A0A087XSM9_POEFO Loading...

Transcobalamin II

AlphaFold DB , UniProt , Accession A0A087XSM9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 427 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	37.8	Very low	237 Å²	237	147.4 Å²	147.4	100%	1.167	84%	0.841	S	S	*	*				0	106.5	0	-77.5	-142.3	-77.2	0	0	108.9
2	L	36	Very low	37.5	Very low	183 Å²	183	143.1 Å²	143.1	96%	0.958	84%	0.837	S	S	*	*			trans	-161.1	111.5	156.9	-112	126.6	0	0	0	106.3
3	A	36.7	Very low	37.2	Very low	97 Å²	97	148 Å²	148	80%	0.802	84%	0.843	S	S	*	*			trans	-83.9	135.1	-173.6	0	0	0	0	0	110.5
4	L	34.7	Very low	37.2	Very low	159 Å²	159	144.1 Å²	144.1	83%	0.832	84%	0.838	S	S	*	*			trans	-90.3	121.5	172.7	-145.1	89.1	0	0	0	108	I6	L4-I6 HydrophobicContact CD2-CD1 4.41Å; L4-I6 HydrophobicContact CD2-CG1 4.31Å
5	V	37.8	Very low	37.3	Very low	125 Å²	125	142.7 Å²	142.7	76%	0.758	84%	0.84	S	S	*	*			trans	-102.4	115.5	172.2	176.4	0	0	0	0	107.9	I7	V5-I7 HydrophobicContact CG1-CG1 4.31Å
6	I	39.7	Very low	37.3	Very low	135 Å²	135	140.4 Å²	140.4	69%	0.692	83%	0.833	S	S	*	*			trans	-98.1	118.5	171.7	-62.3	175.9	0	0	0	107.3	L4	L4-I6 HydrophobicContact CD2-CD1 4.41Å; L4-I6 HydrophobicContact CD2-CG1 4.31Å
7	I	40.3	Very low	37.4	Very low	154 Å²	154	143.5 Å²	143.5	79%	0.79	83%	0.833	S	S	*	*			trans	-92.2	110.6	171.8	-64.3	171.8	0	0	0	107.6	V5	V5-I7 HydrophobicContact CG1-CG1 4.31Å
8	T	40	Very low	37.6	Very low	122 Å²	122	142.3 Å²	142.3	75%	0.748	83%	0.831	S	S	*	*			trans	-86.1	113	167.4	39.8	0	0	0	0	109.8
9	G	36.4	Very low	37.9	Very low	72 Å²	72	140.9 Å²	140.9	74%	0.742	83%	0.829	S	S	*	*			trans	-87.6	118.8	169.5	0	0	0	0	0	111.3
10	L	34.9	Very low	38.6	Very low	178 Å²	178	137.2 Å²	137.2	93%	0.932	81%	0.808	S	S	*	*			trans	-76.7	113.3	168.3	-89.2	125.1	0	0	0	109.7
11	L	38.3	Very low	39.4	Very low	159 Å²	159	135.1 Å²	135.1	83%	0.832	80%	0.797	S	S	*	*			trans	-85.6	107.5	164.1	-87.9	155.8	0	0	0	108.6	F13	L11-F13 PolarHBondContact O-N 2.82Å
12	A	34.6	Very low	40.5	Very low	96 Å²	96	132.4 Å²	132.4	79%	0.793	78%	0.781	S	S	*	*			trans	-71.5	114.8	168.7	0	0	0	0	0	109.3	A14	A12-A14 PolarHBondContact O-N 2.93Å; A12-A14 VanDerWaalsContact O-N 3.17Å
13	F	33.2	Very low	42	Very low	207 Å²	207	126 Å²	126	91%	0.908	76%	0.759	S	S	*	*			trans	-70.5	105.2	167.5	-80.2	-88.2	0	0	0	108.9	L11 S15	L11-F13 PolarHBondContact O-N 2.82Å; F13-S15 PolarHBondContact O-N 2.86Å
14	A	37.1	Very low	43.9	Very low	94 Å²	94	123.3 Å²	123.3	78%	0.777	74%	0.735	S	S	*	*			trans	-69.6	118.4	164.1	0	0	0	0	0	108.7	A12 S16	A12-A14 PolarHBondContact O-N 2.93Å; A12-A14 VanDerWaalsContact O-N 3.17Å; A14-S16 PolarHBondContact O-N 3.22Å
15	S	38.6	Very low	46.4	Very low	123 Å²	123	117.2 Å²	117.2	86%	0.86	70%	0.703	S	S	*	*			trans	-61.7	101.7	171.5	176	0	0	0	0	109.8	F13	F13-S15 PolarHBondContact O-N 2.86Å
16	S	37.9	Very low	48.7	Very low	106 Å²	106	114.5 Å²	114.5	74%	0.741	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-69.8	132.7	168.7	44.1	0	0	0	0	109.9	A14	A14-S16 PolarHBondContact O-N 3.22Å
17	K	39.4	Very low	51.2	Low	192 Å²	192	114.3 Å²	114.3	84%	0.835	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-56.9	138.7	164.8	-75.6	177.3	175.8	177.7	0	108.3	C19	K17-C19 PolarHBondContact O-N 2.66Å
18	P	40.8	Very low	53.7	Low	122 Å²	122	108 Å²	108	79%	0.792	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-61.7	123.7	-178.9	23.8	-30.9	0	0	0	109.7	V20	P18-V20 PolarHBondContact O-N 3.24Å
19	C	42.2	Very low	56.3	Low	117 Å²	117	103.8 Å²	103.8	79%	0.791	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-60.1	122.6	170.3	-70.3	0	0	0	0	108.7	K17 T21	K17-C19 PolarHBondContact O-N 2.66Å; C19-T21 PolarHBondContact O-N 3.05Å
20	V	52.4	Low	59	Low	66 Å²	66	102.1 Å²	102.1	40%	0.4	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-56.4	121	170.3	173.3	0	0	0	0	108.4	P18 N25	P18-V20 PolarHBondContact O-N 3.24Å; V20-N25 VanDerWaalsContact CG1-OD1 3.28Å; V20-N25 WeakPolarHBondContact CG1-OD1 3.42Å
