDerWaalsContact C-N 3.33Å; F407-T409 PolarHBondContact O-N 3.32Å; T409-I412 PolarHBondContact O-N 3.23Å; T409-S413 PolarHBondContact O-N 3Å; T409-V507 HydrophobicContact CG2-CG1 4.44Å; T409-V507 HydrophobicContact CG2-CG2 4.48Å; T409-V541 HydrophobicContact CG2-CG2 3.85Å
410	I	88.9	Confident	86.3	Confident	30 Å²	30	17 Å²	17	15%	0.154	8%	0.08	C	C	.	.	H	α-helix	trans	-60.5	-48.1	171.6	-66.2	170.3	0	0	0	110.2	M406 F407 T408 I412 S413 I414 A503 Y506 V507	M406-I410 WeakPolarHBondContact O-CG1 3.45Å; M406-I410 PolarHBondContact O-N 3.24Å; F407-I410 HydrophobicContact CD1-CD1 4.39Å; F407-I410 WeakPolarHBondContact O-CB 3.31Å; F407-I410 PolarHBondContact O-N 3.48Å; T408-I410 VanDerWaalsContact C-N 3.35Å; T408-I410 PolarHBondContact O-N 2.85Å; I410-I412 VanDerWaalsContact C-N 3.32Å; I410-I412 PolarHBondContact O-N 3Å; I410-S413 WeakPolarHBondContact O-CB 3.38Å; I410-S413 PolarHBondContact O-N 3.26Å; I410-S413 VanDerWaalsContact O-N 3.08Å; I410-S413 PolarHBondContact O-OG 3.27Å; I410-I414 HydrophobicContact CG2-CD1 3.96Å; I410-I414 WeakPolarHBondContact O-CG1 3.35Å; I410-I414 PolarHBondContact O-N 3.34Å; I410-A503 HydrophobicContact CD1-CB 3.73Å; I410-A503 HydrophobicContact CG1-CB 4.28Å; I410-Y506 HydrophobicContact CG2-CD1 4.01Å; I410-Y506 HydrophobicContact CG2-CE1 3.85Å; I410-V507 HydrophobicContact CG1-CG2 3.87Å
411	A	89.9	Confident	85.3	Confident	3 Å²	3	19.3 Å²	19.3	3%	0.025	9%	0.093	C	C	.	.	H	α-helix	trans	-60.8	-40.1	178.6	0	0	0	0	0	112.3	L349 F407 T408 I414 K415 L451	L349-A411 HydrophobicContact CD2-CB 4Å; F407-A411 PolarHBondContact O-N 3.49Å; T408-A411 WeakPolarHBondContact O-CB 3.22Å; T408-A411 PolarHBondContact O-N 3.12Å; A411-I414 PolarHBondContact O-N 3.39Å; A411-K415 WeakPolarHBondContact O-CB 3.01Å; A411-K415 PolarHBondContact O-N 3.1Å; A411-L451 HydrophobicContact CB-CD1 4.47Å
412	I	84.3	Confident	84.4	Confident	6 Å²	6	20.6 Å²	20.6	3%	0.031	10%	0.101	C	C	.	.	H	α-helix	trans	-60.9	-46.3	171.8	-67.7	166.9	0	0	0	110.2	L349 L353 T408 T409 I410 I414 K415 V416 L537	L349-I412 HydrophobicContact CB-CD1 4.43Å; L349-I412 HydrophobicContact CB-CG1 3.84Å; L349-I412 HydrophobicContact CD1-CG1 4.1Å; L353-I412 HydrophobicContact CD2-CD1 3.76Å; T408-I412 HydrophobicContact CG2-CD1 4.21Å; T408-I412 VanDerWaalsContact O-CG1 3.31Å; T408-I412 WeakPolarHBondContact O-CG1 3.49Å; T408-I412 PolarHBondContact O-N 3.25Å; T409-I412 PolarHBondContact O-N 3.23Å; I410-I412 VanDerWaalsContact C-N 3.32Å; I410-I412 PolarHBondContact O-N 3Å; I412-I414 VanDerWaalsContact C-N 3.3Å; I412-I414 PolarHBondContact O-N 2.96Å; I412-K415 WeakPolarHBondContact O-CB 3.25Å; I412-K415 PolarHBondContact O-N 2.62Å; I412-V416 HydrophobicContact CG2-CG2 4.24Å; I412-V416 VanDerWaalsContact O-CG2 3.31Å; I412-V416 WeakPolarHBondContact O-CG2 3.32Å; I412-V416 PolarHBondContact O-N 2.72Å; I412-L537 HydrophobicContact CG2-CD1 4.5Å; I412-L537 HydrophobicContact CG2-CD2 4.21Å
413	S	82.3	Confident	83.3	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.5	-40.3	178.2	85.6	0	0	0	0	112.4	T409 I410 V416 K417 N510	T409-S413 PolarHBondContact O-N 3Å; I410-S413 WeakPolarHBondContact O-CB 3.38Å; I410-S413 PolarHBondContact O-N 3.26Å; I410-S413 VanDerWaalsContact O-N 3.08Å; I410-S413 PolarHBondContact O-OG 3.27Å; S413-V416 PolarHBondContact O-N 2.97Å; S413-K417 VanDerWaalsContact O-CB 3.3Å; S413-K417 WeakPolarHBondContact O-CB 3.45Å; S413-K417 PolarHBondContact O-N 3.38Å; S413-N510 PolarHBondContact OG-ND2 3.37Å
414	I	85.9	Confident	82.3	Confident	27 Å²	27	26.7 Å²	26.7	14%	0.138	12%	0.124	C	C	.	.	H	α-helix	trans	-66.4	-44.7	176.9	-66.2	167.4	0	0	0	110.2	I410 A411 I412 K417 R418 F443 Y506	I410-I414 HydrophobicContact CG2-CD1 3.96Å; I410-I414 WeakPolarHBondContact O-CG1 3.35Å; I410-I414 PolarHBondContact O-N 3.34Å; A411-I414 PolarHBondContact O-N 3.39Å; I412-I414 VanDerWaalsContact C-N 3.3Å; I412-I414 PolarHBondContact O-N 2.96Å; I414-K417 PolarHBondContact O-N 3.07Å; I414-R418 WeakPolarHBondContact O-CB 3.49Å; I414-R418 WeakPolarHBondContact O-CG 3.36Å; I414-R418 PolarHBondContact O-N 3.46Å; I414-F443 HydrophobicContact CG2-CD2 4.19Å; I414-F443 HydrophobicContact CG2-CE2 3.82Å; I414-Y506 HydrophobicContact CD1-CE1 4.43Å; I414-Y506 HydrophobicContact CG1-CE1 4.12Å
415	K	83.2	Confident	81.2	Confident	34 Å²	34	34.1 Å²	34.1	15%	0.148	15%	0.152	C	C	.	.	H	α-helix	trans	-57.9	-49.2	175.8	172.6	62.3	175.8	175.6	0	110.8	L349 A411 I412 T419 F443	L349-K415 HydrophobicContact CD1-CB 4.08Å; L349-K415 HydrophobicContact CD1-CG 4.37Å; A411-K415 WeakPolarHBondContact O-CB 3.01Å; A411-K415 PolarHBondContact O-N 3.1Å; I412-K415 WeakPolarHBondContact O-CB 3.25Å; I412-K415 PolarHBondContact O-N 2.62Å; K415-T419 WeakPolarHBondContact O-CB 3.43Å; K415-T419 PolarHBondContact O-N 3.05Å; K415-T419 PolarHBondContact O-OG1 2.65Å; K415-F443 HydrophobicContact CB-CD1 4.25Å; K415-F443 HydrophobicContact CB-CE1 4.28Å; K415-F443 HydrophobicContact CB-CG 4.41Å; K415-F443 HydrophobicContact CD-CB 3.56Å; K415-F443 HydrophobicContact CD-CD1 3.5Å; K415-F443 VanDerWaalsContact CD-CD1 3.5Å; K415-F443 HydrophobicContact CD-CE1 4.25Å; K415-F443 HydrophobicContact CD-CG 3.71Å; K415-F443 HydrophobicContact CG-CD1 4.37Å; K415-F443 PolarHBondContact NZ-O 2.96Å
416	V	77	Confident	80.1	Confident	8 Å²	8	37.6 Å²	37.6	5%	0.048	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-52.5	178.6	175.2	0	0	0	0	110	I412 S413 R418 T419 Q420 Y511 I514 A534 L537	I412-V416 HydrophobicContact CG2-CG2 4.24Å; I412-V416 VanDerWaalsContact O-CG2 3.31Å; I412-V416 WeakPolarHBondContact O-CG2 3.32Å; I412-V416 PolarHBondContact O-N 2.72Å; S413-V416 PolarHBondContact O-N 2.97Å; V416-R418 PolarHBondContact O-N 3.38Å; V416-T419 PolarHBondContact O-N 2.92Å; V416-T419 VanDerWaalsContact O-N 3.14Å; V416-Q420 HydrophobicContact CG1-CG 4.3Å; V416-Q420 VanDerWaalsContact O-CG 3.3Å; V416-Q420 WeakPolarHBondContact O-CG 3.35Å; V416-Q420 PolarHBondContact O-N 3.3Å; V416-Y511 HydrophobicContact CG1-CE1 4.28Å; V416-I514 HydrophobicContact CG1-CD1 3.78Å; V416-A534 HydrophobicContact CG1-CB 4.29Å; V416-L537 HydrophobicContact CG2-CB 4.29Å; V416-L537 HydrophobicContact CG2-CD1 3.54Å
417	K	79.3	Confident	79	Confident	46 Å²	46	38.5 Å²	38.5	20%	0.2	18%	0.175	C	C	.	.	H	α-helix	trans	-56	-46.3	179.6	-175.4	176	-173.1	174	0	112.6	S413 I414 Q420 L421 N510 I514	S413-K417 VanDerWaalsContact O-CB 3.3Å; S413-K417 WeakPolarHBondContact O-CB 3.45Å; S413-K417 PolarHBondContact O-N 3.38Å; I414-K417 PolarHBondContact O-N 3.07Å; K417-Q420 PolarHBondContact O-N 3.47Å; K417-L421 HydrophobicContact CG-CD1 4.06Å; K417-L421 WeakPolarHBondContact O-CG 3.24Å; K417-L421 PolarHBondContact O-N 3.48Å; K417-N510 HydrophobicContact CD-CB 4.38Å; K417-N510 WeakPolarHBondContact CD-OD1 3.16Å; K417-N510 PolarHBondContact NZ-OD1 3.44Å; K417-I514 HydrophobicContact CB-CD1 4.27Å
418	R	80.4	Confident	77.8	Confident	93 Å²	93	41.3 Å²	41.3	35%	0.351	19%	0.191	S	C	.	.	H	α-helix	trans	-65.9	-40.5	177.8	-77.2	-174.6	-174.1	173.2	3	112.4	I414 V416 Q420 L421 T422	I414-R418 WeakPolarHBondContact O-CB 3.49Å; I414-R418 WeakPolarHBondContact O-CG 3.36Å; I414-R418 PolarHBondContact O-N 3.46Å; V416-R418 PolarHBondContact O-N 3.38Å; R418-Q420 VanDerWaalsContact C-N 3.27Å; R418-Q420 PolarHBondContact O-N 2.9Å; R418-L421 PolarHBondContact O-N 3.06Å; R418-T422 WeakPolarHBondContact O-CB 3.49Å; R418-T422 PolarHBondContact O-N 3.47Å; R418-T422 PolarHBondContact O-OG1 3.49Å
419	T	73	Confident	76.7	Confident	56 Å²	56	44.2 Å²	44.2	34%	0.344	21%	0.211	S	C	.	.	H	α-helix	trans	-61.4	-41.9	177	-54.9	0	0	0	0	110.1	K415 V416 T422 L423	K415-T419 WeakPolarHBondContact O-CB 3.43Å; K415-T419 PolarHBondContact O-N 3.05Å; K415-T419 PolarHBondContact O-OG1 2.65Å; V416-T419 PolarHBondContact O-N 2.92Å; V416-T419 VanDerWaalsContact O-N 3.14Å; T419-T422 PolarHBondContact O-N 3.44Å; T419-L423 WeakPolarHBondContact O-CB 3.29Å; T419-L423 PolarHBondContact O-N 2.8Å
420	Q	70.1	Confident	75.6	Confident	7 Å²	7	50.1 Å²	50.1	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-42.4	177.4	-69.5	-62	-4.7	0	0	113.7	V416 K417 R418 T422 L423 R424 I514 W531	V416-Q420 HydrophobicContact CG1-CG 4.3Å; V416-Q420 VanDerWaalsContact O-CG 3.3Å; V416-Q420 WeakPolarHBondContact O-CG 3.35Å; V416-Q420 PolarHBondContact O-N 3.3Å; K417-Q420 PolarHBondContact O-N 3.47Å; R418-Q420 VanDerWaalsContact C-N 3.27Å; R418-Q420 PolarHBondContact O-N 2.9Å; Q420-T422 VanDerWaalsContact C-N 3.34Å; Q420-T422 PolarHBondContact O-N 3.38Å; Q420-L423 PolarHBondContact O-N 2.92Å; Q420-R424 PolarHBondContact O-N 3.39Å; Q420-I514 HydrophobicContact CG-CG2 4.22Å; Q420-W531 VanDerWaalsContact CD-CH2 3.43Å; Q420-W531 VanDerWaalsContact OE1-CZ2 3.23Å
421	L	75.4	Confident	74.2	Confident	60 Å²	60	58.5 Å²	58.5	31%	0.314	27%	0.272	S	S	.	.	H	α-helix	trans	-61.6	-42.9	174.7	-75.5	163.8	0	0	0	111.8	K417 R418 R424 R425 M517	K417-L421 HydrophobicContact CG-CD1 4.06Å; K417-L421 WeakPolarHBondContact O-CG 3.24Å; K417-L421 PolarHBondContact O-N 3.48Å; R418-L421 PolarHBondContact O-N 3.06Å; L421-R424 PolarHBondContact O-N 3.38Å; L421-R425 WeakPolarHBondContact O-CG 3.36Å; L421-R425 PolarHBondContact O-N 2.8Å; L421-M517 HydrophobicContact CD2-CE 3.47Å; L421-M517 VanDerWaalsContact CD2-CE 3.47Å; L421-M517 HydrophobicContact CG-CE 4.23Å
422	T	73.7	Confident	72.6	Confident	28 Å²	28	67.7 Å²	67.7	17%	0.172	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-43.5	175.3	-60.4	0	0	0	0	110.9	R418 T419 Q420 R425 I426	R418-T422 WeakPolarHBondContact O-CB 3.49Å; R418-T422 PolarHBondContact O-N 3.47Å; R418-T422 PolarHBondContact O-OG1 3.49Å; T419-T422 PolarHBondContact O-N 3.44Å; Q420-T422 VanDerWaalsContact C-N 3.34Å; Q420-T422 PolarHBondContact O-N 3.38Å; T422-R425 PolarHBondContact O-N 3.4Å; T422-I426 HydrophobicContact CG2-CD1 3.99Å; T422-I426 VanDerWaalsContact O-CG1 3.31Å; T422-I426 WeakPolarHBondContact O-CG1 3.12Å; T422-I426 PolarHBondContact O-N 2.8Å
423	L	69	Low	70.9	Confident	9 Å²	9	74.5 Å²	74.5	5%	0.047	34%	0.344	C	S	.	.	H	α-helix	trans	-61.8	-46.3	177.5	178	55.6	0	0	0	112.4	T419 Q420 R425 I426 I427 H527 W531	T419-L423 WeakPolarHBondContact O-CB 3.29Å; T419-L423 PolarHBondContact O-N 2.8Å; Q420-L423 PolarHBondContact O-N 2.92Å; L423-R425 VanDerWaalsContact C-N 3.31Å; L423-R425 PolarHBondContact O-N 3.11Å; L423-I426 PolarHBondContact O-N 3.44Å; L423-I427 HydrophobicContact CD1-CD1 3.91Å; L423-I427 HydrophobicContact CD1-CG1 4.23Å; L423-I427 HydrophobicContact CG-CD1 3.86Å; L423-I427 WeakPolarHBondContact O-CG1 3.15Å; L423-I427 PolarHBondContact O-N 3.29Å; L423-H527 HydrophobicContact CD1-CB 3.88Å; L423-H527 VanDerWaalsContact CD1-CD2 3.45Å; L423-H527 WeakPolarHBondContact CD1-CD2 3.35Å; L423-H527 WeakPolarHBondContact CD1-CE1 3.44Å; L423-H527 WeakPolarHBondContact CD1-ND1 3.44Å; L423-H527 HydrophobicContact CD2-CB 4.15Å; L423-W531 HydrophobicContact CD2-CH2 4.5Å; L423-W531 HydrophobicContact CD2-CZ2 3.55Å; L423-W531 HydrophobicContact CG-CZ2 4.35Å
424	R	70.8	Confident	69.1	Low	122 Å²	122	80.1 Å²	80.1	46%	0.46	38%	0.378	S	S	.	.	H	α-helix	trans	-61.2	-39.6	175.5	-173.8	178	-177.5	-169	1.1	111.9	Q420 L421 I427 N428 M517	Q420-R424 PolarHBondContact O-N 3.39Å; L421-R424 PolarHBondContact O-N 3.38Å; R424-I427 PolarHBondContact O-N 3.42Å; R424-N428 WeakPolarHBondContact O-CB 3.33Å; R424-N428 VanDerWaalsContact O-CG 3.28Å; R424-N428 PolarHBondContact O-N 3.37Å; R424-N428 PolarHBondContact O-OD1 3.47Å; R424-M517 HydrophobicContact CB-CE 3.95Å; R424-M517 HydrophobicContact CB-SD 4.18Å; R424-M517 VanDerWaalsContact CD-SD 3.54Å; R424-M517 HydrophobicContact CG-CE 4.2Å; R424-M517 HydrophobicContact CG-SD 4.45Å; R424-M517 VanDerWaalsContact NH1-CG 3.35Å
425	R	71.4	Confident	67.2	Low	156 Å²	156	91 Å²	91	59%	0.589	42%	0.418	S	S	*	.	H	α-helix	trans	-62.6	-42.5	175.5	-75.4	176.2	-179.1	-179	-0.1	111.6	L421 T422 L423 N428 S429	L421-R425 WeakPolarHBondContact O-CG 3.36Å; L421-R425 PolarHBondContact O-N 2.8Å; T422-R425 PolarHBondContact O-N 3.4Å; L423-R425 VanDerWaalsContact C-N 3.31Å; L423-R425 PolarHBondContact O-N 3.11Å; R425-N428 PolarHBondContact O-N 3.47Å; R425-S429 WeakPolarHBondContact O-CB 3Å; R425-S429 PolarHBondContact O-N 2.98Å; R425-S429 PolarHBondContact O-OG 3.46Å
426	I	67.5	Low	65.3	Low	72 Å²	72	94.1 Å²	94.1	37%	0.369	45%	0.449	S	S	.	.	H	α-helix	trans	-62.4	-48.2	176.2	-68.1	164.8	0	0	0	110.4	T422 L423 N428 S429 L430	T422-I426 HydrophobicContact CG2-CD1 3.99Å; T422-I426 VanDerWaalsContact O-CG1 3.31Å; T422-I426 WeakPolarHBondContact O-CG1 3.12Å; T422-I426 PolarHBondContact O-N 2.8Å; L423-I426 PolarHBondContact O-N 3.44Å; I426-N428 PolarHBondContact O-N 3.16Å; I426-S429 WeakPolarHBondContact CA-OG 3.26Å; I426-S429 PolarHBondContact O-N 3.23Å; I426-S429 PolarHBondContact O-OG 3.35Å; I426-L430 HydrophobicContact CG2-CD1 3.78Å; I426-L430 WeakPolarHBondContact O-CD1 2.96Å; I426-L430 WeakPolarHBondContact O-CG 3.04Å; I426-L430 PolarHBondContact O-N 2.95Å
427	I	66.2	Low	63.7	Low	21 Å²	21	99.1 Å²	99.1	11%	0.108	49%	0.485	C	S	.	.	H	α-helix	trans	-59.6	-48.2	177.2	-66.5	159.4	0	0	0	110.4	L423 R424 S429 L430 W431 L523 P524	L423-I427 HydrophobicContact CD1-CD1 3.91Å; L423-I427 HydrophobicContact CD1-CG1 4.23Å; L423-I427 HydrophobicContact CG-CD1 3.86Å; L423-I427 WeakPolarHBondContact O-CG1 3.15Å; L423-I427 PolarHBondContact O-N 3.29Å; R424-I427 PolarHBondContact O-N 3.42Å; I427-S429 VanDerWaalsContact C-N 3.3Å; I427-S429 PolarHBondContact O-N 3.1Å; I427-L430 WeakPolarHBondContact O-CB 3.36Å; I427-L430 PolarHBondContact O-N 3.01Å; I427-L430 VanDerWaalsContact O-N 3.12Å; I427-W431 VanDerWaalsContact O-CD1 3.28Å; I427-W431 PolarHBondContact O-N 2.99Å; I427-L523 HydrophobicContact CD1-CD2 3.38Å; I427-P524 HydrophobicContact CG1-CG 4.49Å
428	N	67.3	Low	62	Low	87 Å²	87	105.8 Å²	105.8	47%	0.465	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-37.1	178.1	-73.4	0.5	0	0	0	112.2	R424 R425 I426 L430 W431 Y432	R424-N428 WeakPolarHBondContact O-CB 3.33Å; R424-N428 VanDerWaalsContact O-CG 3.28Å; R424-N428 PolarHBondContact O-N 3.37Å; R424-N428 PolarHBondContact O-OD1 3.47Å; R425-N428 PolarHBondContact O-N 3.47Å; I426-N428 PolarHBondContact O-N 3.16Å; N428-L430 VanDerWaalsContact C-N 3.33Å; N428-W431 PolarHBondContact O-N 3.49Å; N428-Y432 PolarHBondContact O-N 3.32Å
429	S	68.2	Low	60.1	Low	61 Å²	61	110.2 Å²	110.2	43%	0.427	53%	0.532	S	S	.	.	H	α-helix	trans	-72.3	-23.4	175.9	68.5	0	0	0	0	113.9	R425 I426 I427 W431	R425-S429 WeakPolarHBondContact O-CB 3Å; R425-S429 PolarHBondContact O-N 2.98Å; R425-S429 PolarHBondContact O-OG 3.46Å; I426-S429 WeakPolarHBondContact CA-OG 3.26Å; I426-S429 PolarHBondContact O-N 3.23Å; I426-S429 PolarHBondContact O-OG 3.35Å; I427-S429 VanDerWaalsContact C-N 3.3Å; I427-S429 PolarHBondContact O-N 3.1Å; S429-W431 VanDerWaalsContact C-N 3.29Å
430	L	63.1	Low	58.6	Low	126 Å²	126	110 Å²	110	66%	0.66	54%	0.541	S	S	*	.	H	α-helix	trans	-74.8	-22.8	171.5	-79.2	153.8	0	0	0	111.8	I426 I427 N428	I426-L430 HydrophobicContact CG2-CD1 3.78Å; I426-L430 WeakPolarHBondContact O-CD1 2.96Å; I426-L430 WeakPolarHBondContact O-CG 3.04Å; I426-L430 PolarHBondContact O-N 2.95Å; I427-L430 WeakPolarHBondContact O-CB 3.36Å; I427-L430 PolarHBondContact O-N 3.01Å; I427-L430 VanDerWaalsContact O-N 3.12Å; N428-L430 VanDerWaalsContact C-N 3.33Å
431	W	59.7	Low	57.7	Low	206 Å²	206	116.1 Å²	116.1	78%	0.78	57%	0.568	S	S	*	*	H	α-helix	trans	-93.8	-21.1	177.7	-82.2	88.4	0	0	0	114	I427 N428 S429	I427-W431 VanDerWaalsContact O-CD1 3.28Å; I427-W431 PolarHBondContact O-N 2.99Å; N428-W431 PolarHBondContact O-N 3.49Å; S429-W431 VanDerWaalsContact C-N 3.29Å
432	Y	56.4	Low	56.9	Low	197 Å²	197	117.8 Å²	117.8	77%	0.773	58%	0.58	S	S	*	*	S	Bend	trans	-122.2	113.2	177.4	-90.4	-91.1	0	0	0	110.1	N428	N428-Y432 PolarHBondContact O-N 3.32Å
433	D	49.4	Very low	56.7	Low	148 Å²	148	116.7 Å²	116.7	79%	0.791	57%	0.573	S	S	*	*			trans	-46	141.3	-175.9	-157.2	-2.4	0	0	0	114.2
434	T	44.9	Very low	57.1	Low	119 Å²	119	120.9 Å²	120.9	73%	0.73	59%	0.593	S	S	*	*	S	Bend	trans	-17.3	110.9	176.6	42.6	0	0	0	0	119.1
435	R	45.5	Very low	57.9	Low	256 Å²	256	120.8 Å²	120.8	97%	0.966	59%	0.592	S	S	*	*	S	Bend	trans	179.6	31.2	136.9	-106.1	171.3	178.9	169.3	0.7	120.5
436	A	43.2	Very low	58.8	Low	98 Å²	98	122.6 Å²	122.6	81%	0.81	60%	0.599	S	S	*	*			trans	-150.7	28.8	173.7	0	0	0	0	0	118	F438	A436-F438 VanDerWaalsContact C-N 3.29Å; A436-F438 PolarHBondContact O-N 3.03Å
437	S	42.6	Very low	59.9	Low	113 Å²	113	121.3 Å²	121.3	79%	0.79	60%	0.595	S	S	*	*			trans	-83.6	56.4	-177.7	-172	0	0	0	0	114.1
438	F	43.9	Very low	61	Low	187 Å²	187	120.3 Å²	120.3	82%	0.82	59%	0.589	S	S	*	*			trans	-124.6	123.7	170.2	-113.4	-100.6	0	0	0	110.1	A436	A436-F438 VanDerWaalsContact C-N 3.29Å; A436-F438 PolarHBondContact O-N 3.03Å
439	Y	40.4	Very low	62.3	Low	186 Å²	186	120 Å²	120	73%	0.729	59%	0.587	S	S	*	*			trans	88.3	56.2	-172.6	-58.6	-80.1	0	0	0	117.9	F441	Y439-F441 PolarHBondContact O-N 3.4Å
440	G	42.1	Very low	63.6	Low	51 Å²	51	122 Å²	122	53%	0.526	59%	0.592	S	S	.	*			trans	-74.5	97.7	153.8	0	0	0	0	0	110.6	T442	G440-T442 PolarHBondContact O-N 2.93Å
441	F	51.9	Low	65.1	Low	136 Å²	136	118.7 Å²	118.7	60%	0.596	57%	0.574	S	S	*	*			trans	-65.3	81.9	171.5	-84.6	-90.2	0	0	0	110.3	Y439 F443	Y439-F441 PolarHBondContact O-N 3.4Å; F441-F443 PolarHBondContact O-N 3.19Å
442	T	58.6	Low	66.8	Low	94 Å²	94	109 Å²	109	58%	0.577	54%	0.538	S	S	*	.			trans	-58.9	134.5	161.6	63.7	0	0	0	0	107.5	G440 E444	G440-T442 PolarHBondContact O-N 2.93Å; T442-E444 WeakPolarHBondContact O-CG 3.31Å; T442-E444 PolarHBondContact O-N 3.5Å
443	F	69.8	Low	68.8	Low	5 Å²	5	103.5 Å²	103.5	2%	0.022	53%	0.527	C	S	.	.			trans	-65.8	102.1	176	-178.6	-90.5	0	0	0	108.1	V345 L349 I414 K415 F441 T447 A448 L451	V345-F443 HydrophobicContact CG1-CD1 3.69Å; V345-F443 HydrophobicContact CG1-CE1 3.67Å; L349-F443 HydrophobicContact CD1-CE1 4.35Å; I414-F443 HydrophobicContact CG2-CD2 4.19Å; I414-F443 HydrophobicContact CG2-CE2 3.82Å; K415-F443 HydrophobicContact CB-CD1 4.25Å; K415-F443 HydrophobicContact CB-CE1 4.28Å; K415-F443 HydrophobicContact CB-CG 4.41Å; K415-F443 HydrophobicContact CD-CB 3.56Å; K415-F443 HydrophobicContact CD-CD1 3.5Å; K415-F443 VanDerWaalsContact CD-CD1 3.5Å; K415-F443 HydrophobicContact CD-CE1 4.25Å; K415-F443 HydrophobicContact CD-CG 3.71Å; K415-F443 HydrophobicContact CG-CD1 4.37Å; K415-F443 PolarHBondContact NZ-O 2.96Å; F441-F443 PolarHBondContact O-N 3.19Å; F443-T447 HydrophobicContact CD2-CG2 4.4Å; F443-T447 HydrophobicContact CE2-CG2 3.91Å; F443-T447 HydrophobicContact CZ-CG2 4.37Å; F443-A448 HydrophobicContact CD1-CB 4.31Å; F443-A448 HydrophobicContact CE1-CB 3.53Å; F443-A448 HydrophobicContact CZ-CB 4.24Å; F443-L451 HydrophobicContact CE2-CD1 3.92Å; F443-L451 HydrophobicContact CZ-CD1 3.78Å