21	T	54.9	Low	61.8	Low	94 Å²	94	96.2 Å²	96.2	58%	0.577	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-78.9	154.7	179.8	57.9	0	0	0	0	110.9	C19 G23 S24 N25	C19-T21 PolarHBondContact O-N 3.05Å; T21-G23 PolarHBondContact O-N 3.16Å; T21-G23 VanDerWaalsContact O-N 3.14Å; T21-S24 PolarHBondContact O-N 3.3Å; T21-N25 PolarHBondContact O-N 2.85Å
22	E	63.8	Low	64.5	Low	180 Å²	180	89 Å²	89	84%	0.841	53%	0.533	S	S	*	.	H	α-helix	trans	-54	-33.1	175.7	-70.5	-173	154.2	0	0	112.5	S24 N25 S26	E22-S24 PolarHBondContact O-N 3.19Å; E22-N25 PolarHBondContact O-N 3.07Å; E22-S26 PolarHBondContact O-N 3.01Å
23	G	68.1	Low	67.4	Low	49 Å²	49	84.4 Å²	84.4	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-41.7	174.7	0	0	0	0	0	113.9	T21 N25 S26 E27	T21-G23 PolarHBondContact O-N 3.16Å; T21-G23 VanDerWaalsContact O-N 3.14Å; G23-N25 VanDerWaalsContact C-N 3.29Å; G23-N25 PolarHBondContact O-N 2.93Å; G23-S26 PolarHBondContact O-N 2.97Å; G23-E27 PolarHBondContact O-N 3.3Å; G23-E27 VanDerWaalsContact O-N 3.13Å
24	S	76.8	Confident	70.3	Confident	40 Å²	40	77.1 Å²	77.1	28%	0.28	46%	0.462	S	S	.	.	H	α-helix	trans	-65.5	-33.2	178.3	176.6	0	0	0	0	112.5	T21 E22 L28 R272	T21-S24 PolarHBondContact O-N 3.3Å; E22-S24 PolarHBondContact O-N 3.19Å; S24-L28 PolarHBondContact O-N 3.18Å; S24-R272 PolarHBondContact OG-NH2 2.72Å
25	N	86.9	Confident	73.1	Confident	31 Å²	31	75 Å²	75	17%	0.166	44%	0.438	C	S	.	.	H	α-helix	trans	-71.4	-36.7	176.7	-70.2	-23.8	0	0	0	111.7	V20 T21 E22 G23 L29 R268 R272	V20-N25 VanDerWaalsContact CG1-OD1 3.28Å; V20-N25 WeakPolarHBondContact CG1-OD1 3.42Å; T21-N25 PolarHBondContact O-N 2.85Å; E22-N25 PolarHBondContact O-N 3.07Å; G23-N25 VanDerWaalsContact C-N 3.29Å; G23-N25 PolarHBondContact O-N 2.93Å; N25-L29 WeakPolarHBondContact O-CG 3.23Å; N25-L29 PolarHBondContact O-N 2.65Å; N25-L29 VanDerWaalsContact O-N 3.16Å; N25-R268 WeakPolarHBondContact OD1-CD 3.36Å; N25-R272 PolarHBondContact OD1-NH2 3.43Å
26	S	87.4	Confident	75.8	Confident	67 Å²	67	69.1 Å²	69.1	47%	0.469	40%	0.397	S	S	.	.	H	α-helix	trans	-64.7	-44.2	175.8	179.8	0	0	0	0	111.9	E22 G23 L28 L29 L30	E22-S26 PolarHBondContact O-N 3.01Å; G23-S26 PolarHBondContact O-N 2.97Å; S26-L28 VanDerWaalsContact C-N 3.35Å; S26-L28 PolarHBondContact O-N 2.93Å; S26-L29 PolarHBondContact O-N 2.81Å; S26-L30 PolarHBondContact O-N 3.35Å
27	E	91.3	Very high	78.5	Confident	132 Å²	132	64.1 Å²	64.1	62%	0.617	36%	0.361	S	S	*	.	H	α-helix	trans	-63.7	-38.8	177.7	-174.3	177.2	-169.7	0	0	112.8	G23 L30 T31	G23-E27 PolarHBondContact O-N 3.3Å; G23-E27 VanDerWaalsContact O-N 3.13Å; E27-L30 PolarHBondContact O-N 3.29Å; E27-T31 WeakPolarHBondContact O-CB 3.47Å; E27-T31 PolarHBondContact O-N 3.18Å; E27-T31 PolarHBondContact O-OG1 3.03Å
28	L	93.4	Very high	81	Confident	20 Å²	20	58.8 Å²	58.8	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-60.3	-47.4	174	177.8	65.1	0	0	0	111.5	S24 S26 L30 T31 L32 R268 A271 R272	S24-L28 PolarHBondContact O-N 3.18Å; S26-L28 VanDerWaalsContact C-N 3.35Å; S26-L28 PolarHBondContact O-N 2.93Å; L28-L30 VanDerWaalsContact C-N 3.32Å; L28-L30 PolarHBondContact O-N 3.28Å; L28-T31 WeakPolarHBondContact O-CB 3.43Å; L28-T31 PolarHBondContact O-N 3.4Å; L28-L32 HydrophobicContact CG-CD1 4.49Å; L28-L32 WeakPolarHBondContact O-CG 3.44Å; L28-L32 PolarHBondContact O-N 3.26Å; L28-R268 HydrophobicContact CD2-CB 3.8Å; L28-R268 HydrophobicContact CD2-CG 3.92Å; L28-A271 HydrophobicContact CD1-CB 3.93Å; L28-A271 HydrophobicContact CD2-CB 4.17Å; L28-A271 HydrophobicContact CG-CB 4.41Å; L28-R272 HydrophobicContact CD1-CG 4.08Å; L28-R272 HydrophobicContact CD2-CG 4.21Å
29	L	93.6	Very high	83.5	Confident	34 Å²	34	54.4 Å²	54.4	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-42	177.6	-72.1	175.7	0	0	0	111.7	N25 S26 T31 L32 N33 L286 L289 Q290	N25-L29 WeakPolarHBondContact O-CG 3.23Å; N25-L29 PolarHBondContact O-N 2.65Å; N25-L29 VanDerWaalsContact O-N 3.16Å; S26-L29 PolarHBondContact O-N 2.81Å; L29-T31 VanDerWaalsContact C-N 3.31Å; L29-T31 PolarHBondContact O-N 3.13Å; L29-L32 PolarHBondContact O-N 2.03Å; L29-N33 PolarHBondContact O-N 3.04Å; L29-N33 PolarHBondContact O-ND2 3.32Å; L29-L286 HydrophobicContact CD2-CD1 3.92Å; L29-L289 HydrophobicContact CD2-CB 3.7Å; L29-L289 HydrophobicContact CD2-CD1 4.4Å; L29-Q290 HydrophobicContact CD1-CG 4.26Å; L29-Q290 HydrophobicContact CD2-CG 3.94Å
30	L	93.1	Very high	85.9	Confident	38 Å²	38	49.5 Å²	49.5	20%	0.199	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-41.1	176.2	-172.6	66.5	0	0	0	111.3	S26 E27 L28 N33 R34 L310	S26-L30 PolarHBondContact O-N 3.35Å; E27-L30 PolarHBondContact O-N 3.29Å; L28-L30 VanDerWaalsContact C-N 3.32Å; L28-L30 PolarHBondContact O-N 3.28Å; L30-N33 PolarHBondContact O-N 3.17Å; L30-R34 VanDerWaalsContact O-CG 3.32Å; L30-R34 WeakPolarHBondContact O-CG 3.32Å; L30-R34 PolarHBondContact O-N 3.44Å; L30-L310 HydrophobicContact CD1-CD2 3.56Å
31	T	93.8	Very high	87.4	Confident	54 Å²	54	51.2 Å²	51.2	33%	0.331	28%	0.278	S	S	.	.	H	α-helix	trans	-63.3	-46.5	176.9	-60	0	0	0	0	111.9	E27 L28 L29 N33 R34 N35	E27-T31 WeakPolarHBondContact O-CB 3.47Å; E27-T31 PolarHBondContact O-N 3.18Å; E27-T31 PolarHBondContact O-OG1 3.03Å; L28-T31 WeakPolarHBondContact O-CB 3.43Å; L28-T31 PolarHBondContact O-N 3.4Å; L29-T31 VanDerWaalsContact C-N 3.31Å; L29-T31 PolarHBondContact O-N 3.13Å; T31-N33 VanDerWaalsContact C-N 3.34Å; T31-N33 PolarHBondContact O-N 3.17Å; T31-R34 PolarHBondContact O-N 3.32Å; T31-N35 VanDerWaalsContact O-CG 3.26Å; T31-N35 PolarHBondContact O-N 3.05Å; T31-N35 PolarHBondContact O-OD1 2.98Å
32	L	95.9	Very high	88.5	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-41.8	177	-68.9	176.2	0	0	0	112	L28 L29 N35 L36 A271 I282 L286 L289	L28-L32 HydrophobicContact CG-CD1 4.49Å; L28-L32 WeakPolarHBondContact O-CG 3.44Å; L28-L32 PolarHBondContact O-N 3.26Å; L29-L32 PolarHBondContact O-N 2.03Å; L32-N35 PolarHBondContact O-N 3.49Å; L32-L36 PolarHBondContact O-N 2.99Å; L32-A271 HydrophobicContact CD1-CB 4.24Å; L32-A271 HydrophobicContact CD2-CB 4.39Å; L32-I282 HydrophobicContact CB-CG2 4.07Å; L32-I282 HydrophobicContact CD2-CD1 4.48Å; L32-I282 HydrophobicContact CD2-CG1 4.37Å; L32-I282 HydrophobicContact CD2-CG2 4.19Å; L32-L286 HydrophobicContact CB-CD1 4.14Å; L32-L286 HydrophobicContact CD1-CD1 4.39Å; L32-L289 HydrophobicContact CD1-CD1 3.75Å
33	N	95.5	Very high	88.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-47.8	174.5	-85.5	-80.8	0	0	0	112	L29 L30 T31 N35 L36 V37 S58 H60 L310	L29-N33 PolarHBondContact O-N 3.04Å; L29-N33 PolarHBondContact O-ND2 3.32Å; L30-N33 PolarHBondContact O-N 3.17Å; T31-N33 VanDerWaalsContact C-N 3.34Å; T31-N33 PolarHBondContact O-N 3.17Å; N33-N35 VanDerWaalsContact C-N 3.27Å; N33-N35 PolarHBondContact O-N 3.38Å; N33-L36 PolarHBondContact O-N 3.33Å; N33-L36 VanDerWaalsContact O-N 3.15Å; N33-V37 WeakPolarHBondContact O-CG2 3.25Å; N33-V37 PolarHBondContact O-N 2.7Å; N33-S58 VanDerWaalsContact CG-OG 3.28Å; N33-S58 PolarHBondContact ND2-OG 3.39Å; N33-S58 VanDerWaalsContact OD1-CB 3.27Å; N33-S58 WeakPolarHBondContact OD1-CB 3.38Å; N33-S58 PolarHBondContact OD1-OG 2.85Å; N33-H60 HydrophobicContact CB-CB 4.25Å; N33-L310 HydrophobicContact CB-CD1 3.84Å; N33-L310 HydrophobicContact CB-CD2 3.7Å; N33-L310 HydrophobicContact CB-CG 4.42Å
34	R	94.4	Very high	88.7	Confident	53 Å²	53	52.8 Å²	52.8	20%	0.2	28%	0.284	C	S	.	.	H	α-helix	trans	-58	-40.2	175.8	-73.9	170.5	172.5	161.7	-6.4	111.8	L30 T31 V37 R38 L310 L312	L30-R34 VanDerWaalsContact O-CG 3.32Å; L30-R34 WeakPolarHBondContact O-CG 3.32Å; L30-R34 PolarHBondContact O-N 3.44Å; T31-R34 PolarHBondContact O-N 3.32Å; R34-V37 PolarHBondContact O-N 2.98Å; R34-R38 WeakPolarHBondContact O-CB 3.18Å; R34-R38 VanDerWaalsContact O-CG 3.31Å; R34-R38 WeakPolarHBondContact O-CG 2.99Å; R34-R38 PolarHBondContact O-N 2.99Å; R34-L310 HydrophobicContact CG-CD2 4.16Å; R34-L312 HydrophobicContact CB-CD2 4.25Å; R34-L312 HydrophobicContact CG-CD2 4.24Å