444	E	77.2	Confident	71.1	Confident	98 Å²	98	100.5 Å²	100.5	46%	0.458	51%	0.51	S	S	.	.			trans	-70.7	153.5	-172.6	-62.5	-174.3	173.5	0	0	111.8	T442 R446 T447 A448	T442-E444 WeakPolarHBondContact O-CG 3.31Å; T442-E444 PolarHBondContact O-N 3.5Å; E444-R446 PolarHBondContact O-N 2.83Å; E444-T447 PolarHBondContact O-N 3.41Å; E444-A448 PolarHBondContact O-N 2.92Å
445	W	86.5	Confident	73.6	Confident	120 Å²	120	95 Å²	95	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-53.9	-39.4	172	-80.3	98.8	0	0	0	113.1	V343 G344 V345 F348 T447 A448 I449	V343-W445 WeakPolarHBondContact O-CH2 3.08Å; V343-W445 WeakPolarHBondContact O-CZ2 3.48Å; G344-W445 VanDerWaalsContact C-CZ2 3.42Å; V345-W445 HydrophobicContact CG2-CD2 3.6Å; V345-W445 HydrophobicContact CG2-CE3 4.12Å; V345-W445 HydrophobicContact CG2-CG 3.8Å; V345-W445 HydrophobicContact CG2-CZ2 4.2Å; F348-W445 HydrophobicContact CB-CH2 4.07Å; F348-W445 HydrophobicContact CB-CZ3 3.68Å; F348-W445 HydrophobicContact CG-CZ3 4.04Å; W445-T447 PolarHBondContact O-N 3.46Å; W445-A448 WeakPolarHBondContact O-CB 3.39Å; W445-A448 PolarHBondContact O-N 2.94Å; W445-I449 VanDerWaalsContact O-CG1 3.31Å; W445-I449 WeakPolarHBondContact O-CG1 3.41Å; W445-I449 PolarHBondContact O-N 3.01Å
446	R	90.7	Very high	76.1	Confident	194 Å²	194	86.8 Å²	86.8	73%	0.732	45%	0.446	S	S	*	.	H	α-helix	trans	-59.5	-48	179.6	-67.5	-179	176	-177	-0.9	111.6	E444 A448 I449 I450	E444-R446 PolarHBondContact O-N 2.83Å; R446-A448 VanDerWaalsContact C-N 3.33Å; R446-A448 PolarHBondContact O-N 3.41Å; R446-I449 PolarHBondContact O-N 3.46Å; R446-I450 WeakPolarHBondContact O-CD1 3.22Å; R446-I450 VanDerWaalsContact O-CG1 3.27Å; R446-I450 WeakPolarHBondContact O-CG1 3.37Å; R446-I450 PolarHBondContact O-N 3.48Å
447	T	89.6	Confident	78.7	Confident	44 Å²	44	88.6 Å²	88.6	27%	0.27	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-41.7	177.2	-49.7	0	0	0	0	111.5	F443 E444 W445 I450 L451	F443-T447 HydrophobicContact CD2-CG2 4.4Å; F443-T447 HydrophobicContact CE2-CG2 3.91Å; F443-T447 HydrophobicContact CZ-CG2 4.37Å; E444-T447 PolarHBondContact O-N 3.41Å; W445-T447 PolarHBondContact O-N 3.46Å; T447-I450 PolarHBondContact O-N 2.92Å; T447-L451 HydrophobicContact CG2-CD1 3.99Å; T447-L451 HydrophobicContact CG2-CG 4.36Å; T447-L451 WeakPolarHBondContact O-CB 3.12Å; T447-L451 VanDerWaalsContact O-CG 3.28Å; T447-L451 WeakPolarHBondContact O-CG 3.32Å; T447-L451 PolarHBondContact O-N 3.37Å
448	A	90.9	Very high	81.3	Confident	0 Å²	0	86 Å²	86	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-60.8	-46.4	178.5	0	0	0	0	0	112.1	V345 F348 F443 E444 W445 R446 L451 Q452	V345-A448 HydrophobicContact CG1-CB 3.47Å; V345-A448 VanDerWaalsContact CG1-CB 3.47Å; F348-A448 HydrophobicContact CD1-CB 4.27Å; F348-A448 HydrophobicContact CE1-CB 4.32Å; F443-A448 HydrophobicContact CD1-CB 4.31Å; F443-A448 HydrophobicContact CE1-CB 3.53Å; F443-A448 HydrophobicContact CZ-CB 4.24Å; E444-A448 PolarHBondContact O-N 2.92Å; W445-A448 WeakPolarHBondContact O-CB 3.39Å; W445-A448 PolarHBondContact O-N 2.94Å; R446-A448 VanDerWaalsContact C-N 3.33Å; R446-A448 PolarHBondContact O-N 3.41Å; A448-L451 PolarHBondContact O-N 3.47Å; A448-Q452 WeakPolarHBondContact O-CG 3.34Å; A448-Q452 PolarHBondContact O-N 3.28Å
449	I	94.7	Very high	83.9	Confident	80 Å²	80	77.1 Å²	77.1	41%	0.41	37%	0.374	S	S	.	.	H	α-helix	trans	-63.9	-47.8	179.8	-67.7	165.2	0	0	0	110.3	F348 W445 R446 L451 Q452 C453	F348-I449 HydrophobicContact CE1-CG1 4.46Å; F348-I449 HydrophobicContact CZ-CG1 4.35Å; W445-I449 VanDerWaalsContact O-CG1 3.31Å; W445-I449 WeakPolarHBondContact O-CG1 3.41Å; W445-I449 PolarHBondContact O-N 3.01Å; R446-I449 PolarHBondContact O-N 3.46Å; I449-L451 PolarHBondContact O-N 3.44Å; I449-Q452 PolarHBondContact O-N 3.4Å; I449-C453 PolarHBondContact O-N 3.12Å; I449-C453 PolarHBondContact O-SG 3.14Å
450	I	94.9	Very high	86.6	Confident	105 Å²	105	71.6 Å²	71.6	54%	0.538	36%	0.356	S	S	.	.	H	α-helix	trans	-58.7	-47.3	179	-67.7	165.7	0	0	0	110.8	R446 T447 Q452 C453 I454	R446-I450 WeakPolarHBondContact O-CD1 3.22Å; R446-I450 VanDerWaalsContact O-CG1 3.27Å; R446-I450 WeakPolarHBondContact O-CG1 3.37Å; R446-I450 PolarHBondContact O-N 3.48Å; T447-I450 PolarHBondContact O-N 2.92Å; I450-Q452 VanDerWaalsContact C-N 3.32Å; I450-Q452 PolarHBondContact O-N 3.23Å; I450-C453 PolarHBondContact O-N 2.87Å; I450-I454 HydrophobicContact CG2-CD1 3.93Å; I450-I454 WeakPolarHBondContact O-CG1 2.99Å; I450-I454 PolarHBondContact O-N 2.76Å
451	L	94.7	Very high	89.3	Confident	55 Å²	55	72.7 Å²	72.7	29%	0.288	35%	0.35	S	S	.	.	H	α-helix	trans	-60.4	-42	178.1	-73.5	173.6	0	0	0	111.9	A411 F443 T447 A448 I449 I454 A455	A411-L451 HydrophobicContact CB-CD1 4.47Å; F443-L451 HydrophobicContact CE2-CD1 3.92Å; F443-L451 HydrophobicContact CZ-CD1 3.78Å; T447-L451 HydrophobicContact CG2-CD1 3.99Å; T447-L451 HydrophobicContact CG2-CG 4.36Å; T447-L451 WeakPolarHBondContact O-CB 3.12Å; T447-L451 VanDerWaalsContact O-CG 3.28Å; T447-L451 WeakPolarHBondContact O-CG 3.32Å; T447-L451 PolarHBondContact O-N 3.37Å; A448-L451 PolarHBondContact O-N 3.47Å; I449-L451 PolarHBondContact O-N 3.44Å; L451-I454 PolarHBondContact O-N 3.3Å; L451-A455 WeakPolarHBondContact O-CB 2.99Å; L451-A455 PolarHBondContact O-N 2.92Å
452	Q	95.6	Very high	91.4	Very high	4 Å²	4	67.2 Å²	67.2	2%	0.019	33%	0.326	C	S	.	.	H	α-helix	trans	-70.1	-38.5	177.1	-66.5	-52.2	95.9	0	0	112.2	F348 L349 N352 T408 A448 I449 I450 I454 A455 W456	F348-Q452 HydrophobicContact CD1-CG 4.49Å; F348-Q452 HydrophobicContact CE1-CB 4.09Å; F348-Q452 HydrophobicContact CE1-CG 3.54Å; F348-Q452 HydrophobicContact CZ-CB 4.09Å; F348-Q452 HydrophobicContact CZ-CG 3.97Å; L349-Q452 HydrophobicContact CD2-CG 3.9Å; N352-Q452 VanDerWaalsContact CG-NE2 3.32Å; N352-Q452 PolarHBondContact OD1-NE2 2.86Å; T408-Q452 PolarHBondContact OG1-NE2 2.99Å; A448-Q452 WeakPolarHBondContact O-CG 3.34Å; A448-Q452 PolarHBondContact O-N 3.28Å; I449-Q452 PolarHBondContact O-N 3.4Å; I450-Q452 VanDerWaalsContact C-N 3.32Å; I450-Q452 PolarHBondContact O-N 3.23Å; Q452-I454 VanDerWaalsContact C-N 3.29Å; Q452-I454 PolarHBondContact O-N 3.1Å; Q452-A455 WeakPolarHBondContact O-CB 3.33Å; Q452-A455 PolarHBondContact O-N 3.24Å; Q452-A455 VanDerWaalsContact O-N 3.17Å; Q452-W456 WeakPolarHBondContact O-CB 3.48Å; Q452-W456 PolarHBondContact O-N 2.03Å
453	C	97.5	Very high	93.2	Very high	80 Å²	80	62.7 Å²	62.7	54%	0.541	30%	0.299	S	S	.	.	H	α-helix	trans	-58.6	-42.8	173.7	-70	0	0	0	0	111.8	I449 I450 F457	I449-C453 PolarHBondContact O-N 3.12Å; I449-C453 PolarHBondContact O-SG 3.14Å; I450-C453 PolarHBondContact O-N 2.87Å; C453-F457 WeakPolarHBondContact O-CB 3.28Å; C453-F457 PolarHBondContact O-N 3.5Å
454	I	97.4	Very high	94.5	Very high	85 Å²	85	64.6 Å²	64.6	44%	0.436	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-45.8	174.5	-65.4	166.5	0	0	0	110.6	I450 L451 Q452 W456 F457 L458	I450-I454 HydrophobicContact CG2-CD1 3.93Å; I450-I454 WeakPolarHBondContact O-CG1 2.99Å; I450-I454 PolarHBondContact O-N 2.76Å; L451-I454 PolarHBondContact O-N 3.3Å; Q452-I454 VanDerWaalsContact C-N 3.29Å; Q452-I454 PolarHBondContact O-N 3.1Å; I454-W456 PolarHBondContact O-N 3.44Å; I454-F457 PolarHBondContact O-N 2.97Å; I454-L458 HydrophobicContact CG2-CD1 3.77Å; I454-L458 HydrophobicContact CG2-CG 4.22Å; I454-L458 WeakPolarHBondContact O-CB 3.4Å; I454-L458 WeakPolarHBondContact O-CG 3.11Å; I454-L458 PolarHBondContact O-N 3.26Å
455	A	97.3	Very high	95.4	Very high	3 Å²	3	61.9 Å²	61.9	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-56.9	-48	177.9	0	0	0	0	0	112	L404 F407 L451 Q452 L458 S459	L404-A455 HydrophobicContact CD1-CB 4.15Å; F407-A455 HydrophobicContact CB-CB 3.44Å; F407-A455 VanDerWaalsContact CB-CB 3.44Å; F407-A455 HydrophobicContact CD2-CB 4.27Å; F407-A455 HydrophobicContact CG-CB 4.11Å; L451-A455 WeakPolarHBondContact O-CB 2.99Å; L451-A455 PolarHBondContact O-N 2.92Å; Q452-A455 WeakPolarHBondContact O-CB 3.33Å; Q452-A455 PolarHBondContact O-N 3.24Å; Q452-A455 VanDerWaalsContact O-N 3.17Å; A455-L458 PolarHBondContact O-N 3.12Å; A455-S459 VanDerWaalsContact O-CB 3.28Å; A455-S459 WeakPolarHBondContact O-CB 3.27Å; A455-S459 PolarHBondContact O-N 3.13Å; A455-S459 PolarHBondContact O-OG 3.11Å
456	W	98.2	Very high	95.9	Very high	85 Å²	85	56.5 Å²	56.5	32%	0.322	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-47.4	177	-87	82.3	0	0	0	111.8	N352 F355 F400 L404 Q452 I454 S459 I460	N352-W456 PolarHBondContact OD1-NE1 2.92Å; F355-W456 AromaticContact CD1-CH2 3.69Å; F355-W456 HydrophobicContact CD1-CH2 3.69Å; F355-W456 AromaticContact CD1-CZ2 3.69Å; F355-W456 HydrophobicContact CD1-CZ2 3.69Å; F355-W456 AromaticContact CE1-CH2 3.2Å; F355-W456 HydrophobicContact CE1-CH2 3.2Å; F355-W456 AromaticContact CE1-CZ2 3.73Å; F355-W456 HydrophobicContact CE1-CZ2 3.73Å; F355-W456 HydrophobicContact CE1-CZ3 4.07Å; F355-W456 AromaticContact CZ-CH2 3.84Å; F355-W456 HydrophobicContact CZ-CH2 3.84Å; F400-W456 HydrophobicContact CE2-CE3 4.02Å; F400-W456 HydrophobicContact CE2-CZ3 4.16Å; F400-W456 AromaticContact CZ-CE3 3.88Å; F400-W456 HydrophobicContact CZ-CE3 3.88Å; F400-W456 HydrophobicContact CZ-CH2 4.1Å; F400-W456 AromaticContact CZ-CZ3 3.6Å; F400-W456 HydrophobicContact CZ-CZ3 3.6Å; L404-W456 HydrophobicContact CD1-CD2 4.41Å; L404-W456 HydrophobicContact CD1-CG 4.1Å; L404-W456 HydrophobicContact CD2-CD2 4.32Å; L404-W456 HydrophobicContact CD2-CZ2 4.03Å; Q452-W456 WeakPolarHBondContact O-CB 3.48Å; Q452-W456 PolarHBondContact O-N 2.03Å; I454-W456 PolarHBondContact O-N 3.44Å; W456-S459 PolarHBondContact O-N 2.96Å; W456-I460 HydrophobicContact CE3-CD1 4.29Å; W456-I460 WeakPolarHBondContact O-CB 3.49Å; W456-I460 VanDerWaalsContact O-CG1 3.29Å; W456-I460 WeakPolarHBondContact O-CG1 3.4Å; W456-I460 PolarHBondContact O-N 2.89Å
457	F	98.3	Very high	96.1	Very high	135 Å²	135	51 Å²	51	59%	0.592	26%	0.264	S	S	*	.	H	α-helix	trans	-59.1	-50.9	178.2	174.1	-98.4	0	0	0	112	C453 I454 S459 I460 L461	C453-F457 WeakPolarHBondContact O-CB 3.28Å; C453-F457 PolarHBondContact O-N 3.5Å; I454-F457 PolarHBondContact O-N 2.97Å; F457-S459 PolarHBondContact O-N 2.9Å; F457-I460 PolarHBondContact O-N 3.48Å; F457-L461 HydrophobicContact CE1-CD2 4.29Å; F457-L461 WeakPolarHBondContact O-CB 3.08Å; F457-L461 PolarHBondContact O-N 2.87Å
458	L	97.2	Very high	96.2	Very high	59 Å²	59	53.1 Å²	53.1	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-64.3	-39.7	-179.8	-68.6	176.7	0	0	0	112.1	F407 I454 A455 L461 L462	F407-L458 HydrophobicContact CD2-CB 4.48Å; F407-L458 HydrophobicContact CE1-CD1 4.09Å; F407-L458 HydrophobicContact CE2-CB 3.63Å; F407-L458 HydrophobicContact CE2-CD1 4.32Å; F407-L458 HydrophobicContact CZ-CB 3.82Å; F407-L458 HydrophobicContact CZ-CD1 3.77Å; F407-L458 HydrophobicContact CZ-CG 4.46Å; I454-L458 HydrophobicContact CG2-CD1 3.77Å; I454-L458 HydrophobicContact CG2-CG 4.22Å; I454-L458 WeakPolarHBondContact O-CB 3.4Å; I454-L458 WeakPolarHBondContact O-CG 3.11Å; I454-L458 PolarHBondContact O-N 3.26Å; A455-L458 PolarHBondContact O-N 3.12Å; L458-L461 PolarHBondContact O-N 3.46Å; L458-L462 WeakPolarHBondContact O-CB 3.36Å; L458-L462 VanDerWaalsContact O-CG 3.32Å; L458-L462 WeakPolarHBondContact O-CG 3.46Å; L458-L462 PolarHBondContact O-N 3.3Å
459	S	97.8	Very high	96.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-41.8	179.2	-54.1	0	0	0	0	111.9	L404 A455 W456 F457 A463	L404-S459 VanDerWaalsContact CA-OG 3.3Å; L404-S459 WeakPolarHBondContact CA-OG 3.37Å; L404-S459 PolarHBondContact N-OG 3.43Å; L404-S459 VanDerWaalsContact N-OG 3.1Å; A455-S459 VanDerWaalsContact O-CB 3.28Å; A455-S459 WeakPolarHBondContact O-CB 3.27Å; A455-S459 PolarHBondContact O-N 3.13Å; A455-S459 PolarHBondContact O-OG 3.11Å; W456-S459 PolarHBondContact O-N 2.96Å; F457-S459 PolarHBondContact O-N 2.9Å; S459-A463 VanDerWaalsContact O-CB 3.24Å; S459-A463 WeakPolarHBondContact O-CB 3.4Å; S459-A463 PolarHBondContact O-N 2.95Å; S459-A463 VanDerWaalsContact O-N 3.1Å
460	I	98.2	Very high	95.9	Very high	71 Å²	71	58.9 Å²	58.9	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-47.4	174.9	-68.9	168.3	0	0	0	109.9	F400 W456 F457 L462 A463 T464	F400-I460 HydrophobicContact CD2-CG1 3.92Å; F400-I460 HydrophobicContact CE2-CD1 4.5Å; F400-I460 HydrophobicContact CE2-CG1 3.75Å; W456-I460 HydrophobicContact CE3-CD1 4.29Å; W456-I460 WeakPolarHBondContact O-CB 3.49Å; W456-I460 VanDerWaalsContact O-CG1 3.29Å; W456-I460 WeakPolarHBondContact O-CG1 3.4Å; W456-I460 PolarHBondContact O-N 2.89Å; F457-I460 PolarHBondContact O-N 3.48Å; I460-L462 PolarHBondContact O-N 2.95Å; I460-A463 PolarHBondContact O-N 3.44Å; I460-T464 HydrophobicContact CG2-CG2 4.14Å; I460-T464 WeakPolarHBondContact O-CG2 3.05Å; I460-T464 PolarHBondContact O-N 3.46Å; I460-T464 PolarHBondContact O-OG1 3.46Å; I460-T464 VanDerWaalsContact O-OG1 3.11Å
461	L	97.4	Very high	95.8	Very high	74 Å²	74	53.9 Å²	53.9	39%	0.387	28%	0.283	S	S	.	.	H	α-helix	trans	-56.1	-51.5	179.1	178.3	64.4	0	0	0	111.5	F457 L458 A463 T464 L465	F457-L461 HydrophobicContact CE1-CD2 4.29Å; F457-L461 WeakPolarHBondContact O-CB 3.08Å; F457-L461 PolarHBondContact O-N 2.87Å; L458-L461 PolarHBondContact O-N 3.46Å; L461-A463 VanDerWaalsContact C-N 3.28Å; L461-A463 PolarHBondContact O-N 3.13Å; L461-T464 PolarHBondContact O-N 3.44Å; L461-T464 PolarHBondContact O-OG1 3.48Å; L461-L465 WeakPolarHBondContact O-CG 3.48Å; L461-L465 PolarHBondContact O-N 2.03Å
462	L	96.7	Very high	95.8	Very high	20 Å²	20	52.5 Å²	52.5	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-33	-179.3	-69.6	172.6	0	0	0	112.7	I399 E403 L458 I460 L465 Y492 L496 L499	I399-L462 HydrophobicContact CG2-CB 4.37Å; E403-L462 HydrophobicContact CG-CB 4.32Å; E403-L462 HydrophobicContact CG-CD1 4Å; L458-L462 WeakPolarHBondContact O-CB 3.36Å; L458-L462 VanDerWaalsContact O-CG 3.32Å; L458-L462 WeakPolarHBondContact O-CG 3.46Å; L458-L462 PolarHBondContact O-N 3.3Å; I460-L462 PolarHBondContact O-N 2.95Å; L462-L465 HydrophobicContact CD2-CD1 4.34Å; L462-Y492 PolarHBondContact O-OH 3.32Å; L462-L496 HydrophobicContact CB-CD2 4.15Å; L462-L496 HydrophobicContact CD1-CD2 4.12Å; L462-L496 HydrophobicContact CD2-CD2 4.14Å; L462-L496 HydrophobicContact CG-CD2 4.37Å; L462-L499 HydrophobicContact CD1-CD2 3.69Å
463	A	97.3	Very high	95.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-78.4	-25.6	177.9	0	0	0	0	0	113.8	F396 I399 F400 S459 I460 L461 Y473	F396-A463 HydrophobicContact CD2-CB 3.6Å; F396-A463 WeakPolarHBondContact CD2-O 3.42Å; F396-A463 HydrophobicContact CE2-CB 3.59Å; F396-A463 HydrophobicContact CG-CB 4.27Å; F396-A463 HydrophobicContact CZ-CB 4.26Å; I399-A463 HydrophobicContact CB-CB 4.04Å; I399-A463 HydrophobicContact CG2-CB 4Å; F400-A463 HydrophobicContact CB-CB 3.81Å; S459-A463 VanDerWaalsContact O-CB 3.24Å; S459-A463 WeakPolarHBondContact O-CB 3.4Å; S459-A463 PolarHBondContact O-N 2.95Å; S459-A463 VanDerWaalsContact O-N 3.1Å; I460-A463 PolarHBondContact O-N 3.44Å; L461-A463 VanDerWaalsContact C-N 3.28Å; L461-A463 PolarHBondContact O-N 3.13Å; A463-Y473 PolarHBondContact O-OH 2.88Å
464	T	97.1	Very high	95.4	Very high	45 Å²	45	50 Å²	50	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-83.6	-24.4	177.4	53.4	0	0	0	0	113.5	F396 I460 L461 L467 T468	F396-T464 HydrophobicContact CD2-CG2 4.39Å; F396-T464 HydrophobicContact CE2-CG2 3.76Å; I460-T464 HydrophobicContact CG2-CG2 4.14Å; I460-T464 WeakPolarHBondContact O-CG2 3.05Å; I460-T464 PolarHBondContact O-N 3.46Å; I460-T464 PolarHBondContact O-OG1 3.46Å; I460-T464 VanDerWaalsContact O-OG1 3.11Å; L461-T464 PolarHBondContact O-N 3.44Å; L461-T464 PolarHBondContact O-OG1 3.48Å; T464-L467 WeakPolarHBondContact O-CA 3Å; T464-L467 VanDerWaalsContact O-CB 3.23Å; T464-L467 WeakPolarHBondContact O-CB 3.46Å; T464-L467 PolarHBondContact O-N 3.46Å; T464-T468 PolarHBondContact O-N 2.82Å
465	L	96.2	Very high	95	Very high	41 Å²	41	48.7 Å²	48.7	22%	0.215	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-53.3	-44.2	-178.5	-73.6	170	0	0	0	113.9	L461 L462 L467 T468 I470 Y492	L461-L465 WeakPolarHBondContact O-CG 3.48Å; L461-L465 PolarHBondContact O-N 2.03Å; L462-L465 HydrophobicContact CD2-CD1 4.34Å; L465-L467 PolarHBondContact O-N 3.18Å; L465-T468 PolarHBondContact O-N 3.39Å; L465-T468 PolarHBondContact O-OG1 3.05Å; L465-I470 CarbonylContact C-O 3.6Å; L465-I470 VanDerWaalsContact C-O 3.25Å; L465-I470 HydrophobicContact CB-CB 4.23Å; L465-I470 HydrophobicContact CB-CG2 4.33Å; L465-I470 HydrophobicContact CD2-CB 4.45Å; L465-I470 HydrophobicContact CD2-CD1 3.61Å; L465-I470 PolarHBondContact O-N 3.07Å; L465-Y492 HydrophobicContact CB-CD2 4.14Å; L465-Y492 HydrophobicContact CB-CE2 3.75Å; L465-Y492 HydrophobicContact CD1-CD2 3.95Å; L465-Y492 HydrophobicContact CD1-CE2 3.85Å; L465-Y492 HydrophobicContact CG-CE2 4.45Å
466	P	95.6	Very high	94.7	Very high	7 Å²	7	48.7 Å²	48.7	5%	0.045	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-69.3	-10.5	174.9	-21.1	35.5	0	0	0	115	I470 Y473 P481 Y492	P466-I470 WeakPolarHBondContact CA-O 3.46Å; P466-Y473 HydrophobicContact CB-CD1 4.12Å; P466-Y473 HydrophobicContact CB-CD2 3.99Å; P466-Y473 HydrophobicContact CB-CE1 3.81Å; P466-Y473 HydrophobicContact CB-CE2 3.67Å; P466-Y473 HydrophobicContact CB-CG 4.2Å; P466-Y473 HydrophobicContact CG-CD1 4.5Å; P466-Y473 HydrophobicContact CG-CE1 3.76Å; P466-Y473 HydrophobicContact CG-CE2 4.14Å; P466-Y473 WeakPolarHBondContact CG-OH 2.9Å; P466-P481 HydrophobicContact CB-CB 4.22Å; P466-P481 HydrophobicContact CG-CB 3.92Å; P466-P481 HydrophobicContact CG-CG 4.38Å; P466-Y492 WeakPolarHBondContact CD-OH 3Å; P466-Y492 HydrophobicContact CG-CE1 3.78Å; P466-Y492 HydrophobicContact CG-CE2 4.23Å; P466-Y492 VanDerWaalsContact CG-CZ 3.48Å; P466-Y492 WeakPolarHBondContact CG-OH 3.04Å
467	L	95.1	Very high	94.3	Very high	78 Å²	78	44.7 Å²	44.7	41%	0.408	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-85	-20.8	170.4	-53.4	177.9	0	0	0	111.9	R392 F396 T464 L465 Y473	R392-L467 HydrophobicContact CB-CD2 3.93Å; R392-L467 HydrophobicContact CG-CD2 4.41Å; F396-L467 HydrophobicContact CD2-CD1 4.03Å; T464-L467 WeakPolarHBondContact O-CA 3Å; T464-L467 VanDerWaalsContact O-CB 3.23Å; T464-L467 WeakPolarHBondContact O-CB 3.46Å; T464-L467 PolarHBondContact O-N 3.46Å; L465-L467 PolarHBondContact O-N 3.18Å; L467-Y473 HydrophobicContact CD2-CD2 3.78Å; L467-Y473 HydrophobicContact CD2-CE2 3.78Å; L467-Y473 HydrophobicContact CG-CE2 4.1Å
468	T	92.4	Very high	93.9	Very high	89 Å²	89	38.7 Å²	38.7	55%	0.546	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	26.5	178.9	64.4	0	0	0	0	112.8	T464 L465 I470	T464-T468 PolarHBondContact O-N 2.82Å; L465-T468 PolarHBondContact O-N 3.39Å; L465-T468 PolarHBondContact O-OG1 3.05Å; T468-I470 VanDerWaalsContact C-N 3.25Å; T468-I470 PolarHBondContact O-N 3.06Å
469	N	88.6	Confident	93.7	Very high	134 Å²	134	35.9 Å²	35.9	72%	0.717	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	8.6	-178	-63	-47.3	0	0	0	116.7	N471 R483	N469-N471 CarbonylContact C-O 3.48Å; N469-N471 PolarHBondContact O-N 3.33Å; N469-R483 PolarHBondContact O-NH2 3.04Å
470	I	91.1	Very high	93.3	Very high	67 Å²	67	37 Å²	37	34%	0.344	21%	0.207	S	C	.	.	S	Bend	trans	-88.5	96.9	168.7	-63.4	168.8	0	0	0	106.8	L465 P466 T468 Y492	L465-I470 CarbonylContact C-O 3.6Å; L465-I470 VanDerWaalsContact C-O 3.25Å; L465-I470 HydrophobicContact CB-CB 4.23Å; L465-I470 HydrophobicContact CB-CG2 4.33Å; L465-I470 HydrophobicContact CD2-CB 4.45Å; L465-I470 HydrophobicContact CD2-CD1 3.61Å; L465-I470 PolarHBondContact O-N 3.07Å; P466-I470 WeakPolarHBondContact CA-O 3.46Å; T468-I470 VanDerWaalsContact C-N 3.25Å; T468-I470 PolarHBondContact O-N 3.06Å; I470-Y492 HydrophobicContact CG2-CD2 4.29Å; I470-Y492 HydrophobicContact CG2-CG 4.43Å
471	N	92.5	Very high	93	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	62.1	-177.7	-159.2	-143.7	-60.2	0	0	0	112.5	N469 P481 R483 D489 Y492	N469-N471 CarbonylContact C-O 3.48Å; N469-N471 PolarHBondContact O-N 3.33Å; N471-P481 HydrophobicContact CB-CB 4.25Å; N471-P481 PolarHBondContact ND2-O 2.73Å; N471-P481 WeakPolarHBondContact OD1-CA 3.47Å; N471-P481 WeakPolarHBondContact OD1-CB 3.27Å; N471-P481 PolarHBondContact OD1-O 3.43Å; N471-R483 PolarHBondContact ND2-O 3.35Å; N471-R483 VanDerWaalsContact ND2-O 3.11Å; N471-R483 WeakPolarHBondContact OD1-CB 3.42Å; N471-R483 PolarHBondContact OD1-N 2.97Å; N471-D489 WeakPolarHBondContact CA-OD1 3.35Å; N471-D489 PolarHBondContact N-OD1 3.36Å; N471-D489 VanDerWaalsContact N-OD1 3.13Å; N471-D489 PolarHBondContact ND2-O 2.82Å; N471-Y492 HydrophobicContact CB-CD1 3.62Å; N471-Y492 HydrophobicContact CB-CE1 4.1Å; N471-Y492 HydrophobicContact CB-CG 4.2Å
472	T	93.5	Very high	92.4	Very high	26 Å²	26	33.1 Å²	33.1	16%	0.16	19%	0.187	C	C	.	.			trans	-155.6	144.1	-179.3	179.5	0	0	0	0	111.9	S474 V475 P481 R483	T472-S474 VanDerWaalsContact C-N 3.25Å; T472-S474 PolarHBondContact O-N 3.19Å; T472-S474 PolarHBondContact OG1-N 3.26Å; T472-V475 HydrophobicContact CG2-CG2 3.67Å; T472-P481 WeakPolarHBondContact O-CA 3.17Å; T472-R483 HydrophobicContact CG2-CB 4.33Å
473	Y	94.5	Very high	91.9	Very high	1 Å²	1	34.7 Å²	34.7	0%	0.004	19%	0.191	C	C	.	.	S	Bend	trans	-78.6	-6.2	173.5	-60.6	-53.2	0	0	0	113.7	C391 G395 F396 I399 A463 P466 L467 V475 C479 P481	C391-Y473 PolarHBondContact SG-O 2.95Å; G395-Y473 VanDerWaalsContact C-CZ 3.48Å; F396-Y473 HydrophobicContact CB-CE2 4.37Å; I399-Y473 HydrophobicContact CG1-CE1 3.8Å; A463-Y473 PolarHBondContact O-OH 2.88Å; P466-Y473 HydrophobicContact CB-CD1 4.12Å; P466-Y473 HydrophobicContact CB-CD2 3.99Å; P466-Y473 HydrophobicContact CB-CE1 3.81Å; P466-Y473 HydrophobicContact CB-CE2 3.67Å; P466-Y473 HydrophobicContact CB-CG 4.2Å; P466-Y473 HydrophobicContact CG-CD1 4.5Å; P466-Y473 HydrophobicContact CG-CE1 3.76Å; P466-Y473 HydrophobicContact CG-CE2 4.14Å; P466-Y473 WeakPolarHBondContact CG-OH 2.9Å; L467-Y473 HydrophobicContact CD2-CD2 3.78Å; L467-Y473 HydrophobicContact CD2-CE2 3.78Å; L467-Y473 HydrophobicContact CG-CE2 4.1Å; Y473-V475 PolarHBondContact O-N 3.08Å; Y473-C479 VanDerWaalsContact CD1-O 3.28Å; Y473-C479 WeakPolarHBondContact CD1-O 3.39Å; Y473-C479 WeakPolarHBondContact O-CA 3.46Å; Y473-P481 HydrophobicContact CD1-CB 3.91Å; Y473-P481 HydrophobicContact CD1-CG 4.13Å; Y473-P481 HydrophobicContact CE1-CB 3.89Å; Y473-P481 HydrophobicContact CE1-CG 3.77Å
474	S	91.9	Very high	91.4	Very high	31 Å²	31	38 Å²	38	22%	0.217	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	12.4	-167.7	-62.4	0	0	0	0	115.6	Q386 T472	Q386-S474 WeakPolarHBondContact O-CA 3.27Å; Q386-S474 WeakPolarHBondContact O-CB 3.13Å; Q386-S474 PolarHBondContact O-OG 2.88Å; T472-S474 VanDerWaalsContact C-N 3.25Å; T472-S474 PolarHBondContact O-N 3.19Å; T472-S474 PolarHBondContact OG1-N 3.26Å
475	V	88.3	Confident	90.6	Very high	56 Å²	56	43.2 Å²	43.2	34%	0.339	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-25.2	-175.8	170.2	0	0	0	0	113.3	N300 T472 Y473 R483	N300-V475 PolarHBondContact ND2-O 3.23Å; N300-V475 PolarHBondContact OD1-O 3.24Å; N300-V475 VanDerWaalsContact OD1-O 3.11Å; T472-V475 HydrophobicContact CG2-CG2 3.67Å; Y473-V475 PolarHBondContact O-N 3.08Å; V475-R483 HydrophobicContact CG2-CB 4.2Å; V475-R483 HydrophobicContact CG2-CG 4.44Å
476	T	89.7	Confident	90.2	Very high	4 Å²	4	45.1 Å²	45.1	3%	0.025	24%	0.243	C	C	.	.	S	Bend	trans	-127.4	154.1	-173.3	64.8	0	0	0	0	112	L299 Q386 V478 C479 L480 L482	L299-T476 HydrophobicContact CB-CG2 4.14Å; L299-T476 HydrophobicContact CD1-CG2 4.27Å; Q386-T476 VanDerWaalsContact NE2-C 3.33Å; T476-V478 PolarHBondContact O-N 2.02Å; T476-C479 PolarHBondContact O-N 3.08Å; T476-C479 VanDerWaalsContact O-N 3.13Å; T476-C479 PolarHBondContact OG1-N 2.76Å; T476-L480 PolarHBondContact OG1-N 2.95Å; T476-L480 PolarHBondContact OG1-O 2.99Å; T476-L482 HydrophobicContact CG2-CB 4.2Å; T476-L482 HydrophobicContact CG2-CD1 3.96Å
477	S	90.3	Very high	89.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.007	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.7	179.7	72.3	0	0	0	0	113.7	L299 Y378 W385	L299-S477 WeakPolarHBondContact O-CB 3.29Å; L299-S477 PolarHBondContact O-N 2.71Å; L299-S477 PolarHBondContact O-OG 3.33Å; L299-S477 VanDerWaalsContact O-OG 3.12Å; Y378-S477 WeakPolarHBondContact OH-CA 3.46Å; Y378-S477 WeakPolarHBondContact OH-CB 3.21Å; W385-S477 PolarHBondContact NE1-O 3.21Å; W385-S477 VanDerWaalsContact NE1-O 3.12Å
478	V	89.4	Confident	89.7	Confident	9 Å²	9	49.9 Å²	49.9	6%	0.055	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	1.2	179.1	-63	0	0	0	0	113.7	L299 Y363 L367 T476 L480 V575	L299-V478 HydrophobicContact CD2-CG2 4.31Å; Y363-V478 PolarHBondContact OH-O 3.5Å; L367-V478 HydrophobicContact CD1-CB 4.44Å; T476-V478 PolarHBondContact O-N 2.02Å; V478-L480 HydrophobicContact CG2-CB 4.41Å; V478-L480 HydrophobicContact CG2-CD1 4.04Å; V478-L480 HydrophobicContact CG2-CG 4.07Å; V478-L480 PolarHBondContact O-N 3.37Å; V478-V575 HydrophobicContact CG1-CG2 4.03Å
479	C	93.7	Very high	89.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.			trans	64.2	31.2	172.6	-54.3	0	0	0	0	115.5	C391 A394 G395 Y473 T476	C391-C479 WeakPolarHBondContact CA-SG 3.44Å; C391-C479 HydrophobicContact CB-CB 4.12Å; C391-C479 WeakPolarHBondContact CB-SG 3.49Å; C391-C479 VanDerWaalsContact O-CB 3.31Å; C391-C479 WeakPolarHBondContact O-CB 3.37Å; C391-C479 VanDerWaalsContact SG-CA 3.53Å; C391-C479 WeakPolarHBondContact SG-CB 3.31Å; C391-C479 CovalentContact SG-SG 2.03Å; C391-C479 PolarHBondContact SG-SG 2.84Å; A394-C479 HydrophobicContact CB-CB 4.13Å; G395-C479 WeakPolarHBondContact CA-O 3.46Å; Y473-C479 VanDerWaalsContact CD1-O 3.28Å; Y473-C479 WeakPolarHBondContact CD1-O 3.39Å; Y473-C479 WeakPolarHBondContact O-CA 3.46Å; T476-C479 PolarHBondContact O-N 3.08Å; T476-C479 VanDerWaalsContact O-N 3.13Å; T476-C479 PolarHBondContact OG1-N 2.76Å
480	L	90.2	Very high	89.5	Confident	24 Å²	24	43 Å²	43	13%	0.126	23%	0.23	C	C	.	.			trans	-94.6	147.5	176	-65.6	176	0	0	0	111.1	A398 T476 V478 L482 L574	A398-L480 HydrophobicContact CB-CD2 3.93Å; T476-L480 PolarHBondContact OG1-N 2.95Å; T476-L480 PolarHBondContact OG1-O 2.99Å; V478-L480 HydrophobicContact CG2-CB 4.41Å; V478-L480 HydrophobicContact CG2-CD1 4.04Å; V478-L480 HydrophobicContact CG2-CG 4.07Å; V478-L480 PolarHBondContact O-N 3.37Å; L480-L482 VanDerWaalsContact C-N 3.3Å; L480-L482 HydrophobicContact CB-CD1 4.09Å; L480-L482 HydrophobicContact CB-CG 4Å; L480-L482 PolarHBondContact O-N 3.04Å; L480-L574 HydrophobicContact CD1-CD1 4.41Å; L480-L574 HydrophobicContact CD1-CD2 4.45Å
481	P	90.3	Very high	89.5	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.026	24%	0.241	C	C	.	.			trans	-80.3	73.5	-174.7	34.4	-34.6	0	0	0	111.4	I399 P466 N471 T472 Y473 Y492 L493	I399-P481 HydrophobicContact CD1-CG 3.96Å; I399-P481 HydrophobicContact CG1-CG 4.17Å; P466-P481 HydrophobicContact CB-CB 4.22Å; P466-P481 HydrophobicContact CG-CB 3.92Å; P466-P481 HydrophobicContact CG-CG 4.38Å; N471-P481 HydrophobicContact CB-CB 4.25Å; N471-P481 PolarHBondContact ND2-O 2.73Å; N471-P481 WeakPolarHBondContact OD1-CA 3.47Å; N471-P481 WeakPolarHBondContact OD1-CB 3.27Å; N471-P481 PolarHBondContact OD1-O 3.43Å; T472-P481 WeakPolarHBondContact O-CA 3.17Å; Y473-P481 HydrophobicContact CD1-CB 3.91Å; Y473-P481 HydrophobicContact CD1-CG 4.13Å; Y473-P481 HydrophobicContact CE1-CB 3.89Å; Y473-P481 HydrophobicContact CE1-CG 3.77Å; P481-Y492 HydrophobicContact CB-CE1 3.85Å; P481-Y492 HydrophobicContact CG-CE1 3.75Å; P481-L493 WeakPolarHBondContact O-CD2 3.35Å
482	L	86.1	Confident	89.6	Confident	59 Å²	59	44.7 Å²	44.7	31%	0.309	24%	0.242	S	C	.	.			trans	-102.9	15.8	-171.6	-64.2	174	0	0	0	113.8	L299 T476 L480 L493	L299-L482 HydrophobicContact CD1-CD1 4.09Å; T476-L482 HydrophobicContact CG2-CB 4.2Å; T476-L482 HydrophobicContact CG2-CD1 3.96Å; L480-L482 VanDerWaalsContact C-N 3.3Å; L480-L482 HydrophobicContact CB-CD1 4.09Å; L480-L482 HydrophobicContact CB-CG 4Å; L480-L482 PolarHBondContact O-N 3.04Å; L482-L493 HydrophobicContact CD2-CD2 4.42Å
483	R	86.2	Confident	89.4	Confident	52 Å²	52	44.3 Å²	44.3	20%	0.196	24%	0.239	C	C	.	.			trans	-66.9	137.1	177.4	-166.8	170.3	62.5	180	-1.6	110.2	N469 N471 T472 V475 E485 D489 L493	N469-R483 PolarHBondContact O-NH2 3.04Å; N471-R483 PolarHBondContact ND2-O 3.35Å; N471-R483 VanDerWaalsContact ND2-O 3.11Å; N471-R483 WeakPolarHBondContact OD1-CB 3.42Å; N471-R483 PolarHBondContact OD1-N 2.97Å; T472-R483 HydrophobicContact CG2-CB 4.33Å; V475-R483 HydrophobicContact CG2-CB 4.2Å; V475-R483 HydrophobicContact CG2-CG 4.44Å; R483-E485 HydrophobicContact CG-CB 4.42Å; R483-E485 HydrophobicContact CG-CG 4.27Å; R483-D489 HydrophobicContact CB-CB 4.4Å; R483-D489 WeakPolarHBondContact CD-OD2 3.28Å; R483-D489 IonicContact CZ-OD1 3.3Å; R483-D489 VanDerWaalsContact CZ-OD1 3.3Å; R483-D489 IonicContact CZ-OD2 3.44Å; R483-D489 IonicContact NE-OD1 3.06Å; R483-D489 PolarHBondContact NE-OD1 3.34Å; R483-D489 IonicContact NE-OD2 2.79Å; R483-D489 PolarHBondContact NE-OD2 3.26Å; R483-D489 IonicContact NH2-OD1 2.71Å; R483-D489 PolarHBondContact NH2-OD1 3.18Å; R483-D489 IonicContact NH2-OD2 3.55Å; R483-D489 VanDerWaalsContact O-CB 3.31Å; R483-D489 WeakPolarHBondContact O-CB 3.36Å; R483-L493 WeakPolarHBondContact O-CD1 3.33Å
484	T	85.6	Confident	89.1	Confident	71 Å²	71	47.3 Å²	47.3	44%	0.436	25%	0.252	S	S	.	.			trans	-131.7	14.2	-179.3	53.9	0	0	0	0	113.6	K490 L493	T484-K490 WeakPolarHBondContact O-CE 3.49Å; T484-L493 HydrophobicContact CG2-CD1 3.72Å
485	E	82.1	Confident	89.1	Confident	154 Å²	154	49.2 Å²	49.2	72%	0.72	26%	0.263	S	S	*	.	S	Bend	trans	-72	-46.7	-174.1	-64.4	176.9	167.7	0	0	112.2	R483	R483-E485 HydrophobicContact CG-CB 4.42Å; R483-E485 HydrophobicContact CG-CG 4.27Å
486	N	87.2	Confident	89.2	Confident	81 Å²	81	47 Å²	47	43%	0.433	25%	0.249	S	C	.	.	S	Bend	trans	-101.8	157.5	-177.1	-52.2	-64.7	0	0	0	111.9	S488 D489 K490	N486-S488 VanDerWaalsContact C-N 3.27Å; N486-S488 PolarHBondContact O-N 3.07Å; N486-D489 WeakPolarHBondContact CB-OD2 3.35Å; N486-D489 PolarHBondContact N-OD2 2.97Å; N486-D489 PolarHBondContact ND2-OD2 3.11Å; N486-D489 WeakPolarHBondContact O-CB 3.36Å; N486-D489 PolarHBondContact O-N 2.9Å; N486-D489 VanDerWaalsContact O-N 3.09Å; N486-K490 PolarHBondContact O-N 3.46Å
487	D	89.1	Confident	89.1	Confident	122 Å²	122	47.6 Å²	47.6	65%	0.652	25%	0.252	S	S	*	.	H	α-helix	trans	-61.2	-36.5	177.1	-66.8	-25.8	0	0	0	112.3	D489 K490 V491	D487-D489 VanDerWaalsContact C-N 3.29Å; D487-D489 PolarHBondContact O-N 2.8Å; D487-K490 PolarHBondContact O-N 3.11Å; D487-K490 IonicContact OD1-NZ 3.43Å; D487-V491 VanDerWaalsContact O-CG2 3.27Å; D487-V491 WeakPolarHBondContact O-CG2 3.36Å; D487-V491 PolarHBondContact O-N 3.34Å
488	S	90.1	Very high	89	Confident	63 Å²	63	52.1 Å²	52.1	44%	0.441	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-37.4	174.8	55.6	0	0	0	0	112.7	N486 Y492	N486-S488 VanDerWaalsContact C-N 3.27Å; N486-S488 PolarHBondContact O-N 3.07Å; S488-Y492 PolarHBondContact O-N 2.91Å; S488-Y492 VanDerWaalsContact O-N 3.11Å
489	D	89.3	Confident	89	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-69	-43.6	179.7	-60.7	-41.7	0	0	0	111.1	N471 R483 N486 D487 Y492 L493	N471-D489 WeakPolarHBondContact CA-OD1 3.35Å; N471-D489 PolarHBondContact N-OD1 3.36Å; N471-D489 VanDerWaalsContact N-OD1 3.13Å; N471-D489 PolarHBondContact ND2-O 2.82Å; R483-D489 HydrophobicContact CB-CB 4.4Å; R483-D489 WeakPolarHBondContact CD-OD2 3.28Å; R483-D489 IonicContact CZ-OD1 3.3Å; R483-D489 VanDerWaalsContact CZ-OD1 3.3Å; R483-D489 IonicContact CZ-OD2 3.44Å; R483-D489 IonicContact NE-OD1 3.06Å; R483-D489 PolarHBondContact NE-OD1 3.34Å; R483-D489 IonicContact NE-OD2 2.79Å; R483-D489 PolarHBondContact NE-OD2 3.26Å; R483-D489 IonicContact NH2-OD1 2.71Å; R483-D489 PolarHBondContact NH2-OD1 3.18Å; R483-D489 IonicContact NH2-OD2 3.55Å; R483-D489 VanDerWaalsContact O-CB 3.31Å; R483-D489 WeakPolarHBondContact O-CB 3.36Å; N486-D489 WeakPolarHBondContact CB-OD2 3.35Å; N486-D489 PolarHBondContact N-OD2 2.97Å; N486-D489 PolarHBondContact ND2-OD2 3.11Å; N486-D489 WeakPolarHBondContact O-CB 3.36Å; N486-D489 PolarHBondContact O-N 2.9Å; N486-D489 VanDerWaalsContact O-N 3.09Å; D487-D489 VanDerWaalsContact C-N 3.29Å; D487-D489 PolarHBondContact O-N 2.8Å; D489-Y492 PolarHBondContact O-N 2.73Å; D489-L493 PolarHBondContact O-N 3.21Å; D489-L493 VanDerWaalsContact O-N 3.11Å
490	K	88.4	Confident	88.7	Confident	79 Å²	79	55.2 Å²	55.2	34%	0.343	29%	0.29	S	S	.	.	H	α-helix	trans	-61.7	-48.2	174.8	-65.7	175.2	-169.7	162.7	0	110.9	T484 N486 D487 Y492 L493 F494	T484-K490 WeakPolarHBondContact O-CE 3.49Å; N486-K490 PolarHBondContact O-N 3.46Å; D487-K490 PolarHBondContact O-N 3.11Å; D487-K490 IonicContact OD1-NZ 3.43Å; K490-Y492 VanDerWaalsContact C-N 3.31Å; K490-Y492 PolarHBondContact O-N 2.92Å; K490-L493 PolarHBondContact O-N 3.11Å; K490-F494 HydrophobicContact CB-CD2 4.22Å; K490-F494 HydrophobicContact CB-CE2 4.26Å; K490-F494 WeakPolarHBondContact O-CB 3.34Å; K490-F494 WeakPolarHBondContact O-CD2 3.11Å; K490-F494 PolarHBondContact O-N 3.47Å
491	V	91.4	Very high	88.4	Confident	93 Å²	93	57.9 Å²	57.9	56%	0.564	30%	0.304	S	S	*	.	H	α-helix	trans	-58.1	-43.4	180	169.2	0	0	0	0	111.4	D487 T495	D487-V491 VanDerWaalsContact O-CG2 3.27Å; D487-V491 WeakPolarHBondContact O-CG2 3.36Å; D487-V491 PolarHBondContact O-N 3.34Å; V491-T495 WeakPolarHBondContact O-CB 3.45Å; V491-T495 PolarHBondContact O-N 3.01Å; V491-T495 PolarHBondContact O-OG1 3.35Å
492	Y	93.3	Very high	88.2	Confident	8 Å²	8	64.4 Å²	64.4	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-49.8	175.8	173.2	-98.7	0	0	0	112.1	L462 L465 P466 I470 N471 P481 S488 D489 K490 F494 T495 L496	L462-Y492 PolarHBondContact O-OH 3.32Å; L465-Y492 HydrophobicContact CB-CD2 4.14Å; L465-Y492 HydrophobicContact CB-CE2 3.75Å; L465-Y492 HydrophobicContact CD1-CD2 3.95Å; L465-Y492 HydrophobicContact CD1-CE2 3.85Å; L465-Y492 HydrophobicContact CG-CE2 4.45Å; P466-Y492 WeakPolarHBondContact CD-OH 3Å; P466-Y492 HydrophobicContact CG-CE1 3.78Å; P466-Y492 HydrophobicContact CG-CE2 4.23Å; P466-Y492 VanDerWaalsContact CG-CZ 3.48Å; P466-Y492 WeakPolarHBondContact CG-OH 3.04Å; I470-Y492 HydrophobicContact CG2-CD2 4.29Å; I470-Y492 HydrophobicContact CG2-CG 4.43Å; N471-Y492 HydrophobicContact CB-CD1 3.62Å; N471-Y492 HydrophobicContact CB-CE1 4.1Å; N471-Y492 HydrophobicContact CB-CG 4.2Å; P481-Y492 HydrophobicContact CB-CE1 3.85Å; P481-Y492 HydrophobicContact CG-CE1 3.75Å; S488-Y492 PolarHBondContact O-N 2.91Å; S488-Y492 VanDerWaalsContact O-N 3.11Å; D489-Y492 PolarHBondContact O-N 2.73Å; K490-Y492 VanDerWaalsContact C-N 3.31Å; K490-Y492 PolarHBondContact O-N 2.92Å; Y492-F494 PolarHBondContact O-N 2.75Å; Y492-T495 WeakPolarHBondContact O-CB 3.44Å; Y492-T495 PolarHBondContact O-N 3.26Å; Y492-L496 HydrophobicContact CD1-CD1 4.14Å; Y492-L496 HydrophobicContact CE1-CD1 3.39Å; Y492-L496 HydrophobicContact CE1-CG 4.17Å; Y492-L496 HydrophobicContact CE2-CD1 4.29Å; Y492-L496 HydrophobicContact CE2-CG 4.33Å; Y492-L496 VanDerWaalsContact CZ-CD1 3.5Å; Y492-L496 PolarHBondContact O-N 3.23Å
493	L	89.8	Confident	88.2	Confident	18 Å²	18	61.6 Å²	61.6	9%	0.094	32%	0.318	C	S	.	.	H	α-helix	trans	-59.4	-47.8	178	-83.4	174.3	0	0	0	112.3	P481 L482 R483 T484 D489 K490 T495 L496 L497	P481-L493 WeakPolarHBondContact O-CD2 3.35Å; L482-L493 HydrophobicContact CD2-CD2 4.42Å; R483-L493 WeakPolarHBondContact O-CD1 3.33Å; T484-L493 HydrophobicContact CG2-CD1 3.72Å; D489-L493 PolarHBondContact O-N 3.21Å; D489-L493 VanDerWaalsContact O-N 3.11Å; K490-L493 PolarHBondContact O-N 3.11Å; L493-T495 VanDerWaalsContact C-N 3.29Å; L493-T495 PolarHBondContact O-N 3.28Å; L493-L496 PolarHBondContact O-N 3.11Å; L493-L497 WeakPolarHBondContact O-CB 3.42Å; L493-L497 VanDerWaalsContact O-CG 3.25Å; L493-L497 WeakPolarHBondContact O-CG 3.33Å; L493-L497 PolarHBondContact O-N 2.65Å
494	F	88.4	Confident	87.9	Confident	64 Å²	64	60 Å²	60	28%	0.281	31%	0.314	S	S	.	.	H	α-helix	trans	-59.4	-41.3	175.7	-82.9	-65.1	0	0	0	111.6	K490 Y492 L497 L498 L556 A559 V560	K490-F494 HydrophobicContact CB-CD2 4.22Å; K490-F494 HydrophobicContact CB-CE2 4.26Å; K490-F494 WeakPolarHBondContact O-CB 3.34Å; K490-F494 WeakPolarHBondContact O-CD2 3.11Å; K490-F494 PolarHBondContact O-N 3.47Å; Y492-F494 PolarHBondContact O-N 2.75Å; F494-L497 PolarHBondContact O-N 3.46Å; F494-L498 VanDerWaalsContact O-CB 3.25Å; F494-L498 WeakPolarHBondContact O-CB 3.28Å; F494-L498 WeakPolarHBondContact O-CG 3.3Å; F494-L498 PolarHBondContact O-N 3.32Å; F494-L556 HydrophobicContact CD1-CD2 4.29Å; F494-L556 HydrophobicContact CE1-CD2 4.44Å; F494-A559 HydrophobicContact CD1-CB 4.16Å; F494-A559 HydrophobicContact CE1-CB 3.55Å; F494-A559 HydrophobicContact CE2-CB 3.98Å; F494-A559 HydrophobicContact CZ-CB 3.45Å; F494-A559 VanDerWaalsContact CZ-CB 3.45Å; F494-A559 WeakPolarHBondContact CZ-O 3.35Å; F494-V560 HydrophobicContact CE1-CG2 4.47Å
495	T	91.1	Very high	87.7	Confident	71 Å²	71	58.5 Å²	58.5	44%	0.436	31%	0.312	S	S	.	.	H	α-helix	trans	-61.4	-47.6	178.4	-58.7	0	0	0	0	111.4	V491 Y492 L493 L497 L499	V491-T495 WeakPolarHBondContact O-CB 3.45Å; V491-T495 PolarHBondContact O-N 3.01Å; V491-T495 PolarHBondContact O-OG1 3.35Å; Y492-T495 WeakPolarHBondContact O-CB 3.44Å; Y492-T495 PolarHBondContact O-N 3.26Å; L493-T495 VanDerWaalsContact C-N 3.29Å; L493-T495 PolarHBondContact O-N 3.28Å; T495-L497 PolarHBondContact O-N 2.9Å; T495-L499 VanDerWaalsContact O-CB 3.23Å; T495-L499 WeakPolarHBondContact O-CB 2.91Å; T495-L499 PolarHBondContact O-N 3.29Å