35	N	94.2	Very high	88.8	Confident	50 Å²	50	53.8 Å²	53.8	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-41	177.1	-69.9	-7.3	0	0	0	111.9	T31 L32 N33 R38 S39 I282	T31-N35 VanDerWaalsContact O-CG 3.26Å; T31-N35 PolarHBondContact O-N 3.05Å; T31-N35 PolarHBondContact O-OD1 2.98Å; L32-N35 PolarHBondContact O-N 3.49Å; N33-N35 VanDerWaalsContact C-N 3.27Å; N33-N35 PolarHBondContact O-N 3.38Å; N35-R38 PolarHBondContact O-N 2.97Å; N35-S39 PolarHBondContact O-N 3.15Å; N35-I282 HydrophobicContact CB-CD1 3.91Å
36	L	95.3	Very high	88.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-47.2	173	-74.3	-172.2	0	0	0	112.3	L32 N33 R38 S39 L40 V51 A54 L55 P279 I282 L286	L32-L36 PolarHBondContact O-N 2.99Å; N33-L36 PolarHBondContact O-N 3.33Å; N33-L36 VanDerWaalsContact O-N 3.15Å; L36-R38 VanDerWaalsContact C-N 3.32Å; L36-R38 PolarHBondContact O-N 3.18Å; L36-S39 WeakPolarHBondContact O-CB 2.98Å; L36-S39 PolarHBondContact O-N 3.37Å; L36-S39 VanDerWaalsContact O-N 3.08Å; L36-S39 PolarHBondContact O-OG 2.92Å; L36-L40 PolarHBondContact O-N 3.18Å; L36-V51 HydrophobicContact CB-CG1 4.36Å; L36-V51 HydrophobicContact CD2-CG1 4.07Å; L36-V51 HydrophobicContact CD2-CG2 4.2Å; L36-A54 HydrophobicContact CD1-CB 3.92Å; L36-L55 HydrophobicContact CB-CD1 4.49Å; L36-L55 HydrophobicContact CB-CD2 3.73Å; L36-L55 HydrophobicContact CB-CG 4.15Å; L36-L55 HydrophobicContact CD1-CD2 4.25Å; L36-L55 HydrophobicContact CD1-CG 4.32Å; L36-P279 HydrophobicContact CD2-CB 4.27Å; L36-P279 VanDerWaalsContact CD2-O 3.29Å; L36-P279 WeakPolarHBondContact CD2-O 3.2Å; L36-I282 HydrophobicContact CD1-CG2 3.94Å; L36-I282 HydrophobicContact CD2-CB 3.66Å; L36-I282 HydrophobicContact CD2-CD1 4.4Å; L36-I282 HydrophobicContact CD2-CG2 3.75Å; L36-I282 HydrophobicContact CG-CB 4.13Å; L36-I282 HydrophobicContact CG-CG2 3.6Å; L36-L286 HydrophobicContact CD1-CD2 3.68Å
37	V	95.1	Very high	89.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-40.8	179.6	-176.5	0	0	0	0	110.9	N33 R34 S39 L40 L55 N62 K65 L310 L312	N33-V37 WeakPolarHBondContact O-CG2 3.25Å; N33-V37 PolarHBondContact O-N 2.7Å; R34-V37 PolarHBondContact O-N 2.98Å; V37-S39 VanDerWaalsContact C-N 3.27Å; V37-S39 PolarHBondContact O-N 3.1Å; V37-L40 HydrophobicContact CG1-CD1 4.45Å; V37-L40 VanDerWaalsContact O-CB 3.26Å; V37-L40 WeakPolarHBondContact O-CB 3.33Å; V37-L40 VanDerWaalsContact O-CG 3.31Å; V37-L40 WeakPolarHBondContact O-CG 3.29Å; V37-L40 PolarHBondContact O-N 3.44Å; V37-L40 VanDerWaalsContact O-N 3.15Å; V37-L55 HydrophobicContact CG2-CD1 4.39Å; V37-L55 HydrophobicContact CG2-CD2 3.62Å; V37-N62 HydrophobicContact CG1-CB 4.08Å; V37-N62 HydrophobicContact CG2-CB 4.33Å; V37-K65 HydrophobicContact CG1-CB 3.79Å; V37-K65 HydrophobicContact CG1-CG 3.92Å; V37-L310 HydrophobicContact CG2-CD1 3.77Å; V37-L312 HydrophobicContact CB-CD1 4.41Å; V37-L312 HydrophobicContact CB-CD2 4.29Å; V37-L312 HydrophobicContact CG1-CD1 3.7Å; V37-L312 HydrophobicContact CG1-CD2 4.35Å; V37-L312 HydrophobicContact CG1-CG 4.2Å
38	R	92.6	Very high	89.5	Confident	80 Å²	80	47.9 Å²	47.9	30%	0.302	27%	0.267	S	S	.	.	H	α-helix	trans	-61.5	-35.8	174.1	-74	178.7	-174.6	130.8	-3.3	112.3	R34 N35 L36 L40 E41 L312	R34-R38 WeakPolarHBondContact O-CB 3.18Å; R34-R38 VanDerWaalsContact O-CG 3.31Å; R34-R38 WeakPolarHBondContact O-CG 2.99Å; R34-R38 PolarHBondContact O-N 2.99Å; N35-R38 PolarHBondContact O-N 2.97Å; L36-R38 VanDerWaalsContact C-N 3.32Å; L36-R38 PolarHBondContact O-N 3.18Å; R38-L40 PolarHBondContact O-N 2.83Å; R38-L40 VanDerWaalsContact O-N 3.16Å; R38-E41 WeakPolarHBondContact O-CB 3.45Å; R38-E41 PolarHBondContact O-N 3.02Å; R38-E41 VanDerWaalsContact O-N 3.07Å; R38-L312 HydrophobicContact CG-CD1 4.46Å; R38-L312 HydrophobicContact CG-CD2 4.06Å
39	S	93.2	Very high	89.7	Confident	31 Å²	31	46.9 Å²	46.9	22%	0.217	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-21.5	178.1	79.2	0	0	0	0	113.6	N35 L36 V37 E41 S42	N35-S39 PolarHBondContact O-N 3.15Å; L36-S39 WeakPolarHBondContact O-CB 2.98Å; L36-S39 PolarHBondContact O-N 3.37Å; L36-S39 VanDerWaalsContact O-N 3.08Å; L36-S39 PolarHBondContact O-OG 2.92Å; V37-S39 VanDerWaalsContact C-N 3.27Å; V37-S39 PolarHBondContact O-N 3.1Å; S39-E41 PolarHBondContact O-N 3.08Å; S39-S42 WeakPolarHBondContact O-CB 3.44Å; S39-S42 PolarHBondContact O-N 3.48Å
40	L	92.5	Very high	90	Very high	13 Å²	13	45.3 Å²	45.3	7%	0.068	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.9	176.5	-50.6	-177.3	0	0	0	113.3	L36 V37 R38 V51 L55 K65 H69 K72	L36-L40 PolarHBondContact O-N 3.18Å; V37-L40 HydrophobicContact CG1-CD1 4.45Å; V37-L40 VanDerWaalsContact O-CB 3.26Å; V37-L40 WeakPolarHBondContact O-CB 3.33Å; V37-L40 VanDerWaalsContact O-CG 3.31Å; V37-L40 WeakPolarHBondContact O-CG 3.29Å; V37-L40 PolarHBondContact O-N 3.44Å; V37-L40 VanDerWaalsContact O-N 3.15Å; R38-L40 PolarHBondContact O-N 2.83Å; R38-L40 VanDerWaalsContact O-N 3.16Å; L40-V51 HydrophobicContact CD2-CG1 3.63Å; L40-L55 HydrophobicContact CD1-CD1 3.74Å; L40-L55 HydrophobicContact CD2-CD1 4.19Å; L40-L55 HydrophobicContact CG-CD1 4.29Å; L40-K65 HydrophobicContact CD1-CB 4.17Å; L40-H69 HydrophobicContact CD1-CB 4.02Å; L40-H69 HydrophobicContact CD2-CB 4.23Å; L40-K72 PolarHBondContact O-NZ 2.94Å
41	E	84	Confident	90.2	Very high	102 Å²	102	43.6 Å²	43.6	48%	0.477	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-11.3	-179.7	-55.2	-172.8	146.8	0	0	112.6	R38 S39 P43 K65	R38-E41 WeakPolarHBondContact O-CB 3.45Å; R38-E41 PolarHBondContact O-N 3.02Å; R38-E41 VanDerWaalsContact O-N 3.07Å; S39-E41 PolarHBondContact O-N 3.08Å; E41-P43 WeakPolarHBondContact O-CD 3.3Å; E41-K65 WeakPolarHBondContact OE1-CE 3.39Å; E41-K65 IonicContact OE1-NZ 2.66Å; E41-K65 PolarHBondContact OE1-NZ 3.16Å
42	S	76.9	Confident	90.4	Very high	63 Å²	63	41.1 Å²	41.1	44%	0.441	23%	0.23	S	C	.	.			trans	-59	122.8	175.8	-178.6	0	0	0	0	109.8	S39 E44	S39-S42 WeakPolarHBondContact O-CB 3.44Å; S39-S42 PolarHBondContact O-N 3.48Å; S42-E44 PolarHBondContact O-N 3.02Å; S42-E44 PolarHBondContact OG-N 3.42Å; S42-E44 PolarHBondContact OG-O 3.44Å
43	P	66.7	Low	90.5	Very high	127 Å²	127	40.8 Å²	40.8	83%	0.825	23%	0.228	S	C	*	.			trans	-76.8	-11	176.2	32.4	-34.5	0	0	0	112.1	E41	E41-P43 WeakPolarHBondContact O-CD 3.3Å
44	E	69.5	Low	90.7	Very high	167 Å²	167	40.8 Å²	40.8	78%	0.78	23%	0.228	S	C	*	.	S	Bend	trans	-96	132.5	-176.1	-64.5	-170.8	179.5	0	0	112.2	S42	S42-E44 PolarHBondContact O-N 3.02Å; S42-E44 PolarHBondContact OG-N 3.42Å; S42-E44 PolarHBondContact OG-O 3.44Å
45	G	79.6	Confident	90.8	Very high	60 Å²	60	38.2 Å²	38.2	62%	0.619	22%	0.218	S	C	*	.	S	Bend	trans	93.5	171.8	174	0	0	0	0	0	114.3
46	L	89.4	Confident	90.9	Very high	75 Å²	75	36.7 Å²	36.7	39%	0.393	21%	0.209	S	C	.	.			trans	-75.8	147.9	174.1	-70.8	169	0	0	0	110.3	N48 D80	L46-N48 PolarHBondContact O-N 3.03Å; L46-D80 HydrophobicContact CD1-CB 3.95Å; L46-D80 VanDerWaalsContact CD1-CG 3.42Å; L46-D80 WeakPolarHBondContact CD1-OD2 3.41Å; L46-D80 HydrophobicContact CD2-CB 3.96Å
47	P	94.8	Very high	90.9	Very high	10 Å²	10	37 Å²	37	7%	0.065	21%	0.21	C	C	.	.			trans	-62.3	128.8	177.8	24.6	-32	0	0	0	110.4	P49 H69 K72 L73 E76 L77	P47-P49 WeakPolarHBondContact O-CD 3.36Å; P47-H69 VanDerWaalsContact CB-CE1 3.41Å; P47-H69 WeakPolarHBondContact CB-CE1 3.49Å; P47-K72 HydrophobicContact CB-CB 3.93Å; P47-K72 HydrophobicContact CG-CB 3.97Å; P47-L73 HydrophobicContact CB-CD2 3.8Å; P47-L73 HydrophobicContact CB-CG 4.25Å; P47-L73 HydrophobicContact CG-CD2 4.08Å; P47-L73 VanDerWaalsContact O-CD2 3.3Å; P47-L73 WeakPolarHBondContact O-CD2 3.05Å; P47-E76 HydrophobicContact CG-CB 4.05Å; P47-L77 HydrophobicContact CG-CB 3.98Å