496	L	90.6	Very high	88	Confident	10 Å²	10	54.8 Å²	54.8	5%	0.052	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-46.5	176	-73.2	-179.2	0	0	0	112	I399 L462 Y492 L493 L499 K500	I399-L496 HydrophobicContact CD1-CD1 4.28Å; I399-L496 HydrophobicContact CG2-CD2 4.47Å; L462-L496 HydrophobicContact CB-CD2 4.15Å; L462-L496 HydrophobicContact CD1-CD2 4.12Å; L462-L496 HydrophobicContact CD2-CD2 4.14Å; L462-L496 HydrophobicContact CG-CD2 4.37Å; Y492-L496 HydrophobicContact CD1-CD1 4.14Å; Y492-L496 HydrophobicContact CE1-CD1 3.39Å; Y492-L496 HydrophobicContact CE1-CG 4.17Å; Y492-L496 HydrophobicContact CE2-CD1 4.29Å; Y492-L496 HydrophobicContact CE2-CG 4.33Å; Y492-L496 VanDerWaalsContact CZ-CD1 3.5Å; Y492-L496 PolarHBondContact O-N 3.23Å; L493-L496 PolarHBondContact O-N 3.11Å; L496-L499 PolarHBondContact O-N 3.36Å; L496-K500 WeakPolarHBondContact O-CG 3.38Å; L496-K500 PolarHBondContact O-N 3.45Å
497	L	87.6	Confident	87.7	Confident	17 Å²	17	51.4 Å²	51.4	9%	0.089	27%	0.274	C	S	.	.	H	α-helix	trans	-69	-41.5	-176.7	-68	167.7	0	0	0	112.3	L493 F494 T495 K500 L501 G555 L556	L493-L497 WeakPolarHBondContact O-CB 3.42Å; L493-L497 VanDerWaalsContact O-CG 3.25Å; L493-L497 WeakPolarHBondContact O-CG 3.33Å; L493-L497 PolarHBondContact O-N 2.65Å; F494-L497 PolarHBondContact O-N 3.46Å; T495-L497 PolarHBondContact O-N 2.9Å; L497-K500 PolarHBondContact O-N 3.11Å; L497-L501 WeakPolarHBondContact O-CB 3.25Å; L497-L501 PolarHBondContact O-N 2.03Å; L497-G555 WeakPolarHBondContact CD1-O 3.22Å; L497-L556 HydrophobicContact CB-CD2 3.96Å; L497-L556 HydrophobicContact CB-CG 4.17Å; L497-L556 HydrophobicContact CD1-CD2 4.27Å; L497-L556 HydrophobicContact CD1-CG 4.34Å
498	L	88.3	Confident	87.1	Confident	96 Å²	96	47.9 Å²	47.9	50%	0.503	26%	0.257	S	S	.	.	H	α-helix	trans	-67.4	-38.6	176.7	-72.7	175.8	0	0	0	111.8	F494 K500 L501 F502	F494-L498 VanDerWaalsContact O-CB 3.25Å; F494-L498 WeakPolarHBondContact O-CB 3.28Å; F494-L498 WeakPolarHBondContact O-CG 3.3Å; F494-L498 PolarHBondContact O-N 3.32Å; L498-K500 VanDerWaalsContact C-N 3.34Å; L498-L501 HydrophobicContact CD2-CD2 4.44Å; L498-L501 PolarHBondContact O-N 2.98Å; L498-F502 WeakPolarHBondContact O-CB 3.05Å; L498-F502 PolarHBondContact O-N 3.27Å
499	L	89.9	Confident	86.8	Confident	49 Å²	49	50.8 Å²	50.8	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-61.9	-44.6	174.7	-177.7	66.5	0	0	0	111	M406 F407 L462 T495 L496 F502 A503	M406-L499 HydrophobicContact CE-CD1 4.44Å; M406-L499 HydrophobicContact CE-CD2 3.64Å; M406-L499 HydrophobicContact CE-CG 3.61Å; M406-L499 HydrophobicContact SD-CG 4.42Å; F407-L499 HydrophobicContact CE1-CD1 4.26Å; F407-L499 HydrophobicContact CE1-CD2 4.28Å; F407-L499 HydrophobicContact CZ-CD1 4.48Å; F407-L499 HydrophobicContact CZ-CD2 3.75Å; L462-L499 HydrophobicContact CD1-CD2 3.69Å; T495-L499 VanDerWaalsContact O-CB 3.23Å; T495-L499 WeakPolarHBondContact O-CB 2.91Å; T495-L499 PolarHBondContact O-N 3.29Å; L496-L499 PolarHBondContact O-N 3.36Å; L499-F502 PolarHBondContact O-N 3.23Å; L499-A503 WeakPolarHBondContact O-CB 3.16Å; L499-A503 PolarHBondContact O-N 3.5Å
500	K	86.7	Confident	86.3	Confident	24 Å²	24	50.8 Å²	50.8	10%	0.104	26%	0.262	C	S	.	.	H	α-helix	trans	-63	-43.4	174	-74	-177.8	-177.2	-175.3	0	112.4	S402 E403 M406 L496 L497 L498 F502 A503 V504 V552	S402-K500 PolarHBondContact OG-NZ 3.18Å; E403-K500 WeakPolarHBondContact OE1-CE 3.35Å; E403-K500 IonicContact OE1-NZ 2.71Å; E403-K500 PolarHBondContact OE1-NZ 3.43Å; M406-K500 HydrophobicContact SD-CB 4.31Å; M406-K500 HydrophobicContact SD-CG 3.72Å; L496-K500 WeakPolarHBondContact O-CG 3.38Å; L496-K500 PolarHBondContact O-N 3.45Å; L497-K500 PolarHBondContact O-N 3.11Å; L498-K500 VanDerWaalsContact C-N 3.34Å; K500-F502 PolarHBondContact O-N 3.44Å; K500-A503 PolarHBondContact O-N 2.68Å; K500-V504 WeakPolarHBondContact O-CB 3.44Å; K500-V504 VanDerWaalsContact O-CG2 3.26Å; K500-V504 WeakPolarHBondContact O-CG2 3.48Å; K500-V504 PolarHBondContact O-N 2.96Å; K500-V552 HydrophobicContact CB-CG2 3.7Å
501	L	84.4	Confident	85.6	Confident	80 Å²	80	47.8 Å²	47.8	42%	0.419	25%	0.249	S	C	.	.	H	α-helix	trans	-60.9	-45.5	176.2	-178.4	64	0	0	0	111.4	L497 L498 V504 G505 V552 L556	L497-L501 WeakPolarHBondContact O-CB 3.25Å; L497-L501 PolarHBondContact O-N 2.03Å; L498-L501 HydrophobicContact CD2-CD2 4.44Å; L498-L501 PolarHBondContact O-N 2.98Å; L501-V504 PolarHBondContact O-N 3.44Å; L501-G505 PolarHBondContact O-N 3.39Å; L501-V552 HydrophobicContact CB-CG1 4.02Å; L501-V552 HydrophobicContact CD1-CG1 4.08Å; L501-L556 HydrophobicContact CD2-CD1 4.26Å
502	F	87.7	Confident	84.9	Confident	141 Å²	141	47.6 Å²	47.6	62%	0.618	24%	0.244	S	C	*	.	H	α-helix	trans	-63.5	-44.5	177.2	178.7	-95.5	0	0	0	111.5	L498 L499 K500 V504 G505 Y506	L498-F502 WeakPolarHBondContact O-CB 3.05Å; L498-F502 PolarHBondContact O-N 3.27Å; L499-F502 PolarHBondContact O-N 3.23Å; K500-F502 PolarHBondContact O-N 3.44Å; F502-V504 PolarHBondContact O-N 2.95Å; F502-G505 PolarHBondContact O-N 3.32Å; F502-Y506 VanDerWaalsContact O-CB 3.23Å; F502-Y506 WeakPolarHBondContact O-CB 3.37Å; F502-Y506 PolarHBondContact O-N 3.25Å
503	A	86	Confident	84.2	Confident	1 Å²	1	51 Å²	51	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-48.6	176.2	0	0	0	0	0	111.4	M406 I410 L499 K500 Y506 V507	M406-A503 HydrophobicContact CG-CB 3.41Å; M406-A503 VanDerWaalsContact CG-CB 3.41Å; M406-A503 HydrophobicContact SD-CB 3.39Å; M406-A503 WeakPolarHBondContact SD-CB 3.44Å; I410-A503 HydrophobicContact CD1-CB 3.73Å; I410-A503 HydrophobicContact CG1-CB 4.28Å; L499-A503 WeakPolarHBondContact O-CB 3.16Å; L499-A503 PolarHBondContact O-N 3.5Å; K500-A503 PolarHBondContact O-N 2.68Å; A503-Y506 PolarHBondContact O-N 3.04Å; A503-V507 VanDerWaalsContact O-CB 3.27Å; A503-V507 WeakPolarHBondContact O-CB 3.09Å; A503-V507 WeakPolarHBondContact O-CG2 3.42Å; A503-V507 PolarHBondContact O-N 3.06Å
504	V	78.2	Confident	83.3	Confident	18 Å²	18	50.6 Å²	50.6	11%	0.109	26%	0.258	C	S	.	.	H	α-helix	trans	-57.8	-49.2	176	162.6	0	0	0	0	111	K500 L501 F502 T508 F545 W548	K500-V504 WeakPolarHBondContact O-CB 3.44Å; K500-V504 VanDerWaalsContact O-CG2 3.26Å; K500-V504 WeakPolarHBondContact O-CG2 3.48Å; K500-V504 PolarHBondContact O-N 2.96Å; L501-V504 PolarHBondContact O-N 3.44Å; F502-V504 PolarHBondContact O-N 2.95Å; V504-T508 VanDerWaalsContact O-CB 3.26Å; V504-T508 WeakPolarHBondContact O-CB 3.4Å; V504-T508 PolarHBondContact O-N 3.17Å; V504-T508 PolarHBondContact O-OG1 3.42Å; V504-F545 HydrophobicContact CG1-CD2 3.59Å; V504-F545 HydrophobicContact CG1-CE2 3.52Å; V504-W548 HydrophobicContact CG2-CB 4.44Å; V504-W548 HydrophobicContact CG2-CE3 4.12Å
505	G	82.6	Confident	82.5	Confident	39 Å²	39	54.7 Å²	54.7	40%	0.402	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-45.8	179.1	0	0	0	0	0	112.8	L501 F502 T508 F509	L501-G505 PolarHBondContact O-N 3.39Å; F502-G505 PolarHBondContact O-N 3.32Å; G505-T508 PolarHBondContact O-N 2.94Å; G505-F509 VanDerWaalsContact O-CB 3.32Å; G505-F509 WeakPolarHBondContact O-CB 3.27Å; G505-F509 PolarHBondContact O-N 3.46Å
506	Y	87.3	Confident	81.7	Confident	77 Å²	77	58.2 Å²	58.2	30%	0.302	28%	0.282	S	S	.	.	H	α-helix	trans	-63.1	-47.2	179.6	179.5	-99.2	0	0	0	112.2	I410 I414 F502 A503 F509 N510	I410-Y506 HydrophobicContact CG2-CD1 4.01Å; I410-Y506 HydrophobicContact CG2-CE1 3.85Å; I414-Y506 HydrophobicContact CD1-CE1 4.43Å; I414-Y506 HydrophobicContact CG1-CE1 4.12Å; F502-Y506 VanDerWaalsContact O-CB 3.23Å; F502-Y506 WeakPolarHBondContact O-CB 3.37Å; F502-Y506 PolarHBondContact O-N 3.25Å; A503-Y506 PolarHBondContact O-N 3.04Å; Y506-F509 PolarHBondContact O-N 3.41Å; Y506-N510 WeakPolarHBondContact CD1-ND2 3.15Å; Y506-N510 WeakPolarHBondContact CE1-ND2 3.48Å; Y506-N510 PolarHBondContact O-N 3.44Å; Y506-N510 PolarHBondContact O-ND2 3.28Å
507	V	80.7	Confident	80.6	Confident	9 Å²	9	59.3 Å²	59.3	6%	0.055	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-47.7	178.8	169.9	0	0	0	0	109.9	T409 I410 A503 F509 N510 Y511 V541	T409-V507 HydrophobicContact CG2-CG1 4.44Å; T409-V507 HydrophobicContact CG2-CG2 4.48Å; I410-V507 HydrophobicContact CG1-CG2 3.87Å; A503-V507 VanDerWaalsContact O-CB 3.27Å; A503-V507 WeakPolarHBondContact O-CB 3.09Å; A503-V507 WeakPolarHBondContact O-CG2 3.42Å; A503-V507 PolarHBondContact O-N 3.06Å; V507-F509 PolarHBondContact O-N 2.9Å; V507-N510 PolarHBondContact O-N 2.88Å; V507-Y511 HydrophobicContact CG1-CD2 3.8Å; V507-Y511 HydrophobicContact CG1-CE2 3.83Å; V507-Y511 VanDerWaalsContact O-CD2 3.25Å; V507-Y511 WeakPolarHBondContact O-CD2 3.23Å; V507-Y511 PolarHBondContact O-N 3.43Å; V507-V541 HydrophobicContact CG1-CB 4.33Å; V507-V541 HydrophobicContact CG1-CG1 3.14Å; V507-V541 HydrophobicContact CG1-CG2 4.32Å
508	T	76.7	Confident	79.5	Confident	48 Å²	48	60.1 Å²	60.1	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-57.7	-48.1	177.1	-57.3	0	0	0	0	111.7	V504 G505 N510 Y511 L512	V504-T508 VanDerWaalsContact O-CB 3.26Å; V504-T508 WeakPolarHBondContact O-CB 3.4Å; V504-T508 PolarHBondContact O-N 3.17Å; V504-T508 PolarHBondContact O-OG1 3.42Å; G505-T508 PolarHBondContact O-N 2.94Å; T508-N510 VanDerWaalsContact C-N 3.33Å; T508-N510 PolarHBondContact O-N 3.42Å; T508-Y511 PolarHBondContact O-N 3.33Å; T508-L512 HydrophobicContact CG2-CD1 3.92Å; T508-L512 HydrophobicContact CG2-CG 4.28Å; T508-L512 WeakPolarHBondContact O-CB 3.33Å; T508-L512 WeakPolarHBondContact O-CG 3.32Å; T508-L512 PolarHBondContact O-N 3.36Å
509	F	84.1	Confident	78.4	Confident	125 Å²	125	58.9 Å²	58.9	55%	0.548	29%	0.293	S	S	.	.	H	α-helix	trans	-56.4	-45.7	176.6	172.4	-99.7	0	0	0	112.1	G505 Y506 V507 Y511 L512 H513	G505-F509 VanDerWaalsContact O-CB 3.32Å; G505-F509 WeakPolarHBondContact O-CB 3.27Å; G505-F509 PolarHBondContact O-N 3.46Å; Y506-F509 PolarHBondContact O-N 3.41Å; V507-F509 PolarHBondContact O-N 2.9Å; F509-Y511 PolarHBondContact O-N 2.63Å; F509-L512 PolarHBondContact O-N 3.23Å; F509-H513 VanDerWaalsContact O-CB 3.31Å; F509-H513 WeakPolarHBondContact O-CB 3.43Å; F509-H513 PolarHBondContact O-N 3.46Å
510	N	79.8	Confident	77.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-41.3	179	-74.9	-31.9	0	0	0	112.3	S413 K417 Y506 V507 T508 I514	S413-N510 PolarHBondContact OG-ND2 3.37Å; K417-N510 HydrophobicContact CD-CB 4.38Å; K417-N510 WeakPolarHBondContact CD-OD1 3.16Å; K417-N510 PolarHBondContact NZ-OD1 3.44Å; Y506-N510 WeakPolarHBondContact CD1-ND2 3.15Å; Y506-N510 WeakPolarHBondContact CE1-ND2 3.48Å; Y506-N510 PolarHBondContact O-N 3.44Å; Y506-N510 PolarHBondContact O-ND2 3.28Å; V507-N510 PolarHBondContact O-N 2.88Å; T508-N510 VanDerWaalsContact C-N 3.33Å; T508-N510 PolarHBondContact O-N 3.42Å; N510-I514 WeakPolarHBondContact O-CD1 3.17Å; N510-I514 WeakPolarHBondContact O-CG1 3.5Å; N510-I514 PolarHBondContact O-N 3.49Å
511	Y	73.1	Confident	76	Confident	16 Å²	16	61.9 Å²	61.9	6%	0.063	34%	0.336	C	S	.	.	H	α-helix	trans	-75	-36.4	179.7	-80	-76.2	0	0	0	113.3	V416 V507 T508 F509 H513 I514 Y515 T538 V541	V416-Y511 HydrophobicContact CG1-CE1 4.28Å; V507-Y511 HydrophobicContact CG1-CD2 3.8Å; V507-Y511 HydrophobicContact CG1-CE2 3.83Å; V507-Y511 VanDerWaalsContact O-CD2 3.25Å; V507-Y511 WeakPolarHBondContact O-CD2 3.23Å; V507-Y511 PolarHBondContact O-N 3.43Å; T508-Y511 PolarHBondContact O-N 3.33Å; F509-Y511 PolarHBondContact O-N 2.63Å; Y511-H513 VanDerWaalsContact C-N 3.32Å; Y511-I514 HydrophobicContact CD1-CD1 4.09Å; Y511-I514 HydrophobicContact CE1-CD1 4.37Å; Y511-I514 PolarHBondContact O-N 2.88Å; Y511-Y515 WeakPolarHBondContact O-CB 3.29Å; Y511-Y515 PolarHBondContact O-N 3.26Å; Y511-T538 HydrophobicContact CD1-CG2 3.76Å; Y511-T538 WeakPolarHBondContact CD1-OG1 3.38Å; Y511-T538 HydrophobicContact CE1-CG2 4.32Å; Y511-T538 WeakPolarHBondContact CE1-OG1 3.49Å; Y511-T538 HydrophobicContact CG-CG2 4.32Å; Y511-V541 HydrophobicContact CD2-CB 4.2Å; Y511-V541 HydrophobicContact CD2-CG1 3.72Å; Y511-V541 HydrophobicContact CD2-CG2 4.32Å; Y511-V541 HydrophobicContact CE2-CB 3.76Å; Y511-V541 HydrophobicContact CE2-CG1 3.65Å; Y511-V541 HydrophobicContact CE2-CG2 3.41Å; Y511-V541 VanDerWaalsContact CE2-CG2 3.41Å; Y511-V541 WeakPolarHBondContact OH-CG2 3.43Å
512	L	77.7	Confident	74.8	Confident	88 Å²	88	67.8 Å²	67.8	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-59.3	-46.6	169.9	-74.1	173.1	0	0	0	110.5	T508 F509 I514 Y515 F516	T508-L512 HydrophobicContact CG2-CD1 3.92Å; T508-L512 HydrophobicContact CG2-CG 4.28Å; T508-L512 WeakPolarHBondContact O-CB 3.33Å; T508-L512 WeakPolarHBondContact O-CG 3.32Å; T508-L512 PolarHBondContact O-N 3.36Å; F509-L512 PolarHBondContact O-N 3.23Å; L512-I514 VanDerWaalsContact C-N 3.32Å; L512-I514 PolarHBondContact O-N 3.13Å; L512-Y515 WeakPolarHBondContact O-CB 3.43Å; L512-Y515 PolarHBondContact O-N 3.12Å; L512-Y515 VanDerWaalsContact O-N 3.17Å; L512-F516 HydrophobicContact CB-CD2 4.47Å; L512-F516 HydrophobicContact CB-CE2 4.32Å; L512-F516 HydrophobicContact CD2-CE2 4.4Å; L512-F516 WeakPolarHBondContact O-CD2 3.13Å; L512-F516 PolarHBondContact O-N 3.28Å
513	H	77.9	Confident	73.5	Confident	79 Å²	79	63.2 Å²	63.2	37%	0.366	34%	0.341	S	S	.	.	H	α-helix	trans	-59.8	-42.3	175.8	-179.2	-82.2	0	0	0	111.9	F509 Y511 M517	F509-H513 VanDerWaalsContact O-CB 3.31Å; F509-H513 WeakPolarHBondContact O-CB 3.43Å; F509-H513 PolarHBondContact O-N 3.46Å; Y511-H513 VanDerWaalsContact C-N 3.32Å; H513-M517 VanDerWaalsContact O-CB 3.29Å; H513-M517 WeakPolarHBondContact O-CB 3.43Å; H513-M517 PolarHBondContact O-N 3.44Å; H513-M517 VanDerWaalsContact O-N 3.08Å
514	I	70.6	Confident	72.3	Confident	11 Å²	11	65.5 Å²	65.5	6%	0.056	36%	0.356	C	S	.	.	H	α-helix	trans	-61.7	-48.8	173.8	-68.8	157.4	0	0	0	110.1	V416 K417 Q420 N510 Y511 L512 F516 M517 V518	V416-I514 HydrophobicContact CG1-CD1 3.78Å; K417-I514 HydrophobicContact CB-CD1 4.27Å; Q420-I514 HydrophobicContact CG-CG2 4.22Å; N510-I514 WeakPolarHBondContact O-CD1 3.17Å; N510-I514 WeakPolarHBondContact O-CG1 3.5Å; N510-I514 PolarHBondContact O-N 3.49Å; Y511-I514 HydrophobicContact CD1-CD1 4.09Å; Y511-I514 HydrophobicContact CE1-CD1 4.37Å; Y511-I514 PolarHBondContact O-N 2.88Å; L512-I514 VanDerWaalsContact C-N 3.32Å; L512-I514 PolarHBondContact O-N 3.13Å; I514-F516 PolarHBondContact O-N 3.05Å; I514-M517 PolarHBondContact O-N 2.9Å; I514-V518 HydrophobicContact CG2-CG2 4.34Å; I514-V518 WeakPolarHBondContact O-CB 3.21Å; I514-V518 WeakPolarHBondContact O-CG2 3.27Å; I514-V518 PolarHBondContact O-N 3.3Å
515	Y	71.4	Confident	71.3	Confident	149 Å²	149	68.6 Å²	68.6	58%	0.584	38%	0.383	S	S	*	.	H	α-helix	trans	-57.1	-47.3	-179.2	175.8	-97.4	0	0	0	112.6	Y511 L512 M517 V518 S519	Y511-Y515 WeakPolarHBondContact O-CB 3.29Å; Y511-Y515 PolarHBondContact O-N 3.26Å; L512-Y515 WeakPolarHBondContact O-CB 3.43Å; L512-Y515 PolarHBondContact O-N 3.12Å; L512-Y515 VanDerWaalsContact O-N 3.17Å; Y515-M517 PolarHBondContact O-N 3.29Å; Y515-V518 PolarHBondContact O-N 3.03Å; Y515-S519 WeakPolarHBondContact O-CB 3.37Å; Y515-S519 PolarHBondContact O-N 3.43Å; Y515-S519 PolarHBondContact O-OG 2.72Å
516	F	74.6	Confident	70.1	Confident	146 Å²	146	70.8 Å²	70.8	64%	0.64	40%	0.397	S	S	*	.	H	α-helix	trans	-68.3	-32.4	178.6	-72.2	-60.7	0	0	0	113.2	L512 I514 V518	L512-F516 HydrophobicContact CB-CD2 4.47Å; L512-F516 HydrophobicContact CB-CE2 4.32Å; L512-F516 HydrophobicContact CD2-CE2 4.4Å; L512-F516 WeakPolarHBondContact O-CD2 3.13Å; L512-F516 PolarHBondContact O-N 3.28Å; I514-F516 PolarHBondContact O-N 3.05Å; F516-V518 PolarHBondContact O-N 3.22Å
517	M	68.5	Low	68.8	Low	33 Å²	33	69 Å²	69	16%	0.163	39%	0.392	C	S	.	.	H	α-helix	trans	-67.6	-20.9	177.1	-162.9	-143.6	-132.8	0	0	112.7	L421 R424 H513 I514 Y515	L421-M517 HydrophobicContact CD2-CE 3.47Å; L421-M517 VanDerWaalsContact CD2-CE 3.47Å; L421-M517 HydrophobicContact CG-CE 4.23Å; R424-M517 HydrophobicContact CB-CE 3.95Å; R424-M517 HydrophobicContact CB-SD 4.18Å; R424-M517 VanDerWaalsContact CD-SD 3.54Å; R424-M517 HydrophobicContact CG-CE 4.2Å; R424-M517 HydrophobicContact CG-SD 4.45Å; R424-M517 VanDerWaalsContact NH1-CG 3.35Å; H513-M517 VanDerWaalsContact O-CB 3.29Å; H513-M517 WeakPolarHBondContact O-CB 3.43Å; H513-M517 PolarHBondContact O-N 3.44Å; H513-M517 VanDerWaalsContact O-N 3.08Å; I514-M517 PolarHBondContact O-N 2.9Å; Y515-M517 PolarHBondContact O-N 3.29Å
518	V	63.2	Low	67.9	Low	34 Å²	34	72 Å²	72	21%	0.206	41%	0.41	C	S	.	.	H	α-helix	trans	-108.7	-32.5	-167.2	178.1	0	0	0	0	111.9	I514 Y515 F516 G520 A521 L523 W531	I514-V518 HydrophobicContact CG2-CG2 4.34Å; I514-V518 WeakPolarHBondContact O-CB 3.21Å; I514-V518 WeakPolarHBondContact O-CG2 3.27Å; I514-V518 PolarHBondContact O-N 3.3Å; Y515-V518 PolarHBondContact O-N 3.03Å; F516-V518 PolarHBondContact O-N 3.22Å; V518-G520 VanDerWaalsContact C-N 3.25Å; V518-G520 PolarHBondContact O-N 2.73Å; V518-A521 PolarHBondContact O-N 2.8Å; V518-A521 VanDerWaalsContact O-N 3.08Å; V518-L523 HydrophobicContact CG1-CD1 4.34Å; V518-W531 HydrophobicContact CB-CH2 4.14Å; V518-W531 HydrophobicContact CB-CZ3 3.92Å; V518-W531 HydrophobicContact CG1-CE3 3.83Å; V518-W531 HydrophobicContact CG1-CH2 3.83Å; V518-W531 HydrophobicContact CG1-CZ3 3.42Å; V518-W531 VanDerWaalsContact CG1-CZ3 3.42Å; V518-W531 HydrophobicContact CG2-CE3 4.3Å; V518-W531 HydrophobicContact CG2-CH2 3.2Å; V518-W531 HydrophobicContact CG2-CZ2 4.42Å; V518-W531 HydrophobicContact CG2-CZ3 3.14Å
519	S	65.6	Low	67.1	Low	70 Å²	70	73.3 Å²	73.3	49%	0.49	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	85.9	174	-59.7	0	0	0	0	109.4	Y515	Y515-S519 WeakPolarHBondContact O-CB 3.37Å; Y515-S519 PolarHBondContact O-N 3.43Å; Y515-S519 PolarHBondContact O-OG 2.72Å
520	G	63.3	Low	65.9	Low	81 Å²	81	71.2 Å²	71.2	84%	0.835	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	136.2	-13.9	-179	0	0	0	0	0	115.3	V518	V518-G520 VanDerWaalsContact C-N 3.25Å; V518-G520 PolarHBondContact O-N 2.73Å
521	A	62	Low	65	Low	54 Å²	54	73 Å²	73	45%	0.446	41%	0.414	S	S	.	.			trans	-86.6	119.4	179.9	0	0	0	0	0	111.6	V518 L523	V518-A521 PolarHBondContact O-N 2.8Å; V518-A521 VanDerWaalsContact O-N 3.08Å; A521-L523 PolarHBondContact O-N 3.33Å
522	K	60.8	Low	64.5	Low	204 Å²	204	76.4 Å²	76.4	89%	0.887	43%	0.433	S	S	*	.			trans	-71	108.4	165.7	-75.6	-174.5	-178.4	178.3	0	108.7