48	N	96.6	Very high	90.8	Very high	21 Å²	21	37.2 Å²	37.2	11%	0.112	21%	0.212	C	C	.	.			trans	-85.7	115.2	-173.8	-173.1	-28.7	0	0	0	111.4	L46 S50 V51 H52 H69 M280 L375	L46-N48 PolarHBondContact O-N 3.03Å; N48-S50 VanDerWaalsContact C-N 3.35Å; N48-S50 PolarHBondContact O-N 2.92Å; N48-S50 WeakPolarHBondContact OD1-CA 3.49Å; N48-S50 WeakPolarHBondContact OD1-CB 3.42Å; N48-S50 PolarHBondContact OD1-N 3.48Å; N48-V51 HydrophobicContact CB-CB 4.14Å; N48-V51 HydrophobicContact CB-CG2 3.9Å; N48-V51 PolarHBondContact O-N 3.5Å; N48-V51 PolarHBondContact OD1-N 3.27Å; N48-H52 PolarHBondContact O-N 3.41Å; N48-H69 PolarHBondContact O-NE2 2.76Å; N48-H69 VanDerWaalsContact O-NE2 3.15Å; N48-M280 PolarHBondContact ND2-SD 3.37Å; N48-L375 HydrophobicContact CB-CD2 4.36Å; N48-L375 PolarHBondContact ND2-O 2.96Å
49	P	98.1	Very high	90.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-71.6	-26.2	-179.7	28.4	-33.8	0	0	0	113	P47 H52 L53 L73 L77 L97 A101 L375	P47-P49 WeakPolarHBondContact O-CD 3.36Å; P49-H52 PolarHBondContact O-N 2.97Å; P49-L53 VanDerWaalsContact O-CB 3.32Å; P49-L53 WeakPolarHBondContact O-CB 3.36Å; P49-L53 PolarHBondContact O-N 3.4Å; P49-L73 HydrophobicContact CB-CD2 3.99Å; P49-L77 HydrophobicContact CB-CD2 4.09Å; P49-L77 HydrophobicContact CG-CD2 3.81Å; P49-L97 HydrophobicContact CB-CB 4.04Å; P49-L97 HydrophobicContact CG-CB 3.63Å; P49-A101 HydrophobicContact CB-CB 3.88Å; P49-A101 WeakPolarHBondContact O-CB 3.31Å; P49-L375 HydrophobicContact CG-CD1 4.25Å
50	S	98.4	Very high	90.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-69.8	-38	176.1	-176.2	0	0	0	0	111.5	N48 L53 A54 M280 S283	N48-S50 VanDerWaalsContact C-N 3.35Å; N48-S50 PolarHBondContact O-N 2.92Å; N48-S50 WeakPolarHBondContact OD1-CA 3.49Å; N48-S50 WeakPolarHBondContact OD1-CB 3.42Å; N48-S50 PolarHBondContact OD1-N 3.48Å; S50-L53 PolarHBondContact O-N 3.17Å; S50-A54 PolarHBondContact O-N 2.94Å; S50-M280 VanDerWaalsContact CB-CE 3.48Å; S50-M280 VanDerWaalsContact CB-SD 3.52Å; S50-M280 WeakPolarHBondContact OG-CE 3.18Å; S50-S283 WeakPolarHBondContact O-CB 3.36Å; S50-S283 PolarHBondContact OG-OG 2.97Å
51	V	98.1	Very high	90.4	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-47.4	173.3	169.9	0	0	0	0	110.4	L36 L40 N48 L53 A54 L55 P279	L36-V51 HydrophobicContact CB-CG1 4.36Å; L36-V51 HydrophobicContact CD2-CG1 4.07Å; L36-V51 HydrophobicContact CD2-CG2 4.2Å; L40-V51 HydrophobicContact CD2-CG1 3.63Å; N48-V51 HydrophobicContact CB-CB 4.14Å; N48-V51 HydrophobicContact CB-CG2 3.9Å; N48-V51 PolarHBondContact O-N 3.5Å; N48-V51 PolarHBondContact OD1-N 3.27Å; V51-L53 PolarHBondContact O-N 3.21Å; V51-A54 PolarHBondContact O-N 3.27Å; V51-L55 HydrophobicContact CG1-CD1 4.22Å; V51-L55 WeakPolarHBondContact O-CG 3.31Å; V51-L55 PolarHBondContact O-N 2.61Å; V51-P279 HydrophobicContact CG2-CB 3.91Å
52	H	98.1	Very high	90.9	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-58.5	-47.6	176	-165.6	76.8	0	0	0	112.1	N48 P49 A54 L55 R56 E66 H69 L73 A101 S105	N48-H52 PolarHBondContact O-N 3.41Å; P49-H52 PolarHBondContact O-N 2.97Å; H52-A54 VanDerWaalsContact C-N 3.31Å; H52-A54 PolarHBondContact O-N 3.42Å; H52-L55 PolarHBondContact O-N 3.33Å; H52-R56 WeakPolarHBondContact O-CG 3.39Å; H52-R56 PolarHBondContact O-N 2.88Å; H52-E66 PolarHBondContact CE1-O 3.2Å; H52-H69 AromaticContact CG-CD2 4Å; H52-H69 AromaticContact ND1-CD2 3.54Å; H52-L73 HydrophobicContact CB-CD1 3.65Å; H52-A101 HydrophobicContact CB-CB 4.24Å; H52-S105 PolarHBondContact NE2-OG 3.29Å