523	L	60.5	Low	63.6	Low	45 Å²	45	75.7 Å²	75.7	24%	0.236	43%	0.428	C	S	.	.			trans	-89.3	128.9	-174	-83.4	149.1	0	0	0	112.1	I427 V518 A521 A525 W531	I427-L523 HydrophobicContact CD1-CD2 3.38Å; V518-L523 HydrophobicContact CG1-CD1 4.34Å; A521-L523 PolarHBondContact O-N 3.33Å; L523-A525 PolarHBondContact O-N 3.38Å; L523-W531 HydrophobicContact CD1-CD2 3.52Å; L523-W531 HydrophobicContact CD1-CE3 4.25Å; L523-W531 HydrophobicContact CD1-CG 3.85Å; L523-W531 HydrophobicContact CD1-CH2 4.22Å; L523-W531 HydrophobicContact CD1-CZ2 3.5Å; L523-W531 HydrophobicContact CD2-CD2 4.49Å; L523-W531 HydrophobicContact CD2-CZ2 3.51Å; L523-W531 HydrophobicContact CG-CD2 4.49Å; L523-W531 HydrophobicContact CG-CZ2 4.03Å
524	P	59.6	Low	62.8	Low	50 Å²	50	72.2 Å²	72.2	33%	0.325	41%	0.414	S	S	.	.			trans	-56.5	139.1	173.1	-21.5	31.2	0	0	0	110.4	I427 A526 H527	I427-P524 HydrophobicContact CG1-CG 4.49Å; P524-A526 PolarHBondContact O-N 3.25Å; P524-H527 PolarHBondContact O-N 3.31Å
525	A	58.1	Low	62.5	Low	82 Å²	82	80.7 Å²	80.7	68%	0.678	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-50.1	-34.5	-178.1	0	0	0	0	0	113.1	L523 H527 T528	L523-A525 PolarHBondContact O-N 3.38Å; A525-H527 PolarHBondContact O-N 3.09Å; A525-H527 VanDerWaalsContact O-N 3.16Å; A525-T528 WeakPolarHBondContact O-CB 3.34Å; A525-T528 WeakPolarHBondContact O-CG2 3.45Å; A525-T528 PolarHBondContact O-N 3.33Å; A525-T528 PolarHBondContact O-OG1 2.71Å
526	A	56.2	Low	62.1	Low	86 Å²	86	76.8 Å²	76.8	71%	0.711	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-57.6	-27	178.2	0	0	0	0	0	114.6	P524	P524-A526 PolarHBondContact O-N 3.25Å
527	H	61	Low	61.5	Low	39 Å²	39	70.9 Å²	70.9	18%	0.181	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-102.8	-6.1	-177.2	-70.9	-64.4	0	0	0	114.2	L423 P524 A525 Q529 D530 W531	L423-H527 HydrophobicContact CD1-CB 3.88Å; L423-H527 VanDerWaalsContact CD1-CD2 3.45Å; L423-H527 WeakPolarHBondContact CD1-CD2 3.35Å; L423-H527 WeakPolarHBondContact CD1-CE1 3.44Å; L423-H527 WeakPolarHBondContact CD1-ND1 3.44Å; L423-H527 HydrophobicContact CD2-CB 4.15Å; P524-H527 PolarHBondContact O-N 3.31Å; A525-H527 PolarHBondContact O-N 3.09Å; A525-H527 VanDerWaalsContact O-N 3.16Å; H527-Q529 PolarHBondContact O-N 3.06Å; H527-Q529 VanDerWaalsContact O-N 3.1Å; H527-D530 IonicContact ND1-OD2 3.68Å; H527-D530 PolarHBondContact O-N 3.13Å; H527-W531 PolarHBondContact O-N 3.3Å
528	T	61.1	Low	61.3	Low	71 Å²	71	71.2 Å²	71.2	44%	0.436	41%	0.41	S	S	.	.	H	α-helix	trans	-51.6	-34.5	178.4	55.2	0	0	0	0	113	A525 W531 D532	A525-T528 WeakPolarHBondContact O-CB 3.34Å; A525-T528 WeakPolarHBondContact O-CG2 3.45Å; A525-T528 PolarHBondContact O-N 3.33Å; A525-T528 PolarHBondContact O-OG1 2.71Å; T528-W531 WeakPolarHBondContact O-CB 3.45Å; T528-W531 PolarHBondContact O-N 2.79Å; T528-D532 PolarHBondContact O-N 3.02Å
529	Q	60.5	Low	61.4	Low	77 Å²	77	74.1 Å²	74.1	36%	0.36	42%	0.424	S	S	.	.	H	α-helix	trans	-67.2	-38.8	178.1	-172.4	171.2	10.8	0	0	113.2	H527 W531 M533 K595	H527-Q529 PolarHBondContact O-N 3.06Å; H527-Q529 VanDerWaalsContact O-N 3.1Å; Q529-W531 VanDerWaalsContact C-N 3.28Å; Q529-M533 PolarHBondContact O-N 2.88Å; Q529-K595 VanDerWaalsContact NE2-CE 3.28Å; Q529-K595 VanDerWaalsContact OE1-CE 3.24Å
530	D	58	Low	61.4	Low	81 Å²	81	70.9 Å²	70.9	43%	0.433	40%	0.401	S	S	.	.	H	α-helix	trans	-68.7	-32.3	175.9	-66.2	-32.6	0	0	0	110.6	H527 M533 A534	H527-D530 IonicContact ND1-OD2 3.68Å; H527-D530 PolarHBondContact O-N 3.13Å; D530-M533 PolarHBondContact O-N 3.43Å; D530-A534 WeakPolarHBondContact O-CB 3.42Å; D530-A534 PolarHBondContact O-N 3.39Å
531	W	61.7	Low	61.4	Low	36 Å²	36	67.4 Å²	67.4	14%	0.136	36%	0.364	C	S	.	.	H	α-helix	trans	-65.4	-47	173.5	-72	107.1	0	0	0	113.5	Q420 L423 V518 L523 H527 T528 Q529 M533 A534 R535	Q420-W531 VanDerWaalsContact CD-CH2 3.43Å; Q420-W531 VanDerWaalsContact OE1-CZ2 3.23Å; L423-W531 HydrophobicContact CD2-CH2 4.5Å; L423-W531 HydrophobicContact CD2-CZ2 3.55Å; L423-W531 HydrophobicContact CG-CZ2 4.35Å; V518-W531 HydrophobicContact CB-CH2 4.14Å; V518-W531 HydrophobicContact CB-CZ3 3.92Å; V518-W531 HydrophobicContact CG1-CE3 3.83Å; V518-W531 HydrophobicContact CG1-CH2 3.83Å; V518-W531 HydrophobicContact CG1-CZ3 3.42Å; V518-W531 VanDerWaalsContact CG1-CZ3 3.42Å; V518-W531 HydrophobicContact CG2-CE3 4.3Å; V518-W531 HydrophobicContact CG2-CH2 3.2Å; V518-W531 HydrophobicContact CG2-CZ2 4.42Å; V518-W531 HydrophobicContact CG2-CZ3 3.14Å; L523-W531 HydrophobicContact CD1-CD2 3.52Å; L523-W531 HydrophobicContact CD1-CE3 4.25Å; L523-W531 HydrophobicContact CD1-CG 3.85Å; L523-W531 HydrophobicContact CD1-CH2 4.22Å; L523-W531 HydrophobicContact CD1-CZ2 3.5Å; L523-W531 HydrophobicContact CD2-CD2 4.49Å; L523-W531 HydrophobicContact CD2-CZ2 3.51Å; L523-W531 HydrophobicContact CG-CD2 4.49Å; L523-W531 HydrophobicContact CG-CZ2 4.03Å; H527-W531 PolarHBondContact O-N 3.3Å; T528-W531 WeakPolarHBondContact O-CB 3.45Å; T528-W531 PolarHBondContact O-N 2.79Å; Q529-W531 VanDerWaalsContact C-N 3.28Å; W531-M533 VanDerWaalsContact C-N 3.26Å; W531-M533 PolarHBondContact O-N 3.18Å; W531-A534 PolarHBondContact O-N 3.07Å; W531-A534 VanDerWaalsContact O-N 3.17Å; W531-R535 WeakPolarHBondContact O-CB 3.41Å; W531-R535 PolarHBondContact O-N 2.89Å
532	D	62.5	Low	61.7	Low	88 Å²	88	67.8 Å²	67.8	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-41.2	177.1	-79	-19.3	0	0	0	110.9	T528 K536	T528-D532 PolarHBondContact O-N 3.02Å; D532-K536 WeakPolarHBondContact O-CB 3.41Å; D532-K536 WeakPolarHBondContact O-CG 3.16Å; D532-K536 PolarHBondContact O-N 3.19Å; D532-K536 VanDerWaalsContact O-N 3.13Å
533	M	59	Low	62.1	Low	73 Å²	73	60 Å²	60	36%	0.36	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-46.4	174.5	-177.3	64.3	85.8	0	0	111.3	Q529 D530 W531 K536 L537	Q529-M533 PolarHBondContact O-N 2.88Å; D530-M533 PolarHBondContact O-N 3.43Å; W531-M533 VanDerWaalsContact C-N 3.26Å; W531-M533 PolarHBondContact O-N 3.18Å; M533-K536 PolarHBondContact O-N 2.97Å; M533-L537 HydrophobicContact CG-CD1 4.17Å; M533-L537 WeakPolarHBondContact O-CG 3.28Å; M533-L537 PolarHBondContact O-N 3.19Å
534	A	59.9	Low	62.5	Low	7 Å²	7	57.9 Å²	57.9	6%	0.058	32%	0.321	C	S	.	.	H	α-helix	trans	-64.4	-41.5	-179.9	0	0	0	0	0	113.1	V416 D530 W531 K536 L537 T538	V416-A534 HydrophobicContact CG1-CB 4.29Å; D530-A534 WeakPolarHBondContact O-CB 3.42Å; D530-A534 PolarHBondContact O-N 3.39Å; W531-A534 PolarHBondContact O-N 3.07Å; W531-A534 VanDerWaalsContact O-N 3.17Å; A534-K536 VanDerWaalsContact C-N 3.29Å; A534-K536 PolarHBondContact O-N 2.99Å; A534-L537 PolarHBondContact O-N 2.74Å; A534-T538 PolarHBondContact O-N 3.14Å; A534-T538 PolarHBondContact O-OG1 3.2Å
535	R	64.6	Low	63.1	Low	189 Å²	189	59.3 Å²	59.3	71%	0.713	32%	0.322	S	S	*	.	H	α-helix	trans	-62.5	-38.5	176.5	-175.5	176.9	-179.4	169.1	1.3	111.6	W531 T538 L539	W531-R535 WeakPolarHBondContact O-CB 3.41Å; W531-R535 PolarHBondContact O-N 2.89Å; R535-T538 VanDerWaalsContact O-CB 3.22Å; R535-T538 WeakPolarHBondContact O-CB 3.18Å; R535-T538 PolarHBondContact O-N 2.95Å; R535-L539 PolarHBondContact O-N 3.14Å; R535-L539 VanDerWaalsContact O-N 3.15Å
536	K	64.2	Low	63.6	Low	66 Å²	66	59.9 Å²	59.9	29%	0.287	32%	0.317	S	S	.	.	H	α-helix	trans	-76.3	-34.4	179.8	-65.1	178.8	-161.1	179.4	0	112.5	D532 M533 A534 T538 L539 L540 S592	D532-K536 WeakPolarHBondContact O-CB 3.41Å; D532-K536 WeakPolarHBondContact O-CG 3.16Å; D532-K536 PolarHBondContact O-N 3.19Å; D532-K536 VanDerWaalsContact O-N 3.13Å; M533-K536 PolarHBondContact O-N 2.97Å; A534-K536 VanDerWaalsContact C-N 3.29Å; A534-K536 PolarHBondContact O-N 2.99Å; K536-T538 PolarHBondContact O-N 3.08Å; K536-L539 WeakPolarHBondContact O-CB 3.5Å; K536-L539 PolarHBondContact O-N 3.01Å; K536-L540 PolarHBondContact O-N 2.81Å; K536-L540 VanDerWaalsContact O-N 3.16Å; K536-S592 WeakPolarHBondContact CB-OG 3.39Å; K536-S592 VanDerWaalsContact CD-CA 3.46Å; K536-S592 WeakPolarHBondContact CD-O 3.15Å; K536-S592 VanDerWaalsContact CD-OG 3.26Å; K536-S592 WeakPolarHBondContact CD-OG 3.35Å; K536-S592 PolarHBondContact NZ-O 3.32Å
537	L	62	Low	64.4	Low	22 Å²	22	56 Å²	56	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-32.1	166.7	-70.8	172.4	0	0	0	111.7	I412 V416 M533 A534 L540 V541	I412-L537 HydrophobicContact CG2-CD1 4.5Å; I412-L537 HydrophobicContact CG2-CD2 4.21Å; V416-L537 HydrophobicContact CG2-CB 4.29Å; V416-L537 HydrophobicContact CG2-CD1 3.54Å; M533-L537 HydrophobicContact CG-CD1 4.17Å; M533-L537 WeakPolarHBondContact O-CG 3.28Å; M533-L537 PolarHBondContact O-N 3.19Å; A534-L537 PolarHBondContact O-N 2.74Å; L537-L540 PolarHBondContact O-N 2.86Å; L537-V541 WeakPolarHBondContact O-CG2 3.23Å; L537-V541 PolarHBondContact O-N 2.81Å; L537-V541 VanDerWaalsContact O-N 3.09Å
538	T	62.7	Low	65	Low	41 Å²	41	55.1 Å²	55.1	25%	0.252	28%	0.28	S	S	.	.	H	α-helix	trans	-63.6	-42.7	172.8	-50.6	0	0	0	0	111.2	Y511 A534 R535 K536 L540 V541 C542	Y511-T538 HydrophobicContact CD1-CG2 3.76Å; Y511-T538 WeakPolarHBondContact CD1-OG1 3.38Å; Y511-T538 HydrophobicContact CE1-CG2 4.32Å; Y511-T538 WeakPolarHBondContact CE1-OG1 3.49Å; Y511-T538 HydrophobicContact CG-CG2 4.32Å; A534-T538 PolarHBondContact O-N 3.14Å; A534-T538 PolarHBondContact O-OG1 3.2Å; R535-T538 VanDerWaalsContact O-CB 3.22Å; R535-T538 WeakPolarHBondContact O-CB 3.18Å; R535-T538 PolarHBondContact O-N 2.95Å; K536-T538 PolarHBondContact O-N 3.08Å; T538-L540 VanDerWaalsContact C-N 3.33Å; T538-L540 PolarHBondContact O-N 3.31Å; T538-V541 PolarHBondContact O-N 2.73Å; T538-V541 VanDerWaalsContact O-N 3.17Å; T538-C542 PolarHBondContact O-N 2.99Å; T538-C542 PolarHBondContact O-SG 3.01Å
539	L	66	Low	65.6	Low	94 Å²	94	53.9 Å²	53.9	49%	0.492	27%	0.272	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175.9	-71.2	170.7	0	0	0	112.5	R535 K536 V541 C542 T543	R535-L539 PolarHBondContact O-N 3.14Å; R535-L539 VanDerWaalsContact O-N 3.15Å; K536-L539 WeakPolarHBondContact O-CB 3.5Å; K536-L539 PolarHBondContact O-N 3.01Å; L539-V541 VanDerWaalsContact C-N 3.27Å; L539-V541 PolarHBondContact O-N 3.09Å; L539-C542 WeakPolarHBondContact O-CB 3.39Å; L539-C542 PolarHBondContact O-N 3.42Å; L539-T543 PolarHBondContact O-N 3.26Å; L539-T543 PolarHBondContact O-OG1 3.12Å
540	L	65.7	Low	66.2	Low	2 Å²	2	51.8 Å²	51.8	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-34.5	175	-179.1	136.4	0	0	0	112.8	L353 K536 L537 T538 T543 N544 D585 L588 Y589	L353-L540 HydrophobicContact CD2-CD2 3.94Å; K536-L540 PolarHBondContact O-N 2.81Å; K536-L540 VanDerWaalsContact O-N 3.16Å; L537-L540 PolarHBondContact O-N 2.86Å; T538-L540 VanDerWaalsContact C-N 3.33Å; T538-L540 PolarHBondContact O-N 3.31Å; L540-T543 WeakPolarHBondContact CA-OG1 3.41Å; L540-T543 PolarHBondContact O-OG1 2.89Å; L540-N544 PolarHBondContact O-N 3.12Å; L540-N544 PolarHBondContact O-ND2 2.91Å; L540-D585 HydrophobicContact CD1-CB 4.17Å; L540-L588 HydrophobicContact CB-CD1 3.83Å; L540-L588 HydrophobicContact CD1-CB 4.19Å; L540-L588 HydrophobicContact CD1-CD1 4.31Å; L540-L588 HydrophobicContact CG-CD1 4.27Å; L540-Y589 HydrophobicContact CD1-CD1 4.15Å; L540-Y589 HydrophobicContact CD1-CE1 3.38Å; L540-Y589 HydrophobicContact CD1-CE2 4.44Å; L540-Y589 WeakPolarHBondContact CD1-OH 3.48Å
541	V	64	Low	67	Low	9 Å²	9	49.2 Å²	49.2	6%	0.055	25%	0.252	C	S	.	.	H	α-helix	trans	-73.4	-37.5	173.1	168.1	0	0	0	0	111.8	T409 V507 Y511 L537 T538 L539 T543 N544 F545	T409-V541 HydrophobicContact CG2-CG2 3.85Å; V507-V541 HydrophobicContact CG1-CB 4.33Å; V507-V541 HydrophobicContact CG1-CG1 3.14Å; V507-V541 HydrophobicContact CG1-CG2 4.32Å; Y511-V541 HydrophobicContact CD2-CB 4.2Å; Y511-V541 HydrophobicContact CD2-CG1 3.72Å; Y511-V541 HydrophobicContact CD2-CG2 4.32Å; Y511-V541 HydrophobicContact CE2-CB 3.76Å; Y511-V541 HydrophobicContact CE2-CG1 3.65Å; Y511-V541 HydrophobicContact CE2-CG2 3.41Å; Y511-V541 VanDerWaalsContact CE2-CG2 3.41Å; Y511-V541 WeakPolarHBondContact OH-CG2 3.43Å; L537-V541 WeakPolarHBondContact O-CG2 3.23Å; L537-V541 PolarHBondContact O-N 2.81Å; L537-V541 VanDerWaalsContact O-N 3.09Å; T538-V541 PolarHBondContact O-N 2.73Å; T538-V541 VanDerWaalsContact O-N 3.17Å; L539-V541 VanDerWaalsContact C-N 3.27Å; L539-V541 PolarHBondContact O-N 3.09Å; V541-T543 VanDerWaalsContact C-N 3.35Å; V541-T543 PolarHBondContact O-N 2.8Å; V541-N544 PolarHBondContact O-N 2.86Å; V541-F545 VanDerWaalsContact O-CB 3.24Å; V541-F545 WeakPolarHBondContact O-CB 3.4Å; V541-F545 PolarHBondContact O-N 2.93Å
542	C	67	Low	67.7	Low	62 Å²	62	47.8 Å²	47.8	42%	0.419	25%	0.248	S	C	.	.	H	α-helix	trans	-62.4	-40.6	174.4	-68.3	0	0	0	0	112	T538 L539 F545 V546	T538-C542 PolarHBondContact O-N 2.99Å; T538-C542 PolarHBondContact O-SG 3.01Å; L539-C542 WeakPolarHBondContact O-CB 3.39Å; L539-C542 PolarHBondContact O-N 3.42Å; C542-F545 WeakPolarHBondContact O-CB 3.16Å; C542-F545 PolarHBondContact O-N 2.77Å; C542-V546 VanDerWaalsContact O-CG2 3.3Å; C542-V546 WeakPolarHBondContact O-CG2 3.28Å; C542-V546 PolarHBondContact O-N 3.25Å
543	T	70.4	Confident	68.4	Low	39 Å²	39	46.9 Å²	46.9	24%	0.239	25%	0.245	C	C	.	.	H	α-helix	trans	-64.1	-47.2	175.8	48.2	0	0	0	0	111	L539 L540 V541 F545 V546 C547 L588	L539-T543 PolarHBondContact O-N 3.26Å; L539-T543 PolarHBondContact O-OG1 3.12Å; L540-T543 WeakPolarHBondContact CA-OG1 3.41Å; L540-T543 PolarHBondContact O-OG1 2.89Å; V541-T543 VanDerWaalsContact C-N 3.35Å; V541-T543 PolarHBondContact O-N 2.8Å; T543-F545 VanDerWaalsContact C-N 3.33Å; T543-F545 PolarHBondContact O-N 2.86Å; T543-V546 PolarHBondContact O-N 3.14Å; T543-C547 WeakPolarHBondContact O-CB 3.28Å; T543-C547 PolarHBondContact O-N 2.97Å; T543-C547 VanDerWaalsContact O-N 3.08Å; T543-C547 PolarHBondContact O-SG 2.85Å; T543-L588 HydrophobicContact CG2-CD1 4.15Å
544	N	69.2	Low	69.2	Low	1 Å²	1	44 Å²	44	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-59	-42.6	174.4	-82.1	-61.6	0	0	0	112.3	L540 V541 C547 W548 N581 D585	L540-N544 PolarHBondContact O-N 3.12Å; L540-N544 PolarHBondContact O-ND2 2.91Å; V541-N544 PolarHBondContact O-N 2.86Å; N544-C547 PolarHBondContact O-N 3.21Å; N544-W548 HydrophobicContact CB-CH2 4.23Å; N544-W548 HydrophobicContact CB-CZ2 4.26Å; N544-W548 PolarHBondContact O-N 3.08Å; N544-N581 VanDerWaalsContact OD1-CB 3.28Å; N544-N581 WeakPolarHBondContact OD1-CB 3.29Å; N544-N581 PolarHBondContact OD1-ND2 2.62Å; N544-D585 PolarHBondContact ND2-OD2 2.71Å
545	F	70.2	Confident	70	Confident	81 Å²	81	44.6 Å²	44.6	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-52.4	176.3	170.6	-93.4	0	0	0	112.6	V504 V541 C542 T543 C547 W548 T549	V504-F545 HydrophobicContact CG1-CD2 3.59Å; V504-F545 HydrophobicContact CG1-CE2 3.52Å; V541-F545 VanDerWaalsContact O-CB 3.24Å; V541-F545 WeakPolarHBondContact O-CB 3.4Å; V541-F545 PolarHBondContact O-N 2.93Å; C542-F545 WeakPolarHBondContact O-CB 3.16Å; C542-F545 PolarHBondContact O-N 2.77Å; T543-F545 VanDerWaalsContact C-N 3.33Å; T543-F545 PolarHBondContact O-N 2.86Å; F545-C547 PolarHBondContact O-N 3.19Å; F545-W548 PolarHBondContact O-N 3.49Å; F545-T549 WeakPolarHBondContact O-CB 3.32Å; F545-T549 PolarHBondContact O-N 3.25Å; F545-T549 PolarHBondContact O-OG1 3.16Å
546	V	70.2	Confident	70.6	Confident	93 Å²	93	37.4 Å²	37.4	56%	0.564	21%	0.213	S	C	*	.	H	α-helix	trans	-62.9	-33.2	-178.7	171.5	0	0	0	0	110.5	C542 T543 P550	C542-V546 VanDerWaalsContact O-CG2 3.3Å; C542-V546 WeakPolarHBondContact O-CG2 3.28Å; C542-V546 PolarHBondContact O-N 3.25Å; T543-V546 PolarHBondContact O-N 3.14Å; V546-P550 WeakPolarHBondContact O-CD 3.25Å
547	C	73.3	Confident	71.3	Confident	6 Å²	6	34.9 Å²	34.9	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-77.2	-32.9	-179.8	-63	0	0	0	0	113.3	T543 N544 F545 I580 N581	T543-C547 WeakPolarHBondContact O-CB 3.28Å; T543-C547 PolarHBondContact O-N 2.97Å; T543-C547 VanDerWaalsContact O-N 3.08Å; T543-C547 PolarHBondContact O-SG 2.85Å; N544-C547 PolarHBondContact O-N 3.21Å; F545-C547 PolarHBondContact O-N 3.19Å; C547-I580 VanDerWaalsContact SG-CG2 3.57Å; C547-N581 HydrophobicContact CB-CB 4.17Å
548	W	72.2	Confident	71.9	Confident	19 Å²	19	36.7 Å²	36.7	7%	0.072	22%	0.218	C	C	.	.	H	α-helix	trans	-87.3	-27.5	-179.2	-63.1	-14.5	0	0	0	114	M406 V504 N544 F545 T551 V552 N581	M406-W548 VanDerWaalsContact CA-CH2 3.41Å; M406-W548 HydrophobicContact CB-CH2 3.79Å; M406-W548 HydrophobicContact CB-CZ2 4.38Å; M406-W548 HydrophobicContact CB-CZ3 3.95Å; M406-W548 HydrophobicContact CG-CH2 4.3Å; M406-W548 HydrophobicContact CG-CZ3 3.94Å; V504-W548 HydrophobicContact CG2-CB 4.44Å; V504-W548 HydrophobicContact CG2-CE3 4.12Å; N544-W548 HydrophobicContact CB-CH2 4.23Å; N544-W548 HydrophobicContact CB-CZ2 4.26Å; N544-W548 PolarHBondContact O-N 3.08Å; F545-W548 PolarHBondContact O-N 3.49Å; W548-T551 WeakPolarHBondContact O-CB 3.22Å; W548-T551 PolarHBondContact O-N 3.29Å; W548-T551 VanDerWaalsContact O-N 3.15Å; W548-V552 WeakPolarHBondContact O-CG2 3.41Å; W548-V552 PolarHBondContact O-N 3.21Å; W548-N581 PolarHBondContact NE1-ND2 3.09Å
549	T	73.9	Confident	72.3	Confident	46 Å²	46	35.7 Å²	35.7	28%	0.282	22%	0.215	S	C	.	.	H	α-helix	trans	-56	-47.4	-177.3	-60.2	0	0	0	0	112.7	F545 T551 V552 V553	F545-T549 WeakPolarHBondContact O-CB 3.32Å; F545-T549 PolarHBondContact O-N 3.25Å; F545-T549 PolarHBondContact O-OG1 3.16Å; T549-T551 VanDerWaalsContact C-N 3.32Å; T549-T551 PolarHBondContact O-N 2.61Å; T549-V552 PolarHBondContact O-N 2.87Å; T549-V553 HydrophobicContact CG2-CG2 4.17Å; T549-V553 WeakPolarHBondContact O-CG2 3.25Å; T549-V553 PolarHBondContact O-N 3.25Å
550	P	74.1	Confident	72.8	Confident	32 Å²	32	36.2 Å²	36.2	21%	0.208	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-44.1	177	-24.8	34.7	0	0	0	112.3	V546 V552 V553 I554 F573	V546-P550 WeakPolarHBondContact O-CD 3.25Å; P550-V552 VanDerWaalsContact C-N 3.35Å; P550-V552 PolarHBondContact O-N 2.74Å; P550-V553 PolarHBondContact O-N 2.8Å; P550-I554 HydrophobicContact CB-CD1 4.43Å; P550-I554 VanDerWaalsContact O-CB 3.24Å; P550-I554 WeakPolarHBondContact O-CB 3.07Å; P550-I554 WeakPolarHBondContact O-CD1 3.36Å; P550-I554 WeakPolarHBondContact O-CG1 3.43Å; P550-I554 PolarHBondContact O-N 3.14Å; P550-F573 HydrophobicContact CB-CD1 3.96Å; P550-F573 HydrophobicContact CB-CG 4.47Å; P550-F573 HydrophobicContact CG-CD1 4.37Å
551	T	73.7	Confident	73.3	Confident	27 Å²	27	39 Å²	39	17%	0.166	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-41.3	179.9	-52.1	0	0	0	0	112.1	W548 T549 G555 L574	W548-T551 WeakPolarHBondContact O-CB 3.22Å; W548-T551 PolarHBondContact O-N 3.29Å; W548-T551 VanDerWaalsContact O-N 3.15Å; T549-T551 VanDerWaalsContact C-N 3.32Å; T549-T551 PolarHBondContact O-N 2.61Å; T551-G555 PolarHBondContact O-N 2.9Å; T551-L574 HydrophobicContact CG2-CD2 3.85Å