53	L	98.5	Very high	91.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.1	-43.6	177.4	173	60.9	0	0	0	112	P49 S50 V51 R56 L57 L100 Y294 V297	P49-L53 VanDerWaalsContact O-CB 3.32Å; P49-L53 WeakPolarHBondContact O-CB 3.36Å; P49-L53 PolarHBondContact O-N 3.4Å; S50-L53 PolarHBondContact O-N 3.17Å; V51-L53 PolarHBondContact O-N 3.21Å; L53-R56 PolarHBondContact O-N 3.27Å; L53-L57 HydrophobicContact CD1-CD1 3.86Å; L53-L57 HydrophobicContact CD1-CG 4.14Å; L53-L57 HydrophobicContact CG-CD1 4.06Å; L53-L57 WeakPolarHBondContact O-CB 3.45Å; L53-L57 WeakPolarHBondContact O-CG 3.3Å; L53-L57 PolarHBondContact O-N 3.13Å; L53-L100 HydrophobicContact CD1-CB 4.29Å; L53-L100 HydrophobicContact CD2-CB 3.87Å; L53-L100 HydrophobicContact CD2-CD1 4.08Å; L53-Y294 HydrophobicContact CD2-CD1 3.7Å; L53-Y294 HydrophobicContact CD2-CE1 3.58Å; L53-Y294 HydrophobicContact CD2-CG 4.26Å; L53-Y294 HydrophobicContact CG-CD1 4.3Å; L53-Y294 HydrophobicContact CG-CE1 4.17Å; L53-V297 HydrophobicContact CD1-CG2 3.52Å
54	A	98.1	Very high	92.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.4	-40.4	179.3	0	0	0	0	0	112.6	L36 S50 V51 H52 L57 S58 S283 P287	L36-A54 HydrophobicContact CD1-CB 3.92Å; S50-A54 PolarHBondContact O-N 2.94Å; V51-A54 PolarHBondContact O-N 3.27Å; H52-A54 VanDerWaalsContact C-N 3.31Å; H52-A54 PolarHBondContact O-N 3.42Å; A54-L57 PolarHBondContact O-N 3.37Å; A54-S58 PolarHBondContact O-N 3Å; A54-S58 VanDerWaalsContact O-N 3.13Å; A54-S283 WeakPolarHBondContact CB-O 3.43Å; A54-P287 HydrophobicContact CB-CG 4.28Å
55	L	96.8	Very high	93.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.8	-45	174.2	-71.5	170.2	0	0	0	111.3	L36 V37 L40 V51 H52 L57 S58 H61 E66	L36-L55 HydrophobicContact CB-CD1 4.49Å; L36-L55 HydrophobicContact CB-CD2 3.73Å; L36-L55 HydrophobicContact CB-CG 4.15Å; L36-L55 HydrophobicContact CD1-CD2 4.25Å; L36-L55 HydrophobicContact CD1-CG 4.32Å; V37-L55 HydrophobicContact CG2-CD1 4.39Å; V37-L55 HydrophobicContact CG2-CD2 3.62Å; L40-L55 HydrophobicContact CD1-CD1 3.74Å; L40-L55 HydrophobicContact CD2-CD1 4.19Å; L40-L55 HydrophobicContact CG-CD1 4.29Å; V51-L55 HydrophobicContact CG1-CD1 4.22Å; V51-L55 WeakPolarHBondContact O-CG 3.31Å; V51-L55 PolarHBondContact O-N 2.61Å; H52-L55 PolarHBondContact O-N 3.33Å; L55-L57 VanDerWaalsContact C-N 3.29Å; L55-L57 PolarHBondContact O-N 3.3Å; L55-S58 WeakPolarHBondContact O-CB 3.31Å; L55-S58 PolarHBondContact O-N 3.33Å; L55-S58 VanDerWaalsContact O-N 3.09Å; L55-H61 PolarHBondContact O-CE1 3.2Å; L55-E66 HydrophobicContact CB-CG 4.27Å; L55-E66 HydrophobicContact CD1-CG 4.37Å
56	R	95.8	Very high	94.7	Very high	18 Å²	18	23.6 Å²	23.6	7%	0.068	12%	0.124	C	C	.	.	H	α-helix	trans	-67.3	-26.6	177.6	-67	-51.3	-55.4	158.7	4.6	114.2	H52 L53 S58 E66 S104 E305	H52-R56 WeakPolarHBondContact O-CG 3.39Å; H52-R56 PolarHBondContact O-N 2.88Å; L53-R56 PolarHBondContact O-N 3.27Å; R56-S58 VanDerWaalsContact C-N 3.33Å; R56-E66 WeakPolarHBondContact CD-OE2 3.45Å; R56-E66 IonicContact CZ-OE2 3.49Å; R56-E66 IonicContact NE-OE2 2.8Å; R56-E66 IonicContact NH1-OE2 3.18Å; R56-E66 PolarHBondContact NH1-OE2 3.09Å; R56-S104 WeakPolarHBondContact CB-O 3.46Å; R56-S104 WeakPolarHBondContact CB-OG 3.26Å; R56-S104 PolarHBondContact NE-O 3.29Å; R56-E305 IonicContact CZ-OE1 3.36Å; R56-E305 IonicContact CZ-OE2 3.83Å; R56-E305 IonicContact NH1-OE1 3.25Å; R56-E305 IonicContact NH1-OE2 3.19Å; R56-E305 PolarHBondContact NH1-OE2 2.99Å; R56-E305 IonicContact NH2-OE1 3.96Å; R56-E305 PolarHBondContact NH2-OE1 3.41Å; R56-E305 IonicContact NH2-OE2 2.62Å; R56-E305 PolarHBondContact NH2-OE2 2.92Å
57	L	95.3	Very high	94.9	Very high	5 Å²	5	23.6 Å²	23.6	3%	0.026	13%	0.127	C	C	.	.	H	α-helix	trans	-82.4	-12.6	173.6	-73.4	173.1	0	0	0	113.1	L53 A54 L55 P287 Y294 V297 L300	L53-L57 HydrophobicContact CD1-CD1 3.86Å; L53-L57 HydrophobicContact CD1-CG 4.14Å; L53-L57 HydrophobicContact CG-CD1 4.06Å; L53-L57 WeakPolarHBondContact O-CB 3.45Å; L53-L57 WeakPolarHBondContact O-CG 3.3Å; L53-L57 PolarHBondContact O-N 3.13Å; A54-L57 PolarHBondContact O-N 3.37Å; L55-L57 VanDerWaalsContact C-N 3.29Å; L55-L57 PolarHBondContact O-N 3.3Å; L57-P287 HydrophobicContact CD1-CB 4.36Å; L57-P287 HydrophobicContact CD1-CG 4.31Å; L57-Y294 HydrophobicContact CD1-CD1 3.91Å; L57-Y294 HydrophobicContact CD1-CE1 4.39Å; L57-V297 HydrophobicContact CD1-CG2 4.36Å; L57-V297 HydrophobicContact CD2-CG2 3.98Å; L57-V297 HydrophobicContact CG-CG2 4.43Å; L57-L300 HydrophobicContact CD2-CD1 4.44Å