552	V	77.3	Confident	73.9	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-68.4	-46.6	178.3	174.5	0	0	0	0	111	K500 L501 W548 T549 P550 L556	K500-V552 HydrophobicContact CB-CG2 3.7Å; L501-V552 HydrophobicContact CB-CG1 4.02Å; L501-V552 HydrophobicContact CD1-CG1 4.08Å; W548-V552 WeakPolarHBondContact O-CG2 3.41Å; W548-V552 PolarHBondContact O-N 3.21Å; T549-V552 PolarHBondContact O-N 2.87Å; P550-V552 VanDerWaalsContact C-N 3.35Å; P550-V552 PolarHBondContact O-N 2.74Å; V552-L556 HydrophobicContact CG1-CD1 3.72Å; V552-L556 HydrophobicContact CG1-CG 4.45Å; V552-L556 WeakPolarHBondContact O-CB 3.4Å; V552-L556 VanDerWaalsContact O-CG 3.32Å; V552-L556 WeakPolarHBondContact O-CG 3.48Å; V552-L556 PolarHBondContact O-N 2.88Å
553	V	77.5	Confident	74.3	Confident	68 Å²	68	46.6 Å²	46.6	41%	0.412	29%	0.286	S	S	.	.	H	α-helix	trans	-64.2	-48.8	-179.1	171.3	0	0	0	0	111	T549 P550 S557 L564	T549-V553 HydrophobicContact CG2-CG2 4.17Å; T549-V553 WeakPolarHBondContact O-CG2 3.25Å; T549-V553 PolarHBondContact O-N 3.25Å; P550-V553 PolarHBondContact O-N 2.8Å; V553-S557 WeakPolarHBondContact O-CB 3.36Å; V553-S557 PolarHBondContact O-N 3.43Å; V553-S557 PolarHBondContact O-OG 3.24Å; V553-L564 HydrophobicContact CG1-CD1 3.57Å
554	I	76.2	Confident	74.5	Confident	13 Å²	13	50.6 Å²	50.6	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-50.8	178.4	-68.2	166.2	0	0	0	109.7	P550 L556 S557 S558 L565 C570 F573	P550-I554 HydrophobicContact CB-CD1 4.43Å; P550-I554 VanDerWaalsContact O-CB 3.24Å; P550-I554 WeakPolarHBondContact O-CB 3.07Å; P550-I554 WeakPolarHBondContact O-CD1 3.36Å; P550-I554 WeakPolarHBondContact O-CG1 3.43Å; P550-I554 PolarHBondContact O-N 3.14Å; I554-L556 PolarHBondContact O-N 3.02Å; I554-S557 PolarHBondContact O-N 3.27Å; I554-S557 PolarHBondContact O-OG 3.28Å; I554-S558 PolarHBondContact O-N 3.35Å; I554-S558 PolarHBondContact O-OG 3.45Å; I554-L565 HydrophobicContact CD1-CD1 3.88Å; I554-L565 HydrophobicContact CG1-CD1 3.96Å; I554-C570 HydrophobicContact CG2-CB 3.96Å; I554-C570 WeakPolarHBondContact CG2-SG 3.23Å; I554-F573 HydrophobicContact CD1-CB 3.77Å; I554-F573 HydrophobicContact CD1-CD2 4.15Å; I554-F573 HydrophobicContact CD1-CG 4.07Å
555	G	74.8	Confident	74.8	Confident	19 Å²	19	53.5 Å²	53.5	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-43.8	-178.6	0	0	0	0	0	113.1	L497 T551 S558 A559	L497-G555 WeakPolarHBondContact CD1-O 3.22Å; T551-G555 PolarHBondContact O-N 2.9Å; G555-S558 PolarHBondContact O-N 2.65Å; G555-A559 VanDerWaalsContact O-CB 3.31Å; G555-A559 WeakPolarHBondContact O-CB 3.31Å; G555-A559 PolarHBondContact O-N 3.18Å
556	L	77.5	Confident	75.2	Confident	39 Å²	39	54.6 Å²	54.6	20%	0.204	33%	0.33	C	S	.	.	H	α-helix	trans	-66.8	-41	177.4	-74.2	167.9	0	0	0	111.6	F494 L497 L501 V552 I554 S558 A559 V560	F494-L556 HydrophobicContact CD1-CD2 4.29Å; F494-L556 HydrophobicContact CE1-CD2 4.44Å; L497-L556 HydrophobicContact CB-CD2 3.96Å; L497-L556 HydrophobicContact CB-CG 4.17Å; L497-L556 HydrophobicContact CD1-CD2 4.27Å; L497-L556 HydrophobicContact CD1-CG 4.34Å; L501-L556 HydrophobicContact CD2-CD1 4.26Å; V552-L556 HydrophobicContact CG1-CD1 3.72Å; V552-L556 HydrophobicContact CG1-CG 4.45Å; V552-L556 WeakPolarHBondContact O-CB 3.4Å; V552-L556 VanDerWaalsContact O-CG 3.32Å; V552-L556 WeakPolarHBondContact O-CG 3.48Å; V552-L556 PolarHBondContact O-N 2.88Å; I554-L556 PolarHBondContact O-N 3.02Å; L556-S558 VanDerWaalsContact C-N 3.34Å; L556-S558 PolarHBondContact O-N 2.89Å; L556-A559 PolarHBondContact O-N 2.68Å; L556-V560 WeakPolarHBondContact O-CG2 3.32Å; L556-V560 PolarHBondContact O-N 3.2Å
557	S	79.2	Confident	75.4	Confident	12 Å²	12	53.5 Å²	53.5	8%	0.084	32%	0.321	C	S	.	.	H	α-helix	trans	-60.9	-43.9	177.5	76.6	0	0	0	0	112.1	V553 I554 V560 G561 Q562 L564	V553-S557 WeakPolarHBondContact O-CB 3.36Å; V553-S557 PolarHBondContact O-N 3.43Å; V553-S557 PolarHBondContact O-OG 3.24Å; I554-S557 PolarHBondContact O-N 3.27Å; I554-S557 PolarHBondContact O-OG 3.28Å; S557-V560 PolarHBondContact O-N 3.44Å; S557-G561 PolarHBondContact O-N 3.05Å; S557-Q562 CarbonylContact C-O 3.6Å; S557-Q562 VanDerWaalsContact CB-O 3.29Å; S557-Q562 WeakPolarHBondContact CB-O 3.5Å; S557-Q562 CarbonylContact O-C 3.43Å; S557-Q562 PolarHBondContact O-N 2.91Å; S557-Q562 VanDerWaalsContact O-O 3.1Å; S557-L564 PolarHBondContact OG-N 3.14Å
558	S	74.3	Confident	75.4	Confident	60 Å²	60	55.6 Å²	55.6	42%	0.42	34%	0.335	S	S	.	.	H	α-helix	trans	-66.3	-38.6	175.4	-58.8	0	0	0	0	112.1	I554 G555 L556 G561	I554-S558 PolarHBondContact O-N 3.35Å; I554-S558 PolarHBondContact O-OG 3.45Å; G555-S558 PolarHBondContact O-N 2.65Å; L556-S558 VanDerWaalsContact C-N 3.34Å; L556-S558 PolarHBondContact O-N 2.89Å; S558-G561 PolarHBondContact O-N 3.2Å; S558-G561 VanDerWaalsContact O-N 3.16Å
559	A	71.9	Confident	75.6	Confident	21 Å²	21	57.4 Å²	57.4	17%	0.174	35%	0.348	C	S	.	.	H	α-helix	trans	-69.9	-31.4	-179.8	0	0	0	0	0	113.2	F494 G555 L556 G561	F494-A559 HydrophobicContact CD1-CB 4.16Å; F494-A559 HydrophobicContact CE1-CB 3.55Å; F494-A559 HydrophobicContact CE2-CB 3.98Å; F494-A559 HydrophobicContact CZ-CB 3.45Å; F494-A559 VanDerWaalsContact CZ-CB 3.45Å; F494-A559 WeakPolarHBondContact CZ-O 3.35Å; G555-A559 VanDerWaalsContact O-CB 3.31Å; G555-A559 WeakPolarHBondContact O-CB 3.31Å; G555-A559 PolarHBondContact O-N 3.18Å; L556-A559 PolarHBondContact O-N 2.68Å; A559-G561 PolarHBondContact O-N 3.06Å
560	V	77.1	Confident	75.7	Confident	105 Å²	105	55.7 Å²	55.7	64%	0.636	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-7.8	173.8	176	0	0	0	0	112.1	F494 L556 S557	F494-V560 HydrophobicContact CE1-CG2 4.47Å; L556-V560 WeakPolarHBondContact O-CG2 3.32Å; L556-V560 PolarHBondContact O-N 3.2Å; S557-V560 PolarHBondContact O-N 3.44Å
561	G	74.8	Confident	75.8	Confident	60 Å²	60	54.5 Å²	54.5	62%	0.619	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	12.6	-178.5	0	0	0	0	0	114.1	S557 S558 A559	S557-G561 PolarHBondContact O-N 3.05Å; S558-G561 PolarHBondContact O-N 3.2Å; S558-G561 VanDerWaalsContact O-N 3.16Å; A559-G561 PolarHBondContact O-N 3.06Å
562	Q	78.4	Confident	76	Confident	148 Å²	148	56.7 Å²	56.7	69%	0.692	34%	0.336	S	S	*	.			trans	-124.4	77	176	-67.7	-162	-14.9	0	0	110	S557 L564	S557-Q562 CarbonylContact C-O 3.6Å; S557-Q562 VanDerWaalsContact CB-O 3.29Å; S557-Q562 WeakPolarHBondContact CB-O 3.5Å; S557-Q562 CarbonylContact O-C 3.43Å; S557-Q562 PolarHBondContact O-N 2.91Å; S557-Q562 VanDerWaalsContact O-O 3.1Å; Q562-L564 PolarHBondContact O-N 3.11Å
563	P	74.2	Confident	75.9	Confident	82 Å²	82	60.5 Å²	60.5	53%	0.532	35%	0.352	S	S	.	.			trans	-61.9	121.7	-178.7	26.4	-33.5	0	0	0	110.5	L565	P563-L565 VanDerWaalsContact C-N 3.27Å; P563-L565 PolarHBondContact O-N 2.97Å
564	L	75.4	Confident	75.7	Confident	123 Å²	123	58.6 Å²	58.6	64%	0.644	34%	0.339	S	S	*	.	S	Bend	trans	-71.4	-24	179.3	-74.4	169.9	0	0	0	113	V553 S557 Q562	V553-L564 HydrophobicContact CG1-CD1 3.57Å; S557-L564 PolarHBondContact OG-N 3.14Å; Q562-L564 PolarHBondContact O-N 3.11Å
565	L	75.1	Confident	75.5	Confident	63 Å²	63	58.6 Å²	58.6	33%	0.33	34%	0.339	S	S	.	.	S	Bend	trans	-130.6	145.9	-176.5	-70.1	176.4	0	0	0	109.4	I554 P563 T569 C570 F573	I554-L565 HydrophobicContact CD1-CD1 3.88Å; I554-L565 HydrophobicContact CG1-CD1 3.96Å; P563-L565 VanDerWaalsContact C-N 3.27Å; P563-L565 PolarHBondContact O-N 2.97Å; L565-T569 HydrophobicContact CB-CG2 4.5Å; L565-T569 HydrophobicContact CD1-CG2 4.06Å; L565-T569 HydrophobicContact CD2-CG2 4.17Å; L565-T569 HydrophobicContact CG-CG2 4.49Å; L565-C570 PolarHBondContact O-SG 2.81Å; L565-F573 HydrophobicContact CD1-CD2 3.97Å; L565-F573 HydrophobicContact CD1-CE2 3.89Å
566	D	79	Confident	75.6	Confident	103 Å²	103	59.6 Å²	59.6	55%	0.551	34%	0.34	S	S	*	.			trans	-61	148.2	171.1	-175.6	34.8	0	0	0	110.7	S568 T569 C570	D566-S568 PolarHBondContact O-N 3.22Å; D566-S568 VanDerWaalsContact O-N 3.11Å; D566-S568 PolarHBondContact OD2-OG 2.94Å; D566-S568 VanDerWaalsContact OD2-OG 3.12Å; D566-T569 WeakPolarHBondContact O-CA 3.4Å; D566-T569 WeakPolarHBondContact O-CB 3.47Å; D566-T569 PolarHBondContact O-N 3.14Å; D566-C570 PolarHBondContact O-N 2.77Å; D566-C570 PolarHBondContact O-SG 3.16Å
567	I	74.6	Confident	75.4	Confident	71 Å²	71	58.2 Å²	58.2	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-56.5	-35.5	-172.8	-58.4	173.8	0	0	0	110.8	D297 A298 L299 T569 C570 K571	D297-I567 HydrophobicContact CB-CD1 4.32Å; D297-I567 HydrophobicContact CB-CG2 4.2Å; A298-I567 HydrophobicContact CB-CG2 4.21Å; L299-I567 HydrophobicContact CD1-CG2 4.03Å; L299-I567 HydrophobicContact CG-CG2 3.96Å; I567-T569 PolarHBondContact O-N 2.8Å; I567-C570 WeakPolarHBondContact O-CB 3.42Å; I567-C570 PolarHBondContact O-N 2.93Å; I567-K571 PolarHBondContact O-N 3.25Å
568	S	73.4	Confident	75	Confident	50 Å²	50	58.9 Å²	58.9	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-53	-50.1	172.2	-51.1	0	0	0	0	112.6	D566 K571 Y572	D566-S568 PolarHBondContact O-N 3.22Å; D566-S568 VanDerWaalsContact O-N 3.11Å; D566-S568 PolarHBondContact OD2-OG 2.94Å; D566-S568 VanDerWaalsContact OD2-OG 3.12Å; S568-K571 PolarHBondContact O-N 2.88Å; S568-Y572 WeakPolarHBondContact O-CD2 3.29Å; S568-Y572 WeakPolarHBondContact O-CE2 3.38Å; S568-Y572 PolarHBondContact O-N 2.94Å
569	T	75.7	Confident	75	Confident	56 Å²	56	56 Å²	56	34%	0.344	32%	0.315	S	S	.	.	H	α-helix	trans	-70.5	-40.8	-178.8	-54.3	0	0	0	0	110.6	L565 D566 I567 K571 Y572 F573	L565-T569 HydrophobicContact CB-CG2 4.5Å; L565-T569 HydrophobicContact CD1-CG2 4.06Å; L565-T569 HydrophobicContact CD2-CG2 4.17Å; L565-T569 HydrophobicContact CG-CG2 4.49Å; D566-T569 WeakPolarHBondContact O-CA 3.4Å; D566-T569 WeakPolarHBondContact O-CB 3.47Å; D566-T569 PolarHBondContact O-N 3.14Å; I567-T569 PolarHBondContact O-N 2.8Å; T569-K571 VanDerWaalsContact C-N 3.3Å; T569-K571 PolarHBondContact O-N 3.01Å; T569-Y572 PolarHBondContact O-N 3.34Å; T569-Y572 VanDerWaalsContact O-N 3.17Å; T569-F573 HydrophobicContact CG2-CD2 3.77Å; T569-F573 HydrophobicContact CG2-CE2 3.55Å; T569-F573 VanDerWaalsContact O-CD2 3.3Å; T569-F573 WeakPolarHBondContact O-CD2 3.43Å; T569-F573 PolarHBondContact O-N 2.99Å; T569-F573 VanDerWaalsContact O-N 3.1Å
570	C	74.6	Confident	75.3	Confident	10 Å²	10	58.4 Å²	58.4	7%	0.068	33%	0.325	C	S	.	.	H	α-helix	trans	-55.9	-43.1	176.3	-66.1	0	0	0	0	112.4	I554 L565 D566 I567 Y572 F573 L574	I554-C570 HydrophobicContact CG2-CB 3.96Å; I554-C570 WeakPolarHBondContact CG2-SG 3.23Å; L565-C570 PolarHBondContact O-SG 2.81Å; D566-C570 PolarHBondContact O-N 2.77Å; D566-C570 PolarHBondContact O-SG 3.16Å; I567-C570 WeakPolarHBondContact O-CB 3.42Å; I567-C570 PolarHBondContact O-N 2.93Å; C570-Y572 PolarHBondContact O-N 3.29Å; C570-F573 PolarHBondContact O-N 3.12Å; C570-L574 WeakPolarHBondContact O-CG 3.46Å; C570-L574 PolarHBondContact O-N 2.98Å
571	K	77.9	Confident	75.4	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-58.4	-48.6	175.9	168.8	170.5	171.8	-175.2	0	112.3	A298 L299 M305 I567 S568 T569 F573 L574 V575	A298-K571 HydrophobicContact CB-CB 4.19Å; A298-K571 HydrophobicContact CB-CD 4.04Å; A298-K571 WeakPolarHBondContact O-CD 3.42Å; A298-K571 WeakPolarHBondContact O-CE 3.06Å; A298-K571 PolarHBondContact O-NZ 3.16Å; L299-K571 HydrophobicContact CD2-CB 4.11Å; M305-K571 WeakPolarHBondContact O-CE 3.47Å; M305-K571 PolarHBondContact O-NZ 3.02Å; I567-K571 PolarHBondContact O-N 3.25Å; S568-K571 PolarHBondContact O-N 2.88Å; T569-K571 VanDerWaalsContact C-N 3.3Å; T569-K571 PolarHBondContact O-N 3.01Å; K571-F573 VanDerWaalsContact C-N 3.3Å; K571-F573 PolarHBondContact O-N 2.82Å; K571-L574 PolarHBondContact O-N 2.94Å; K571-V575 HydrophobicContact CG-CG2 4.19Å; K571-V575 WeakPolarHBondContact O-CB 3.29Å; K571-V575 VanDerWaalsContact O-CG2 3.29Å; K571-V575 WeakPolarHBondContact O-CG2 3.23Å; K571-V575 PolarHBondContact O-N 3.19Å
572	Y	77.2	Confident	75.7	Confident	73 Å²	73	50.7 Å²	50.7	29%	0.286	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-40.9	-180	-65	-65.7	0	0	0	111.2	H308 V311 S568 T569 C570 V575 L576	H308-Y572 AromaticContact CD2-CE1 3.75Å; H308-Y572 AromaticContact CD2-CZ 3.57Å; H308-Y572 PolarHBondContact CD2-OH 3.46Å; H308-Y572 PolarHBondContact NE2-OH 3.4Å; H308-Y572 VanDerWaalsContact NE2-OH 3.11Å; V311-Y572 HydrophobicContact CG2-CD1 3.63Å; V311-Y572 HydrophobicContact CG2-CE1 3.68Å; S568-Y572 WeakPolarHBondContact O-CD2 3.29Å; S568-Y572 WeakPolarHBondContact O-CE2 3.38Å; S568-Y572 PolarHBondContact O-N 2.94Å; T569-Y572 PolarHBondContact O-N 3.34Å; T569-Y572 VanDerWaalsContact O-N 3.17Å; C570-Y572 PolarHBondContact O-N 3.29Å; Y572-V575 PolarHBondContact O-N 2.94Å; Y572-L576 WeakPolarHBondContact O-CB 3.17Å; Y572-L576 WeakPolarHBondContact O-CG 3.45Å; Y572-L576 PolarHBondContact O-N 3.26Å
573	F	74.2	Confident	76	Confident	86 Å²	86	44.5 Å²	44.5	38%	0.377	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-46.1	175.1	-82.9	-72.4	0	0	0	112.3	P550 I554 L565 T569 C570 K571 V575 A577	P550-F573 HydrophobicContact CB-CD1 3.96Å; P550-F573 HydrophobicContact CB-CG 4.47Å; P550-F573 HydrophobicContact CG-CD1 4.37Å; I554-F573 HydrophobicContact CD1-CB 3.77Å; I554-F573 HydrophobicContact CD1-CD2 4.15Å; I554-F573 HydrophobicContact CD1-CG 4.07Å; L565-F573 HydrophobicContact CD1-CD2 3.97Å; L565-F573 HydrophobicContact CD1-CE2 3.89Å; T569-F573 HydrophobicContact CG2-CD2 3.77Å; T569-F573 HydrophobicContact CG2-CE2 3.55Å; T569-F573 VanDerWaalsContact O-CD2 3.3Å; T569-F573 WeakPolarHBondContact O-CD2 3.43Å; T569-F573 PolarHBondContact O-N 2.99Å; T569-F573 VanDerWaalsContact O-N 3.1Å; C570-F573 PolarHBondContact O-N 3.12Å; K571-F573 VanDerWaalsContact C-N 3.3Å; K571-F573 PolarHBondContact O-N 2.82Å; F573-V575 PolarHBondContact O-N 3.24Å; F573-A577 WeakPolarHBondContact O-CA 3.5Å; F573-A577 WeakPolarHBondContact O-CB 3.47Å; F573-A577 PolarHBondContact O-N 2.7Å
574	L	73.3	Confident	76.4	Confident	29 Å²	29	41.7 Å²	41.7	15%	0.152	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-42.5	178	-71	171.2	0	0	0	112	L480 T551 C570 K571 Y578	L480-L574 HydrophobicContact CD1-CD1 4.41Å; L480-L574 HydrophobicContact CD1-CD2 4.45Å; T551-L574 HydrophobicContact CG2-CD2 3.85Å; C570-L574 WeakPolarHBondContact O-CG 3.46Å; C570-L574 PolarHBondContact O-N 2.98Å; K571-L574 PolarHBondContact O-N 2.94Å; L574-Y578 WeakPolarHBondContact O-CB 3.49Å
575	V	73.8	Confident	76.6	Confident	12 Å²	12	35.9 Å²	35.9	7%	0.073	19%	0.191	C	C	.	.	H	α-helix	trans	-78	-31.7	-177.3	178.2	0	0	0	0	112.5	V311 M315 V478 K571 Y572 F573 P579	V311-V575 HydrophobicContact CG1-CB 4.42Å; V311-V575 HydrophobicContact CG1-CG1 3.51Å; M315-V575 HydrophobicContact CG-CG1 4.01Å; M315-V575 HydrophobicContact SD-CG1 3.94Å; V478-V575 HydrophobicContact CG1-CG2 4.03Å; K571-V575 HydrophobicContact CG-CG2 4.19Å; K571-V575 WeakPolarHBondContact O-CB 3.29Å; K571-V575 VanDerWaalsContact O-CG2 3.29Å; K571-V575 WeakPolarHBondContact O-CG2 3.23Å; K571-V575 PolarHBondContact O-N 3.19Å; Y572-V575 PolarHBondContact O-N 2.94Å; F573-V575 PolarHBondContact O-N 3.24Å; V575-P579 WeakPolarHBondContact O-CD 3.31Å; V575-P579 WeakPolarHBondContact O-CG 3.36Å
576	L	76.8	Confident	76.6	Confident	41 Å²	41	33.2 Å²	33.2	22%	0.215	18%	0.178	C	C	.	.	H	α-helix	trans	-95.6	-35.8	-176.3	-62.7	176.3	0	0	0	113.8	F310 V311 F314 Y572 P579 I580	F310-L576 HydrophobicContact CE1-CD1 4.45Å; V311-L576 HydrophobicContact CG2-CD2 4.5Å; F314-L576 HydrophobicContact CB-CD2 4.14Å; F314-L576 HydrophobicContact CD1-CD2 3.36Å; F314-L576 HydrophobicContact CE1-CB 4.48Å; F314-L576 HydrophobicContact CE1-CD2 3.82Å; F314-L576 HydrophobicContact CG-CD2 3.76Å; Y572-L576 WeakPolarHBondContact O-CB 3.17Å; Y572-L576 WeakPolarHBondContact O-CG 3.45Å; Y572-L576 PolarHBondContact O-N 3.26Å; L576-P579 WeakPolarHBondContact O-CD 3.45Å; L576-I580 VanDerWaalsContact O-CD1 3.24Å; L576-I580 WeakPolarHBondContact O-CD1 3.38Å; L576-I580 VanDerWaalsContact O-CG1 3.24Å; L576-I580 WeakPolarHBondContact O-CG1 3.27Å
577	A	73	Confident	76.2	Confident	10 Å²	10	33.1 Å²	33.1	8%	0.083	17%	0.173	C	C	.	.	H	α-helix	trans	-77.9	-37.2	-178.7	0	0	0	0	0	111.7	F573 I580	F573-A577 WeakPolarHBondContact O-CA 3.5Å; F573-A577 WeakPolarHBondContact O-CB 3.47Å; F573-A577 PolarHBondContact O-N 2.7Å; A577-I580 PolarHBondContact O-N 2.84Å
578	Y	70.4	Confident	76	Confident	25 Å²	25	32 Å²	32	10%	0.098	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-34	-177.8	-165.4	-90.4	0	0	0	114.3	T360 Y363 A398 S401 S402 L574 N581	T360-Y578 HydrophobicContact CG2-CD1 3.94Å; T360-Y578 HydrophobicContact CG2-CE1 3.58Å; Y363-Y578 HydrophobicContact CD1-CD1 4.18Å; Y363-Y578 AromaticContact CD1-CE1 3.86Å; Y363-Y578 HydrophobicContact CD1-CE1 3.86Å; Y363-Y578 HydrophobicContact CE1-CD1 4.03Å; Y363-Y578 HydrophobicContact CE1-CE1 4Å; A398-Y578 PolarHBondContact O-OH 2.71Å; S401-Y578 PolarHBondContact OG-OH 3.35Å; S401-Y578 VanDerWaalsContact OG-OH 3.09Å; S402-Y578 WeakPolarHBondContact CB-OH 3.21Å; L574-Y578 WeakPolarHBondContact O-CB 3.49Å; Y578-N581 PolarHBondContact O-OD1 2.64Å
579	P	73.9	Confident	75.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-80.4	-21.1	175.7	-22.6	36.8	0	0	0	115.9	F314 A318 L364 V575 L576 N581 A582 T583	F314-P579 HydrophobicContact CE1-CB 3.93Å; F314-P579 HydrophobicContact CE1-CG 3.9Å; F314-P579 HydrophobicContact CZ-CB 4.35Å; A318-P579 HydrophobicContact CB-CB 3.63Å; A318-P579 HydrophobicContact CB-CG 4.44Å; L364-P579 HydrophobicContact CD1-CB 3.44Å; L364-P579 VanDerWaalsContact CD1-CB 3.44Å; L364-P579 HydrophobicContact CD1-CG 3.55Å; L364-P579 HydrophobicContact CD2-CG 3.68Å; L364-P579 HydrophobicContact CG-CG 4.25Å; V575-P579 WeakPolarHBondContact O-CD 3.31Å; V575-P579 WeakPolarHBondContact O-CG 3.36Å; L576-P579 WeakPolarHBondContact O-CD 3.45Å; P579-N581 VanDerWaalsContact C-N 3.31Å; P579-N581 PolarHBondContact O-N 2.92Å; P579-A582 PolarHBondContact O-N 2.97Å; P579-T583 WeakPolarHBondContact O-CB 3.23Å; P579-T583 VanDerWaalsContact O-CG2 3.3Å; P579-T583 WeakPolarHBondContact O-CG2 3.33Å; P579-T583 PolarHBondContact O-N 2.84Å; P579-T583 VanDerWaalsContact O-N 3.11Å; P579-T583 PolarHBondContact O-OG1 2.96Å
580	I	78.7	Confident	74.9	Confident	72 Å²	72	30.4 Å²	30.4	37%	0.369	16%	0.158	S	C	.	.	H	α-helix	trans	-65.7	-38	-170.5	-70.4	168.3	0	0	0	110.6	F314 C547 L576 A577 T583 A584	F314-I580 HydrophobicContact CZ-CG1 3.93Å; C547-I580 VanDerWaalsContact SG-CG2 3.57Å; L576-I580 VanDerWaalsContact O-CD1 3.24Å; L576-I580 WeakPolarHBondContact O-CD1 3.38Å; L576-I580 VanDerWaalsContact O-CG1 3.24Å; L576-I580 WeakPolarHBondContact O-CG1 3.27Å; A577-I580 PolarHBondContact O-N 2.84Å; I580-T583 WeakPolarHBondContact CA-OG1 3.35Å; I580-T583 PolarHBondContact O-OG1 3.38Å; I580-T583 VanDerWaalsContact O-OG1 3.05Å; I580-A584 WeakPolarHBondContact O-CB 3.02Å; I580-A584 PolarHBondContact O-N 2.91Å
581	N	78	Confident	74	Confident	2 Å²	2	37 Å²	37	1%	0.011	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-51.8	178.3	68.4	-22.2	0	0	0	111.9	N544 C547 W548 Y578 P579 T583 A584 D585	N544-N581 VanDerWaalsContact OD1-CB 3.28Å; N544-N581 WeakPolarHBondContact OD1-CB 3.29Å; N544-N581 PolarHBondContact OD1-ND2 2.62Å; C547-N581 HydrophobicContact CB-CB 4.17Å; W548-N581 PolarHBondContact NE1-ND2 3.09Å; Y578-N581 PolarHBondContact O-OD1 2.64Å; P579-N581 VanDerWaalsContact C-N 3.31Å; P579-N581 PolarHBondContact O-N 2.92Å; N581-T583 PolarHBondContact O-N 2.86Å; N581-A584 PolarHBondContact O-N 3.24Å; N581-D585 VanDerWaalsContact O-CG 3.31Å; N581-D585 PolarHBondContact O-N 2.98Å; N581-D585 VanDerWaalsContact O-N 3.14Å
582	A	82.5	Confident	72.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-27.7	-176.7	0	0	0	0	0	113.1	A322 N326 D357 T360 P579 P586	A322-A582 HydrophobicContact CB-CB 4.12Å; N326-A582 PolarHBondContact ND2-O 2.89Å; D357-A582 HydrophobicContact CB-CB 3.75Å; T360-A582 HydrophobicContact CG2-CB 3.59Å; P579-A582 PolarHBondContact O-N 2.97Å; A582-P586 WeakPolarHBondContact O-CD 3.14Å
583	T	85	Confident	71.8	Confident	18 Å²	18	34.8 Å²	34.8	11%	0.11	18%	0.182	C	C	.	.	H	α-helix	trans	-83.9	-35	177.6	52.6	0	0	0	0	113	A318 L321 A322 P579 I580 N581 F587	A318-T583 HydrophobicContact CB-CG2 3.93Å; A318-T583 WeakPolarHBondContact O-CG2 3.22Å; L321-T583 HydrophobicContact CB-CG2 3.98Å; A322-T583 HydrophobicContact CB-CG2 4.01Å; P579-T583 WeakPolarHBondContact O-CB 3.23Å; P579-T583 VanDerWaalsContact O-CG2 3.3Å; P579-T583 WeakPolarHBondContact O-CG2 3.33Å; P579-T583 PolarHBondContact O-N 2.84Å; P579-T583 VanDerWaalsContact O-N 3.11Å; P579-T583 PolarHBondContact O-OG1 2.96Å; I580-T583 WeakPolarHBondContact CA-OG1 3.35Å; I580-T583 PolarHBondContact O-OG1 3.38Å; I580-T583 VanDerWaalsContact O-OG1 3.05Å; N581-T583 PolarHBondContact O-N 2.86Å; T583-F587 WeakPolarHBondContact O-CD2 3.35Å; T583-F587 WeakPolarHBondContact O-CE2 3.26Å
584	A	82	Confident	70.8	Confident	24 Å²	24	34.4 Å²	34.4	20%	0.198	19%	0.19	C	C	.	.	H	α-helix	trans	-75.6	-36.1	-178.5	0	0	0	0	0	112.8	I580 N581 F587 L588	I580-A584 WeakPolarHBondContact O-CB 3.02Å; I580-A584 PolarHBondContact O-N 2.91Å; N581-A584 PolarHBondContact O-N 3.24Å; A584-F587 PolarHBondContact O-N 3.25Å; A584-F587 VanDerWaalsContact O-N 3.08Å; A584-L588 WeakPolarHBondContact O-CG 3.42Å; A584-L588 PolarHBondContact O-N 2.83Å
585	D	78.8	Confident	70.1	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.6	-47	-172.5	-80.1	11.5	0	0	0	113.7	L540 N544 N581 F587 L588 Y589	L540-D585 HydrophobicContact CD1-CB 4.17Å; N544-D585 PolarHBondContact ND2-OD2 2.71Å; N581-D585 VanDerWaalsContact O-CG 3.31Å; N581-D585 PolarHBondContact O-N 2.98Å; N581-D585 VanDerWaalsContact O-N 3.14Å; D585-F587 VanDerWaalsContact C-N 3.32Å; D585-F587 PolarHBondContact O-N 2.88Å; D585-L588 WeakPolarHBondContact O-CB 3.43Å; D585-L588 PolarHBondContact O-N 3.27Å; D585-L588 VanDerWaalsContact O-N 3.09Å; D585-Y589 VanDerWaalsContact C-CD2 3.44Å; D585-Y589 VanDerWaalsContact C-CE2 3.5Å; D585-Y589 HydrophobicContact CB-CE2 3.73Å; D585-Y589 WeakPolarHBondContact O-CD2 3.4Å; D585-Y589 WeakPolarHBondContact O-CE2 3.24Å; D585-Y589 PolarHBondContact O-N 2.97Å
586	P	75.9	Confident	69.2	Low	8 Å²	8	39.1 Å²	39.1	5%	0.052	21%	0.209	C	C	.	.	H	α-helix	trans	-51.5	-44.1	172.2	-30.5	36.4	0	0	0	114.9	N326 V329 A582 Y589 A590	N326-P586 HydrophobicContact CB-CG 4.49Å; N326-P586 WeakPolarHBondContact OD1-CG 3.03Å; V329-P586 HydrophobicContact CG2-CB 4.32Å; A582-P586 WeakPolarHBondContact O-CD 3.14Å; P586-Y589 PolarHBondContact O-N 3.42Å; P586-A590 VanDerWaalsContact O-CB 3.32Å; P586-A590 WeakPolarHBondContact O-CB 3.23Å; P586-A590 PolarHBondContact O-N 3.18Å
587	F	70.2	Confident	68.3	Low	101 Å²	101	38.8 Å²	38.8	44%	0.443	21%	0.209	S	C	.	.	H	α-helix	trans	-68.2	-41.3	179.2	-64.2	-77.3	0	0	0	110.5	L321 T583 A584 D585 Y589 A590 F591	L321-F587 HydrophobicContact CD2-CZ 4.24Å; T583-F587 WeakPolarHBondContact O-CD2 3.35Å; T583-F587 WeakPolarHBondContact O-CE2 3.26Å; A584-F587 PolarHBondContact O-N 3.25Å; A584-F587 VanDerWaalsContact O-N 3.08Å; D585-F587 VanDerWaalsContact C-N 3.32Å; D585-F587 PolarHBondContact O-N 2.88Å; F587-Y589 VanDerWaalsContact C-N 3.33Å; F587-Y589 PolarHBondContact O-N 3.32Å; F587-A590 PolarHBondContact O-N 3.1Å; F587-F591 HydrophobicContact CB-CD2 4.32Å; F587-F591 HydrophobicContact CB-CE2 4.38Å; F587-F591 HydrophobicContact CD1-CE2 4.16Å; F587-F591 WeakPolarHBondContact O-CD2 3.33Å; F587-F591 PolarHBondContact O-N 3.41Å
588	L	70.1	Confident	67.8	Low	47 Å²	47	44.2 Å²	44.2	25%	0.246	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-40.8	175.4	-65.1	178.2	0	0	0	111.3	L540 T543 A584 D585 S592	L540-L588 HydrophobicContact CB-CD1 3.83Å; L540-L588 HydrophobicContact CD1-CB 4.19Å; L540-L588 HydrophobicContact CD1-CD1 4.31Å; L540-L588 HydrophobicContact CG-CD1 4.27Å; T543-L588 HydrophobicContact CG2-CD1 4.15Å; A584-L588 WeakPolarHBondContact O-CG 3.42Å; A584-L588 PolarHBondContact O-N 2.83Å; D585-L588 WeakPolarHBondContact O-CB 3.43Å; D585-L588 PolarHBondContact O-N 3.27Å; D585-L588 VanDerWaalsContact O-N 3.09Å; L588-S592 WeakPolarHBondContact O-CB 3.49Å; L588-S592 PolarHBondContact O-N 2.94Å; L588-S592 VanDerWaalsContact O-N 3.14Å
589	Y	65.5	Low	67.5	Low	23 Å²	23	45.9 Å²	45.9	9%	0.09	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-46.7	174	-57.3	-50.6	0	0	0	112.5	V329 V350 L353 L540 D585 P586 F587 S592	V329-Y589 HydrophobicContact CG1-CD2 4.17Å; V329-Y589 HydrophobicContact CG2-CD2 3.89Å; V350-Y589 HydrophobicContact CB-CD1 4.49Å; V350-Y589 HydrophobicContact CB-CE1 4.2Å; V350-Y589 HydrophobicContact CG1-CD1 3.55Å; V350-Y589 HydrophobicContact CG1-CD2 4.05Å; V350-Y589 HydrophobicContact CG1-CE1 3.49Å; V350-Y589 VanDerWaalsContact CG1-CE1 3.49Å; V350-Y589 HydrophobicContact CG1-CE2 4.03Å; V350-Y589 HydrophobicContact CG1-CG 3.85Å; V350-Y589 HydrophobicContact CG2-CD1 4.08Å; V350-Y589 HydrophobicContact CG2-CE1 3.75Å; L353-Y589 WeakPolarHBondContact CD2-OH 3.18Å; L353-Y589 WeakPolarHBondContact CG-OH 3.49Å; L540-Y589 HydrophobicContact CD1-CD1 4.15Å; L540-Y589 HydrophobicContact CD1-CE1 3.38Å; L540-Y589 HydrophobicContact CD1-CE2 4.44Å; L540-Y589 WeakPolarHBondContact CD1-OH 3.48Å; D585-Y589 VanDerWaalsContact C-CD2 3.44Å; D585-Y589 VanDerWaalsContact C-CE2 3.5Å; D585-Y589 HydrophobicContact CB-CE2 3.73Å; D585-Y589 WeakPolarHBondContact O-CD2 3.4Å; D585-Y589 WeakPolarHBondContact O-CE2 3.24Å; D585-Y589 PolarHBondContact O-N 2.97Å; P586-Y589 PolarHBondContact O-N 3.42Å; F587-Y589 VanDerWaalsContact C-N 3.33Å; F587-Y589 PolarHBondContact O-N 3.32Å; Y589-S592 PolarHBondContact O-N 3.34Å
590	A	61	Low	66.9	Low	49 Å²	49	47.1 Å²	47.1	41%	0.405	25%	0.251	S	S	.	.	H	α-helix	trans	-60.1	-50.8	-178	0	0	0	0	0	110.3	P586 F587 S592 V597	P586-A590 VanDerWaalsContact O-CB 3.32Å; P586-A590 WeakPolarHBondContact O-CB 3.23Å; P586-A590 PolarHBondContact O-N 3.18Å; F587-A590 PolarHBondContact O-N 3.1Å; A590-S592 VanDerWaalsContact C-N 3.3Å; A590-S592 PolarHBondContact O-N 2.91Å; A590-V597 WeakPolarHBondContact O-CG2 3.27Å
591	F	56.4	Low	66.3	Low	149 Å²	149	51.8 Å²	51.8	65%	0.654	26%	0.264	S	S	*	.	H	α-helix	trans	-79.7	-8	-177.6	-66.1	-71	0	0	0	114.3	F587	F587-F591 HydrophobicContact CB-CD2 4.32Å; F587-F591 HydrophobicContact CB-CE2 4.38Å; F587-F591 HydrophobicContact CD1-CE2 4.16Å; F587-F591 WeakPolarHBondContact O-CD2 3.33Å; F587-F591 PolarHBondContact O-N 3.41Å
592	S	51.9	Low	65.8	Low	14 Å²	14	56.7 Å²	56.7	10%	0.098	29%	0.29	C	S	.	.	H	α-helix	trans	-83.5	-35.8	-169	178.2	0	0	0	0	115.5	K536 L588 Y589 A590	K536-S592 WeakPolarHBondContact CB-OG 3.39Å; K536-S592 VanDerWaalsContact CD-CA 3.46Å; K536-S592 WeakPolarHBondContact CD-O 3.15Å; K536-S592 VanDerWaalsContact CD-OG 3.26Å; K536-S592 WeakPolarHBondContact CD-OG 3.35Å; K536-S592 PolarHBondContact NZ-O 3.32Å; L588-S592 WeakPolarHBondContact O-CB 3.49Å; L588-S592 PolarHBondContact O-N 2.94Å; L588-S592 VanDerWaalsContact O-N 3.14Å; Y589-S592 PolarHBondContact O-N 3.34Å; A590-S592 VanDerWaalsContact C-N 3.3Å; A590-S592 PolarHBondContact O-N 2.91Å
593	S	56.2	Low	64.8	Low	20 Å²	20	58 Å²	58	14%	0.14	30%	0.299	C	S	.	.			trans	-106.3	106.9	177.7	176	0	0	0	0	110.6	K595 L596 V597	S593-K595 PolarHBondContact O-N 3.25Å; S593-L596 VanDerWaalsContact CB-CB 3.46Å; S593-L596 PolarHBondContact O-N 3.34Å; S593-L596 WeakPolarHBondContact OG-CB 3.33Å; S593-L596 PolarHBondContact OG-N 2.79Å; S593-V597 WeakPolarHBondContact O-CG2 3.44Å; S593-V597 PolarHBondContact O-N 3.32Å
594	S	52.9	Low	63.9	Low	78 Å²	78	62.7 Å²	62.7	55%	0.545	32%	0.323	S	S	.	.	H	α-helix	trans	-51.6	-38.8	172.2	55	0	0	0	0	111.3	Q598	S594-Q598 WeakPolarHBondContact O-CB 3.48Å; S594-Q598 PolarHBondContact O-N 2.79Å
595	K	58.3	Low	63.4	Low	106 Å²	106	65.5 Å²	65.5	46%	0.461	34%	0.338	S	S	.	.	H	α-helix	trans	-65.8	-42.6	175	-69.1	-173.8	177	162.5	0	112.3	Q529 S593 Q598 Q599	Q529-K595 VanDerWaalsContact NE2-CE 3.28Å; Q529-K595 VanDerWaalsContact OE1-CE 3.24Å; S593-K595 PolarHBondContact O-N 3.25Å; K595-Q598 PolarHBondContact O-N 2.79Å; K595-Q599 VanDerWaalsContact O-CB 3.24Å; K595-Q599 WeakPolarHBondContact O-CB 3.28Å; K595-Q599 WeakPolarHBondContact O-CG 3.34Å; K595-Q599 PolarHBondContact O-N 3.02Å
596	L	55.4	Low	63	Low	34 Å²	34	67.6 Å²	67.6	18%	0.178	36%	0.355	C	S	.	.	H	α-helix	trans	-73.1	-39	-178.9	-146.9	102.5	0	0	0	111.4	L332 F333 L336 S593 Q599 A600	L332-L596 HydrophobicContact CD2-CD2 3.42Å; L332-L596 VanDerWaalsContact CD2-CD2 3.42Å; L332-L596 HydrophobicContact CD2-CG 4.16Å; L332-L596 HydrophobicContact CG-CD2 4.44Å; F333-L596 HydrophobicContact CE1-CD1 4.48Å; L336-L596 HydrophobicContact CD1-CD1 3.98Å; S593-L596 VanDerWaalsContact CB-CB 3.46Å; S593-L596 PolarHBondContact O-N 3.34Å; S593-L596 WeakPolarHBondContact OG-CB 3.33Å; S593-L596 PolarHBondContact OG-N 2.79Å; L596-Q599 PolarHBondContact O-N 2.92Å; L596-A600 VanDerWaalsContact O-CB 3.24Å; L596-A600 WeakPolarHBondContact O-CB 3.17Å; L596-A600 PolarHBondContact O-N 2.78Å
597	V	58.8	Low	62.7	Low	35 Å²	35	71.7 Å²	71.7	21%	0.212	37%	0.374	C	S	.	.	H	α-helix	trans	-60.9	-48.9	170.4	176.4	0	0	0	0	110.5	A590 S593 Q599 A600 R601	A590-V597 WeakPolarHBondContact O-CG2 3.27Å; S593-V597 WeakPolarHBondContact O-CG2 3.44Å; S593-V597 PolarHBondContact O-N 3.32Å; V597-Q599 VanDerWaalsContact C-N 3.27Å; V597-Q599 PolarHBondContact O-N 2.83Å; V597-A600 PolarHBondContact O-N 2.9Å; V597-R601 HydrophobicContact CG1-CG 4.15Å; V597-R601 VanDerWaalsContact O-CB 3.29Å; V597-R601 WeakPolarHBondContact O-CB 3.27Å; V597-R601 VanDerWaalsContact O-CG 3.28Å; V597-R601 WeakPolarHBondContact O-CG 3.43Å; V597-R601 PolarHBondContact O-N 2.95Å
598	Q	62.7	Low	62.9	Low	124 Å²	124	75.9 Å²	75.9	58%	0.579	39%	0.387	S	S	*	.	H	α-helix	trans	-63.2	-39.8	-178.7	-170.6	175.1	12	0	0	110.2	S594 K595 L602	S594-Q598 WeakPolarHBondContact O-CB 3.48Å; S594-Q598 PolarHBondContact O-N 2.79Å; K595-Q598 PolarHBondContact O-N 2.79Å; Q598-L602 HydrophobicContact CG-CD1 4.33Å; Q598-L602 WeakPolarHBondContact O-CB 3.47Å; Q598-L602 WeakPolarHBondContact O-CD1 3.48Å; Q598-L602 WeakPolarHBondContact O-CG 3.07Å; Q598-L602 PolarHBondContact O-N 3.28Å
599	Q	63.2	Low	63.1	Low	60 Å²	60	76.4 Å²	76.4	28%	0.28	40%	0.395	S	S	.	.	H	α-helix	trans	-66.5	-46.2	174.2	-72.8	171.5	13.2	0	0	112	R341 K595 L596 V597 R601 L602 S603	R341-Q599 VanDerWaalsContact NH1-OE1 3.09Å; K595-Q599 VanDerWaalsContact O-CB 3.24Å; K595-Q599 WeakPolarHBondContact O-CB 3.28Å; K595-Q599 WeakPolarHBondContact O-CG 3.34Å; K595-Q599 PolarHBondContact O-N 3.02Å; L596-Q599 PolarHBondContact O-N 2.92Å; V597-Q599 VanDerWaalsContact C-N 3.27Å; V597-Q599 PolarHBondContact O-N 2.83Å; Q599-R601 VanDerWaalsContact C-N 3.34Å; Q599-R601 PolarHBondContact O-N 3.45Å; Q599-L602 PolarHBondContact O-N 2.82Å; Q599-S603 WeakPolarHBondContact O-CB 3.23Å; Q599-S603 PolarHBondContact O-N 2.84Å; Q599-S603 PolarHBondContact O-OG 3.06Å
600	A	62.3	Low	63.4	Low	25 Å²	25	77.9 Å²	77.9	21%	0.207	40%	0.404	C	S	.	.	H	α-helix	trans	-62.6	-40.5	176.7	0	0	0	0	0	111.7	L596 V597 S603 L604	L596-A600 VanDerWaalsContact O-CB 3.24Å; L596-A600 WeakPolarHBondContact O-CB 3.17Å; L596-A600 PolarHBondContact O-N 2.78Å; V597-A600 PolarHBondContact O-N 2.9Å; A600-S603 PolarHBondContact O-N 3.45Å; A600-L604 VanDerWaalsContact O-CB 3.31Å; A600-L604 WeakPolarHBondContact O-CB 3.39Å; A600-L604 WeakPolarHBondContact O-CD1 3.36Å; A600-L604 WeakPolarHBondContact O-CG 3.26Å; A600-L604 PolarHBondContact O-N 3.2Å
601	R	65	Low	64	Low	170 Å²	170	78.9 Å²	78.9	64%	0.642	40%	0.402	S	S	*	.	H	α-helix	trans	-60.9	-49	173.1	-77.8	-179	-178.7	-178.9	1.1	110.9	V597 Q599 S603 L604 T605	V597-R601 HydrophobicContact CG1-CG 4.15Å; V597-R601 VanDerWaalsContact O-CB 3.29Å; V597-R601 WeakPolarHBondContact O-CB 3.27Å; V597-R601 VanDerWaalsContact O-CG 3.28Å; V597-R601 WeakPolarHBondContact O-CG 3.43Å; V597-R601 PolarHBondContact O-N 2.95Å; Q599-R601 VanDerWaalsContact C-N 3.34Å; Q599-R601 PolarHBondContact O-N 3.45Å; R601-S603 VanDerWaalsContact C-N 3.3Å; R601-S603 PolarHBondContact O-N 3.49Å; R601-L604 PolarHBondContact O-N 3.01Å; R601-T605 WeakPolarHBondContact O-CG2 3.48Å; R601-T605 PolarHBondContact O-N 2.91Å; R601-T605 PolarHBondContact O-OG1 3.17Å
602	L	67.2	Low	65	Low	106 Å²	106	74.9 Å²	74.9	56%	0.555	39%	0.39	S	S	*	.	H	α-helix	trans	-58.9	-42.4	176.7	-74.3	166.7	0	0	0	111.4	Q598 Q599 T605 A606	Q598-L602 HydrophobicContact CG-CD1 4.33Å; Q598-L602 WeakPolarHBondContact O-CB 3.47Å; Q598-L602 WeakPolarHBondContact O-CD1 3.48Å; Q598-L602 WeakPolarHBondContact O-CG 3.07Å; Q598-L602 PolarHBondContact O-N 3.28Å; Q599-L602 PolarHBondContact O-N 2.82Å; L602-T605 VanDerWaalsContact C-OG1 3.28Å; L602-T605 VanDerWaalsContact CA-OG1 3.24Å; L602-T605 WeakPolarHBondContact CA-OG1 3.21Å; L602-T605 PolarHBondContact O-N 3.18Å; L602-T605 PolarHBondContact O-OG1 3.28Å; L602-A606 VanDerWaalsContact O-CB 3.31Å; L602-A606 WeakPolarHBondContact O-CB 3.46Å; L602-A606 PolarHBondContact O-N 3.31Å
603	S	62.5	Low	66.2	Low	26 Å²	26	77.6 Å²	77.6	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-67	-43.1	176.6	-56.9	0	0	0	0	112.5	W335 Q599 A600 R601 T605 A606 M607	W335-S603 WeakPolarHBondContact CH2-OG 3.44Å; W335-S603 WeakPolarHBondContact CZ3-OG 3.3Å; Q599-S603 WeakPolarHBondContact O-CB 3.23Å; Q599-S603 PolarHBondContact O-N 2.84Å; Q599-S603 PolarHBondContact O-OG 3.06Å; A600-S603 PolarHBondContact O-N 3.45Å; R601-S603 VanDerWaalsContact C-N 3.3Å; R601-S603 PolarHBondContact O-N 3.49Å; S603-T605 VanDerWaalsContact C-N 3.33Å; S603-A606 PolarHBondContact O-N 2.83Å; S603-M607 VanDerWaalsContact O-CB 3.29Å; S603-M607 WeakPolarHBondContact O-CB 3.47Å; S603-M607 PolarHBondContact O-N 3.36Å
604	L	66.1	Low	67	Low	117 Å²	117	77.6 Å²	77.6	61%	0.613	40%	0.401	S	S	*	.	H	α-helix	trans	-63.5	-40.3	175.3	-82.3	159.1	0	0	0	111	A600 R601 R608	A600-L604 VanDerWaalsContact O-CB 3.31Å; A600-L604 WeakPolarHBondContact O-CB 3.39Å; A600-L604 WeakPolarHBondContact O-CD1 3.36Å; A600-L604 WeakPolarHBondContact O-CG 3.26Å; A600-L604 PolarHBondContact O-N 3.2Å; R601-L604 PolarHBondContact O-N 3.01Å; L604-R608 WeakPolarHBondContact O-CB 3.33Å; L604-R608 PolarHBondContact O-N 2.71Å
605	T	71.3	Confident	68	Low	84 Å²	84	80 Å²	80	52%	0.515	40%	0.402	S	S	.	.	H	α-helix	trans	-66.4	-40.7	174.3	47.9	0	0	0	0	111.8	R601 L602 S603 R608 S609	R601-T605 WeakPolarHBondContact O-CG2 3.48Å; R601-T605 PolarHBondContact O-N 2.91Å; R601-T605 PolarHBondContact O-OG1 3.17Å; L602-T605 VanDerWaalsContact C-OG1 3.28Å; L602-T605 VanDerWaalsContact CA-OG1 3.24Å; L602-T605 WeakPolarHBondContact CA-OG1 3.21Å; L602-T605 PolarHBondContact O-N 3.18Å; L602-T605 PolarHBondContact O-OG1 3.28Å; S603-T605 VanDerWaalsContact C-N 3.33Å; T605-R608 PolarHBondContact O-N 2.94Å; T605-S609 WeakPolarHBondContact O-CB 3.19Å; T605-S609 PolarHBondContact O-N 3.04Å; T605-S609 PolarHBondContact O-OG 3.36Å
606	A	70.5	Confident	69	Low	43 Å²	43	80.3 Å²	80.3	36%	0.355	41%	0.405	S	S	.	.	H	α-helix	trans	-67.8	-40	176.7	0	0	0	0	0	112	L602 S603 S609 N610	L602-A606 VanDerWaalsContact O-CB 3.31Å; L602-A606 WeakPolarHBondContact O-CB 3.46Å; L602-A606 PolarHBondContact O-N 3.31Å; S603-A606 PolarHBondContact O-N 2.83Å; A606-S609 WeakPolarHBondContact CA-OG 3.29Å; A606-S609 PolarHBondContact O-N 3.47Å; A606-S609 PolarHBondContact O-OG 2.92Å; A606-N610 VanDerWaalsContact O-CB 3.25Å; A606-N610 WeakPolarHBondContact O-CB 3.28Å; A606-N610 PolarHBondContact O-N 3.25Å; A606-N610 PolarHBondContact O-ND2 3.41Å
607	M	69.5	Low	69.8	Low	94 Å²	94	85.6 Å²	85.6	46%	0.463	42%	0.423	S	S	.	.	H	α-helix	trans	-67.6	-42.3	175.7	-166.1	-173.1	-67.1	0	0	110.5	S603 N610 L611	S603-M607 VanDerWaalsContact O-CB 3.29Å; S603-M607 WeakPolarHBondContact O-CB 3.47Å; S603-M607 PolarHBondContact O-N 3.36Å; M607-N610 PolarHBondContact O-N 3.29Å; M607-L611 VanDerWaalsContact O-CB 3.22Å; M607-L611 WeakPolarHBondContact O-CB 3.42Å; M607-L611 PolarHBondContact O-N 3.17Å
608	R	74.8	Confident	70.4	Confident	190 Å²	190	86.9 Å²	86.9	72%	0.717	43%	0.431	S	S	*	.	H	α-helix	trans	-62	-45.1	174.6	-177.7	176.9	174.7	162.1	-1.1	111.5	L604 T605 L611 V612	L604-R608 WeakPolarHBondContact O-CB 3.33Å; L604-R608 PolarHBondContact O-N 2.71Å; T605-R608 PolarHBondContact O-N 2.94Å; R608-L611 PolarHBondContact O-N 3.02Å; R608-V612 WeakPolarHBondContact O-CB 3.39Å; R608-V612 VanDerWaalsContact O-CG2 3.24Å; R608-V612 WeakPolarHBondContact O-CG2 3.26Å; R608-V612 PolarHBondContact O-N 2.99Å
609	S	73	Confident	70.9	Confident	57 Å²	57	90.8 Å²	90.8	40%	0.399	44%	0.44	S	S	.	.	H	α-helix	trans	-63.7	-45	176.4	62.9	0	0	0	0	111.1	T605 A606 L611 V612 D613	T605-S609 WeakPolarHBondContact O-CB 3.19Å; T605-S609 PolarHBondContact O-N 3.04Å; T605-S609 PolarHBondContact O-OG 3.36Å; A606-S609 WeakPolarHBondContact CA-OG 3.29Å; A606-S609 PolarHBondContact O-N 3.47Å; A606-S609 PolarHBondContact O-OG 2.92Å; S609-L611 VanDerWaalsContact C-N 3.3Å; S609-L611 PolarHBondContact O-N 3.29Å; S609-V612 PolarHBondContact O-N 2.78Å; S609-D613 WeakPolarHBondContact O-CB 3.3Å; S609-D613 PolarHBondContact O-N 3.04Å
610	N	72.8	Confident	71.2	Confident	55 Å²	55	94.2 Å²	94.2	29%	0.294	46%	0.456	S	S	.	.	H	α-helix	trans	-63.6	-34.3	177.3	-71.8	-15.8	0	0	0	112.9	A606 M607 H614 W643	A606-N610 VanDerWaalsContact O-CB 3.25Å; A606-N610 WeakPolarHBondContact O-CB 3.28Å; A606-N610 PolarHBondContact O-N 3.25Å; A606-N610 PolarHBondContact O-ND2 3.41Å; M607-N610 PolarHBondContact O-N 3.29Å; N610-H614 WeakPolarHBondContact O-CB 3.46Å; N610-H614 PolarHBondContact O-N 3.22Å; N610-W643 PolarHBondContact O-NE1 2.7Å; N610-W643 VanDerWaalsContact O-NE1 3.09Å
611	L	73.7	Confident	71.4	Confident	69 Å²	69	94.3 Å²	94.3	36%	0.361	46%	0.455	S	S	.	.	H	α-helix	trans	-71.7	-44.2	176.3	-162.6	105.4	0	0	0	110.7	M607 R608 S609 H614 F615 W643	M607-L611 VanDerWaalsContact O-CB 3.22Å; M607-L611 WeakPolarHBondContact O-CB 3.42Å; M607-L611 PolarHBondContact O-N 3.17Å; R608-L611 PolarHBondContact O-N 3.02Å; S609-L611 VanDerWaalsContact C-N 3.3Å; S609-L611 PolarHBondContact O-N 3.29Å; L611-H614 PolarHBondContact O-N 3.46Å; L611-F615 HydrophobicContact CD1-CE2 4.4Å; L611-F615 HydrophobicContact CD2-CD2 4.03Å; L611-F615 HydrophobicContact CD2-CE2 3.68Å; L611-F615 HydrophobicContact CG-CD2 3.94Å; L611-F615 HydrophobicContact CG-CE2 3.73Å; L611-F615 WeakPolarHBondContact O-CD2 3.41Å; L611-F615 PolarHBondContact O-N 2.81Å; L611-W643 HydrophobicContact CB-CZ2 4.13Å; L611-W643 HydrophobicContact CD1-CH2 3.49Å; L611-W643 VanDerWaalsContact CD1-CH2 3.49Å; L611-W643 HydrophobicContact CD1-CZ2 3.7Å; L611-W643 HydrophobicContact CD1-CZ3 4.4Å; L611-W643 HydrophobicContact CG-CZ2 4.39Å
612	V	77.5	Confident	71.3	Confident	66 Å²	66	90.3 Å²	90.3	40%	0.4	45%	0.453	S	S	.	.	H	α-helix	trans	-60.3	-46.9	174.4	170.5	0	0	0	0	110.6	R608 S609 H614 F615 Q616	R608-V612 WeakPolarHBondContact O-CB 3.39Å; R608-V612 VanDerWaalsContact O-CG2 3.24Å; R608-V612 WeakPolarHBondContact O-CG2 3.26Å; R608-V612 PolarHBondContact O-N 2.99Å; S609-V612 PolarHBondContact O-N 2.78Å; V612-H614 VanDerWaalsContact C-N 3.29Å; V612-H614 PolarHBondContact O-N 2.91Å; V612-F615 PolarHBondContact O-N 2.83Å; V612-Q616 HydrophobicContact CG1-CG 4.42Å; V612-Q616 WeakPolarHBondContact O-CB 3.07Å; V612-Q616 WeakPolarHBondContact O-CG 3.48Å; V612-Q616 PolarHBondContact O-N 3.31Å
613	D	75.6	Confident	71	Confident	71 Å²	71	94.4 Å²	94.4	38%	0.38	46%	0.462	S	S	.	.	H	α-helix	trans	-60.9	-36.4	175.4	-85.8	15	0	0	0	112.5	S609 R617	S609-D613 WeakPolarHBondContact O-CB 3.3Å; S609-D613 PolarHBondContact O-N 3.04Å; D613-R617 WeakPolarHBondContact O-CB 2.97Å; D613-R617 WeakPolarHBondContact O-CG 3.47Å; D613-R617 PolarHBondContact O-N 2.92Å; D613-R617 PolarHBondContact O-NE 3.19Å
614	H	73.4	Confident	70.7	Confident	20 Å²	20	100.9 Å²	100.9	9%	0.093	48%	0.482	C	S	.	.	H	α-helix	trans	-67.6	-49.4	175.7	-176.5	74.9	0	0	0	111.1	N610 L611 V612 Q616 R617 V618 W643	N610-H614 WeakPolarHBondContact O-CB 3.46Å; N610-H614 PolarHBondContact O-N 3.22Å; L611-H614 PolarHBondContact O-N 3.46Å; V612-H614 VanDerWaalsContact C-N 3.29Å; V612-H614 PolarHBondContact O-N 2.91Å; H614-Q616 VanDerWaalsContact C-N 3.31Å; H614-Q616 PolarHBondContact O-N 2.99Å; H614-R617 PolarHBondContact O-N 2.78Å; H614-V618 WeakPolarHBondContact O-CG2 3.05Å; H614-V618 PolarHBondContact O-N 3.49Å; H614-W643 HydrophobicContact CB-CG 4.27Å; H614-W643 AromaticContact CG-CD1 3.67Å; H614-W643 AromaticContact CG-CG 3.89Å; H614-W643 AromaticContact CG-NE1 3.97Å; H614-W643 AromaticContact ND1-CD1 3.55Å; H614-W643 AromaticContact ND1-CG 3.63Å
615	F	75.5	Confident	70.1	Confident	127 Å²	127	100 Å²	100	56%	0.557	49%	0.487	S	S	*	.	H	α-helix	trans	-62.3	-37.8	176.9	-82.3	-67	0	0	0	112.3	L611 V612 V618 R619	L611-F615 HydrophobicContact CD1-CE2 4.4Å; L611-F615 HydrophobicContact CD2-CD2 4.03Å; L611-F615 HydrophobicContact CD2-CE2 3.68Å; L611-F615 HydrophobicContact CG-CD2 3.94Å; L611-F615 HydrophobicContact CG-CE2 3.73Å; L611-F615 WeakPolarHBondContact O-CD2 3.41Å; L611-F615 PolarHBondContact O-N 2.81Å; V612-F615 PolarHBondContact O-N 2.83Å; F615-V618 PolarHBondContact O-N 3.08Å; F615-R619 VanDerWaalsContact O-CB 3.27Å; F615-R619 WeakPolarHBondContact O-CB 3.46Å; F615-R619 PolarHBondContact O-N 3.07Å
616	Q	78	Confident	69.4	Low	113 Å²	113	100.3 Å²	100.3	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-42.9	173.4	-77	179.6	-20.2	0	0	111.9	V612 H614 R619 H620	V612-Q616 HydrophobicContact CG1-CG 4.42Å; V612-Q616 WeakPolarHBondContact O-CB 3.07Å; V612-Q616 WeakPolarHBondContact O-CG 3.48Å; V612-Q616 PolarHBondContact O-N 3.31Å; H614-Q616 VanDerWaalsContact C-N 3.31Å; H614-Q616 PolarHBondContact O-N 2.99Å; Q616-R619 PolarHBondContact O-N 2.8Å; Q616-H620 WeakPolarHBondContact O-CB 3.05Å; Q616-H620 PolarHBondContact O-N 3.02Å
617	R	71.5	Confident	68.8	Low	145 Å²	145	101.4 Å²	101.4	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174.6	-82.2	-175.8	-95.1	-159	-9.6	112.6	D613 H614 R619 H620 C621	D613-R617 WeakPolarHBondContact O-CB 2.97Å; D613-R617 WeakPolarHBondContact O-CG 3.47Å; D613-R617 PolarHBondContact O-N 2.92Å; D613-R617 PolarHBondContact O-NE 3.19Å; H614-R617 PolarHBondContact O-N 2.78Å; R617-R619 VanDerWaalsContact C-N 3.33Å; R617-R619 PolarHBondContact O-N 3.34Å; R617-H620 PolarHBondContact O-N 3.26Å; R617-C621 WeakPolarHBondContact O-CB 3.23Å; R617-C621 PolarHBondContact O-N 3.06Å
618	V	71.5	Confident	67.9	Low	62 Å²	62	99.7 Å²	99.7	38%	0.376	51%	0.51	S	S	.	.	H	α-helix	trans	-60.5	-43.3	174.6	173.5	0	0	0	0	110.6	H614 F615 C621 S622 V638	H614-V618 WeakPolarHBondContact O-CG2 3.05Å; H614-V618 PolarHBondContact O-N 3.49Å; F615-V618 PolarHBondContact O-N 3.08Å; V618-C621 WeakPolarHBondContact O-CB 3.48Å; V618-C621 PolarHBondContact O-N 3.25Å; V618-S622 WeakPolarHBondContact O-CB 3.43Å; V618-S622 PolarHBondContact O-N 3.24Å; V618-V638 HydrophobicContact CG2-CG1 3.5Å
619	R	73.2	Confident	66.7	Low	206 Å²	206	97 Å²	97	78%	0.777	52%	0.521	S	S	*	.	H	α-helix	trans	-66.5	-41.5	178.7	-157	176.6	-164.4	166.5	3.4	112.3	F615 Q616 R617 C621 S622 Y623	F615-R619 VanDerWaalsContact O-CB 3.27Å; F615-R619 WeakPolarHBondContact O-CB 3.46Å; F615-R619 PolarHBondContact O-N 3.07Å; Q616-R619 PolarHBondContact O-N 2.8Å; R617-R619 VanDerWaalsContact C-N 3.33Å; R617-R619 PolarHBondContact O-N 3.34Å; R619-C621 VanDerWaalsContact C-N 3.34Å; R619-S622 PolarHBondContact O-N 2.8Å; R619-Y623 PolarHBondContact O-N 3.13Å
620	H	70.3	Confident	65.4	Low	133 Å²	133	98.5 Å²	98.5	62%	0.616	53%	0.531	S	S	*	.	H	α-helix	trans	-63.2	-39.6	174.2	-105.9	-62.7	0	0	0	112.5	Q616 R617 R624	Q616-H620 WeakPolarHBondContact O-CB 3.05Å; Q616-H620 PolarHBondContact O-N 3.02Å; R617-H620 PolarHBondContact O-N 3.26Å; H620-R624 PolarHBondContact O-N 3.34Å
621	C	66.8	Low	64.1	Low	26 Å²	26	99.8 Å²	99.8	18%	0.176	54%	0.541	C	S	.	.	H	α-helix	trans	-62.3	-47.4	172.7	-102.5	0	0	0	0	112	R617 V618 R619 Y623 R624 S625 C635	R617-C621 WeakPolarHBondContact O-CB 3.23Å; R617-C621 PolarHBondContact O-N 3.06Å; V618-C621 WeakPolarHBondContact O-CB 3.48Å; V618-C621 PolarHBondContact O-N 3.25Å; R619-C621 VanDerWaalsContact C-N 3.34Å; C621-Y623 VanDerWaalsContact C-N 3.31Å; C621-Y623 PolarHBondContact O-N 3.11Å; C621-R624 PolarHBondContact O-N 3.07Å; C621-S625 PolarHBondContact O-N 3.2Å; C621-C635 HydrophobicContact CB-CB 4.35Å; C621-C635 WeakPolarHBondContact CB-SG 3.44Å; C621-C635 VanDerWaalsContact SG-CA 3.52Å; C621-C635 WeakPolarHBondContact SG-CB 3.43Å; C621-C635 CovalentContact SG-SG 2.04Å; C621-C635 PolarHBondContact SG-SG 2.99Å
622	S	62.8	Low	62.9	Low	86 Å²	86	105.5 Å²	105.5	60%	0.601	57%	0.566	S	S	*	*	H	α-helix	trans	-64.4	-33.8	179.5	-171	0	0	0	0	112.7	V618 R619	V618-S622 WeakPolarHBondContact O-CB 3.43Å; V618-S622 PolarHBondContact O-N 3.24Å; R619-S622 PolarHBondContact O-N 2.8Å
623	Y	60.8	Low	61.7	Low	193 Å²	193	107 Å²	107	76%	0.757	58%	0.579	S	S	*	*	H	α-helix	trans	-74.6	-38.9	176.3	-166.4	-94.6	0	0	0	112.3	R619 C621 A626	R619-Y623 PolarHBondContact O-N 3.13Å; C621-Y623 VanDerWaalsContact C-N 3.31Å; C621-Y623 PolarHBondContact O-N 3.11Å; Y623-A626 PolarHBondContact O-N 2.79Å
624	R	57.1	Low	60.7	Low	161 Å²	161	108.3 Å²	108.3	61%	0.608	59%	0.59	S	S	*	*	H	α-helix	trans	-69.2	-35.3	176.5	-86.4	-174.6	174.6	-176.2	-1.4	113.2	H620 C621 A626 G627 S628	H620-R624 PolarHBondContact O-N 3.34Å; C621-R624 PolarHBondContact O-N 3.07Å; R624-A626 PolarHBondContact O-N 2.04Å; R624-G627 PolarHBondContact O-N 2.87Å; R624-S628 PolarHBondContact O-N 2.83Å; R624-S628 PolarHBondContact O-OG 2.03Å
625	S	53.6	Low	59.8	Low	100 Å²	100	109.6 Å²	109.6	70%	0.699	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-18.2	174.1	-92.7	0	0	0	0	114	C621	C621-S625 PolarHBondContact O-N 3.2Å
626	A	56.1	Low	58.7	Low	89 Å²	89	107.9 Å²	107.9	74%	0.736	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-8.9	178.1	0	0	0	0	0	114	Y623 R624	Y623-A626 PolarHBondContact O-N 2.79Å; R624-A626 PolarHBondContact O-N 2.04Å
627	G	57.1	Low	57.6	Low	67 Å²	67	108.9 Å²	108.9	69%	0.691	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	-4.4	-168.4	0	0	0	0	0	117.3	R624	R624-G627 PolarHBondContact O-N 2.87Å
628	S	50.4	Low	56.9	Low	58 Å²	58	104.3 Å²	104.3	41%	0.406	60%	0.597	S	S	.	*			trans	-156.4	125.4	178.9	60.5	0	0	0	0	112.8	R624 S630	R624-S628 PolarHBondContact O-N 2.83Å; R624-S628 PolarHBondContact O-OG 2.03Å; S628-S630 PolarHBondContact O-N 3.19Å
629	S	49.9	Very low	56.3	Low	134 Å²	134	103.7 Å²	103.7	94%	0.937	60%	0.596	S	S	*	*	S	Bend	trans	-74.5	22.7	176.8	49	0	0	0	0	114.5
630	S	45.7	Very low	55.7	Low	87 Å²	87	99.8 Å²	99.8	61%	0.608	58%	0.584	S	S	*	*	S	Bend	trans	-153.3	80.1	-172.4	50.8	0	0	0	0	111.7	S628	S628-S630 PolarHBondContact O-N 3.19Å
631	T	46.1	Very low	54.9	Low	82 Å²	82	101 Å²	101	50%	0.503	59%	0.588	S	S	.	*			trans	175.9	64	153.6	29.4	0	0	0	0	111.3	S633	T631-S633 VanDerWaalsContact C-N 3.29Å; T631-S633 PolarHBondContact O-N 2.82Å
632	E	47.6	Very low	54.4	Low	189 Å²	189	106.4 Å²	106.4	88%	0.883	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-9.6	178.5	-83.7	-176.3	144.1	0	0	114.9
633	S	53.2	Low	54.3	Low	98 Å²	98	103.8 Å²	103.8	69%	0.685	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-20.6	-169.4	62.2	0	0	0	0	115.7	T631 S636	T631-S633 VanDerWaalsContact C-N 3.29Å; T631-S633 PolarHBondContact O-N 2.82Å; S633-S636 PolarHBondContact O-OG 3.05Å
634	T	53.3	Low	54	Low	98 Å²	98	97.6 Å²	97.6	60%	0.601	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-22.2	-173.8	9.5	0	0	0	0	114.4
635	C	55.3	Low	54	Low	48 Å²	48	95.4 Å²	95.4	32%	0.324	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-86.6	-20	-175.9	-162.4	0	0	0	0	113.6	C621 Q637 V638	C621-C635 HydrophobicContact CB-CB 4.35Å; C621-C635 WeakPolarHBondContact CB-SG 3.44Å; C621-C635 VanDerWaalsContact SG-CA 3.52Å; C621-C635 WeakPolarHBondContact SG-CB 3.43Å; C621-C635 CovalentContact SG-SG 2.04Å; C621-C635 PolarHBondContact SG-SG 2.99Å; C635-Q637 PolarHBondContact O-N 3.14Å; C635-V638 PolarHBondContact O-N 3.3Å
636	S	51.6	Low	54	Low	91 Å²	91	94 Å²	94	64%	0.636	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-63.5	-9.7	179	60	0	0	0	0	114.6	S633	S633-S636 PolarHBondContact O-OG 3.05Å
637	Q	54.7	Low	53.9	Low	133 Å²	133	90.8 Å²	90.8	62%	0.621	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-91	-7.5	177.2	-67	-139.9	-5.5	0	0	115	C635 S639	C635-Q637 PolarHBondContact O-N 3.14Å; Q637-S639 PolarHBondContact O-N 2.78Å
638	V	57	Low	53.5	Low	49 Å²	49	93.8 Å²	93.8	30%	0.297	52%	0.517	S	S	.	.			trans	-84.7	57.1	-178.6	-165	0	0	0	0	110.8	V618 C635	V618-V638 HydrophobicContact CG2-CG1 3.5Å; C635-V638 PolarHBondContact O-N 3.3Å
639	S	60.5	Low	53.3	Low	49 Å²	49	94.8 Å²	94.8	34%	0.343	52%	0.524	S	S	.	.			trans	-85.4	125.1	172.4	172.8	0	0	0	0	110	Q637 K641 R642 W643	Q637-S639 PolarHBondContact O-N 2.78Å; S639-K641 PolarHBondContact O-N 3.19Å; S639-K641 VanDerWaalsContact O-N 3.12Å; S639-K641 WeakPolarHBondContact OG-CB 3.45Å; S639-K641 PolarHBondContact OG-N 3.14Å; S639-R642 PolarHBondContact O-N 3.28Å; S639-W643 PolarHBondContact O-N 2.97Å
640	F	60	Low	52.9	Low	124 Å²	124	92.4 Å²	92.4	54%	0.544	51%	0.507	S	S	.	.	H	α-helix	trans	-52	-33.1	171	-174.5	-106	0	0	0	112.1	W643 L644	F640-W643 HydrophobicContact CD2-CE3 4.02Å; F640-W643 AromaticContact CE2-CE3 3.77Å; F640-W643 HydrophobicContact CE2-CE3 3.77Å; F640-W643 AromaticContact CE2-CZ3 3.82Å; F640-W643 HydrophobicContact CE2-CZ3 3.82Å; F640-W643 HydrophobicContact CZ-CE3 4.39Å; F640-W643 HydrophobicContact CZ-CZ3 4.2Å; F640-W643 PolarHBondContact O-N 3.17Å; F640-L644 HydrophobicContact CD1-CD1 3.87Å; F640-L644 HydrophobicContact CD1-CG 4.39Å; F640-L644 HydrophobicContact CE1-CD1 3.57Å; F640-L644 HydrophobicContact CE1-CG 4.08Å; F640-L644 HydrophobicContact CZ-CD1 4.27Å; F640-L644 HydrophobicContact CZ-CD2 4.49Å; F640-L644 HydrophobicContact CZ-CG 4.35Å; F640-L644 PolarHBondContact O-N 3.29Å
641	K	53.7	Low	52.5	Low	160 Å²	160	99.7 Å²	99.7	70%	0.696	52%	0.521	S	S	*	.	H	α-helix	trans	-66.1	-41.3	176.8	-155.9	176.9	-176.2	-178.9	0	112.1	S639 I645	S639-K641 PolarHBondContact O-N 3.19Å; S639-K641 VanDerWaalsContact O-N 3.12Å; S639-K641 WeakPolarHBondContact OG-CB 3.45Å; S639-K641 PolarHBondContact OG-N 3.14Å; K641-I645 WeakPolarHBondContact O-CD1 3.39Å; K641-I645 VanDerWaalsContact O-CG1 3.29Å; K641-I645 WeakPolarHBondContact O-CG1 3.39Å; K641-I645 PolarHBondContact O-N 3.14Å
642	R	56.1	Low	51.9	Low	139 Å²	139	100.4 Å²	100.4	53%	0.525	53%	0.529	S	S	.	.	H	α-helix	trans	-70	-36.1	172.9	-80.2	-172.5	-163.8	179.1	5.7	112.1	S639 I645 S646	S639-R642 PolarHBondContact O-N 3.28Å; R642-I645 PolarHBondContact O-N 3.1Å; R642-S646 PolarHBondContact O-N 3.38Å; R642-S646 PolarHBondContact O-OG 3.34Å
643	W	59.6	Low	51.3	Low	30 Å²	30	97.1 Å²	97.1	11%	0.114	52%	0.524	C	S	.	.	H	α-helix	trans	-63.7	-41.2	176.3	174.6	84	0	0	0	112.5	N610 L611 H614 S639 F640 S646 S647	N610-W643 PolarHBondContact O-NE1 2.7Å; N610-W643 VanDerWaalsContact O-NE1 3.09Å; L611-W643 HydrophobicContact CB-CZ2 4.13Å; L611-W643 HydrophobicContact CD1-CH2 3.49Å; L611-W643 VanDerWaalsContact CD1-CH2 3.49Å; L611-W643 HydrophobicContact CD1-CZ2 3.7Å; L611-W643 HydrophobicContact CD1-CZ3 4.4Å; L611-W643 HydrophobicContact CG-CZ2 4.39Å; H614-W643 HydrophobicContact CB-CG 4.27Å; H614-W643 AromaticContact CG-CD1 3.67Å; H614-W643 AromaticContact CG-CG 3.89Å; H614-W643 AromaticContact CG-NE1 3.97Å; H614-W643 AromaticContact ND1-CD1 3.55Å; H614-W643 AromaticContact ND1-CG 3.63Å; S639-W643 PolarHBondContact O-N 2.97Å; F640-W643 HydrophobicContact CD2-CE3 4.02Å; F640-W643 AromaticContact CE2-CE3 3.77Å; F640-W643 HydrophobicContact CE2-CE3 3.77Å; F640-W643 AromaticContact CE2-CZ3 3.82Å; F640-W643 HydrophobicContact CE2-CZ3 3.82Å; F640-W643 HydrophobicContact CZ-CE3 4.39Å; F640-W643 HydrophobicContact CZ-CZ3 4.2Å; F640-W643 PolarHBondContact O-N 3.17Å; W643-S646 PolarHBondContact O-N 3.12Å; W643-S646 PolarHBondContact O-OG 3.21Å; W643-S647 PolarHBondContact NE1-OG 3Å; W643-S647 WeakPolarHBondContact O-CB 3.04Å; W643-S647 PolarHBondContact O-N 2.65Å; W643-S647 PolarHBondContact O-OG 2.91Å
644	L	55.2	Low	50.2	Low	64 Å²	64	100.3 Å²	100.3	34%	0.335	53%	0.533	S	S	.	.	H	α-helix	trans	-58.8	-51.2	171.8	-77.7	168.7	0	0	0	110.1	F640 S646 S647 F648	F640-L644 HydrophobicContact CD1-CD1 3.87Å; F640-L644 HydrophobicContact CD1-CG 4.39Å; F640-L644 HydrophobicContact CE1-CD1 3.57Å; F640-L644 HydrophobicContact CE1-CG 4.08Å; F640-L644 HydrophobicContact CZ-CD1 4.27Å; F640-L644 HydrophobicContact CZ-CD2 4.49Å; F640-L644 HydrophobicContact CZ-CG 4.35Å; F640-L644 PolarHBondContact O-N 3.29Å; L644-S646 VanDerWaalsContact C-N 3.35Å; L644-S646 PolarHBondContact O-N 2.74Å; L644-S647 PolarHBondContact O-N 2.53Å; L644-F648 HydrophobicContact CD2-CE2 3.93Å; L644-F648 VanDerWaalsContact O-N 3.07Å; L644-F648 PolarHBondContact O-N 2.86Å; L644-F648 WeakPolarHBondContact O-CD2 3.35Å
645	I	56.9	Low	49.3	Very low	114 Å²	114	107.4 Å²	107.4	59%	0.585	55%	0.549	S	S	*	.	H	α-helix	trans	-59.6	-42.6	-179	-64.4	164.5	0	0	0	111.8	K641 R642 S649	K641-I645 WeakPolarHBondContact O-CD1 3.39Å; K641-I645 VanDerWaalsContact O-CG1 3.29Å; K641-I645 WeakPolarHBondContact O-CG1 3.39Å; K641-I645 PolarHBondContact O-N 3.14Å; R642-I645 PolarHBondContact O-N 3.1Å; I645-S649 WeakPolarHBondContact O-CB 3.38Å; I645-S649 PolarHBondContact O-N 3Å
646	S	53.7	Low	48.1	Very low	72 Å²	72	116.7 Å²	116.7	50%	0.503	59%	0.593	S	S	.	*	H	α-helix	trans	-73.6	-37.1	179.9	72.9	0	0	0	0	113.1	R642 W643 L644 F648 S649	R642-S646 PolarHBondContact O-N 3.38Å; R642-S646 PolarHBondContact O-OG 3.34Å; W643-S646 PolarHBondContact O-N 3.12Å; W643-S646 PolarHBondContact O-OG 3.21Å; L644-S646 VanDerWaalsContact C-N 3.35Å; L644-S646 PolarHBondContact O-N 2.74Å; S646-F648 PolarHBondContact O-N 3.15Å; S646-S649 PolarHBondContact O-N 3.16Å; S646-S649 VanDerWaalsContact O-N 3.13Å
647	S	53.4	Low	48	Very low	20 Å²	20	118 Å²	118	14%	0.14	59%	0.591	C	S	.	*	H	α-helix	trans	-68.6	-25.1	178.5	-60.8	0	0	0	0	112.6	W643 L644	W643-S647 PolarHBondContact NE1-OG 3Å; W643-S647 WeakPolarHBondContact O-CB 3.04Å; W643-S647 PolarHBondContact O-N 2.65Å; W643-S647 PolarHBondContact O-OG 2.91Å; L644-S647 PolarHBondContact O-N 2.53Å
648	F	50	Low	47.6	Very low	131 Å²	131	117.2 Å²	117.2	58%	0.575	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-8.4	172.8	-75.3	-71	0	0	0	113.9	L644 S646	L644-F648 HydrophobicContact CD2-CE2 3.93Å; L644-F648 VanDerWaalsContact O-N 3.07Å; L644-F648 PolarHBondContact O-N 2.86Å; L644-F648 WeakPolarHBondContact O-CD2 3.35Å; S646-F648 PolarHBondContact O-N 3.15Å
649	S	46.5	Very low	47.1	Very low	79 Å²	79	120.9 Å²	120.9	55%	0.552	61%	0.605	S	S	*	*			trans	-106	3.7	-172.4	178.6	0	0	0	0	114.5	I645 S646 R651	I645-S649 WeakPolarHBondContact O-CB 3.38Å; I645-S649 PolarHBondContact O-N 3Å; S646-S649 PolarHBondContact O-N 3.16Å; S646-S649 VanDerWaalsContact O-N 3.13Å; S649-R651 PolarHBondContact O-N 2.84Å
650	S	41.6	Very low	46.3	Very low	83 Å²	83	125.2 Å²	125.2	58%	0.58	62%	0.621	S	S	*	*			trans	-66.6	88.9	-175.5	61.7	0	0	0	0	112.7	C652	S650-C652 PolarHBondContact O-N 3Å
651	R	36.4	Very low	45.4	Very low	240 Å²	240	125.3 Å²	125.3	91%	0.906	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-52.7	116.3	156.5	-75.5	-179	-177.6	-169.3	-0.2	107.6	S649	S649-R651 PolarHBondContact O-N 2.84Å
652	C	33.1	Very low	44.9	Very low	98 Å²	98	122.9 Å²	122.9	66%	0.662	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-69.5	142.8	161.5	-78.2	0	0	0	0	108.7	S650 N654	S650-C652 PolarHBondContact O-N 3Å; C652-N654 PolarHBondContact O-N 2.95Å
653	P	35	Very low	44.1	Very low	120 Å²	120	121.8 Å²	121.8	78%	0.779	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-67.2	132.2	176.1	28	-30.6	0	0	0	109.3	R655	P653-R655 PolarHBondContact O-N 2.96Å
654	N	30.8	Very low	42.9	Very low	165 Å²	165	128.8 Å²	128.8	88%	0.882	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-54.6	121.7	168.1	-73.8	-29.5	0	0	0	108.7	C652	C652-N654 PolarHBondContact O-N 2.95Å
655	R	33.9	Very low	41.9	Very low	246 Å²	246	134.3 Å²	134.3	93%	0.928	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-96.2	129.3	155	-96.4	-171.7	-175.5	-161.1	1.1	107.6	P653	P653-R655 PolarHBondContact O-N 2.96Å
656	I	31.4	Very low	40.5	Very low	243 Å²	243	136.1 Å²	136.1	100%	1.246	71%	0.705	S	S	*	*			trans	-49.5	0	169.5	-62.4	168.5	0	0	0	110.4

Retrieved 656 of 656 residues in 420.7 ms (Link to these results)

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