58	S	93.5	Very high	95	Very high	5 Å²	5	27.5 Å²	27.5	4%	0.035	15%	0.147	C	C	.	.	S	Bend	trans	-73.4	162.4	-179.7	-171.2	0	0	0	0	112.2	N33 A54 L55 R56 H60 H61 Q290	N33-S58 VanDerWaalsContact CG-OG 3.28Å; N33-S58 PolarHBondContact ND2-OG 3.39Å; N33-S58 VanDerWaalsContact OD1-CB 3.27Å; N33-S58 WeakPolarHBondContact OD1-CB 3.38Å; N33-S58 PolarHBondContact OD1-OG 2.85Å; A54-S58 PolarHBondContact O-N 3Å; A54-S58 VanDerWaalsContact O-N 3.13Å; L55-S58 WeakPolarHBondContact O-CB 3.31Å; L55-S58 PolarHBondContact O-N 3.33Å; L55-S58 VanDerWaalsContact O-N 3.09Å; R56-S58 VanDerWaalsContact C-N 3.33Å; S58-H60 VanDerWaalsContact C-N 3.28Å; S58-H60 PolarHBondContact OG-N 3.29Å; S58-H60 VanDerWaalsContact OG-N 3.13Å; S58-H61 PolarHBondContact O-CE1 3.47Å; S58-H61 PolarHBondContact O-NE2 3.35Å; S58-Q290 PolarHBondContact OG-NE2 3.35Å; S58-Q290 PolarHBondContact OG-OE1 3.27Å
59	H	88.8	Confident	95	Very high	83 Å²	83	26.9 Å²	26.9	38%	0.384	14%	0.144	S	C	.	.	S	Bend	trans	-87.3	-0.2	166.9	-66.1	-64	0	0	0	113.1	K292 D306	H59-K292 WeakPolarHBondContact NE2-CE 3.33Å; H59-D306 IonicContact ND1-OD2 3.72Å
60	H	91.1	Very high	94.9	Very high	37 Å²	37	27.9 Å²	27.9	17%	0.171	15%	0.149	C	C	.	.			trans	-122.4	121	-174.7	-66.4	-56.3	0	0	0	108.5	N33 S58 T309 L310	N33-H60 HydrophobicContact CB-CB 4.25Å; S58-H60 VanDerWaalsContact C-N 3.28Å; S58-H60 PolarHBondContact OG-N 3.29Å; S58-H60 VanDerWaalsContact OG-N 3.13Å; H60-T309 WeakPolarHBondContact CA-OG1 3.43Å; H60-T309 PolarHBondContact ND1-OG1 3.06Å; H60-L310 VanDerWaalsContact C-CD1 3.42Å; H60-L310 HydrophobicContact CB-CD1 3.78Å; H60-L310 HydrophobicContact CB-CD2 3.75Å; H60-L310 HydrophobicContact CB-CG 3.62Å; H60-L310 WeakPolarHBondContact O-CD1 3.37Å
61	H	91.2	Very high	94.8	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.037	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-123.6	148	-173.7	-63.7	-59.8	0	0	0	113.2	L55 S58 E66 T309 L310	L55-H61 PolarHBondContact O-CE1 3.2Å; S58-H61 PolarHBondContact O-CE1 3.47Å; S58-H61 PolarHBondContact O-NE2 3.35Å; H61-E66 VanDerWaalsContact CA-OE1 3.26Å; H61-E66 WeakPolarHBondContact CA-OE1 3.39Å; H61-E66 IonicContact CG-OE1 3.9Å; H61-E66 IonicContact ND1-OE1 3.71Å; H61-E66 PolarHBondContact ND1-OE1 3.13Å; H61-E66 IonicContact ND1-OE2 3.72Å; H61-E66 PolarHBondContact ND1-OE2 3.24Å; H61-T309 PolarHBondContact O-N 2.89Å; H61-L310 VanDerWaalsContact O-CB 3.29Å; H61-L310 WeakPolarHBondContact O-CB 3.45Å; H61-L310 PolarHBondContact O-N 2.93Å
62	N	93.3	Very high	94.8	Very high	25 Å²	25	34.4 Å²	34.4	13%	0.134	18%	0.18	C	C	.	.			trans	-127.2	85.7	159.8	-171.1	-63.9	0	0	0	107.3	V37 A64 K65 E66 L310	V37-N62 HydrophobicContact CG1-CB 4.08Å; V37-N62 HydrophobicContact CG2-CB 4.33Å; N62-A64 PolarHBondContact O-N 3Å; N62-K65 HydrophobicContact CB-CB 4.33Å; N62-K65 PolarHBondContact O-N 3.39Å; N62-K65 VanDerWaalsContact O-N 3.16Å; N62-K65 VanDerWaalsContact OD1-CB 3.32Å; N62-K65 WeakPolarHBondContact OD1-CB 3.45Å; N62-K65 WeakPolarHBondContact OD1-CG 3.26Å; N62-K65 PolarHBondContact OD1-N 3.25Å; N62-E66 PolarHBondContact N-OE1 3.45Å; N62-E66 WeakPolarHBondContact O-CB 2.99Å; N62-E66 WeakPolarHBondContact O-CG 3.47Å; N62-E66 PolarHBondContact O-N 3.44Å; N62-L310 HydrophobicContact CB-CB 4.07Å; N62-L310 PolarHBondContact ND2-O 2.84Å
63	Q	90.9	Very high	94.8	Very high	74 Å²	74	34.3 Å²	34.3	35%	0.346	18%	0.18	S	C	.	.	H	α-helix	trans	-57.1	-36.2	-170.9	-75	173.6	12.1	0	0	112.7	T67 D308	Q63-T67 WeakPolarHBondContact O-CB 3.32Å; Q63-T67 PolarHBondContact O-N 3.19Å; Q63-T67 PolarHBondContact O-OG1 3.38Å; Q63-D308 WeakPolarHBondContact CB-OD1 3.24Å; Q63-D308 VanDerWaalsContact CG-OD1 3.23Å; Q63-D308 WeakPolarHBondContact CG-OD1 3.38Å; Q63-D308 PolarHBondContact N-OD1 3.2Å
64	A	92.1	Very high	94.7	Very high	61 Å²	61	36.7 Å²	36.7	50%	0.504	19%	0.19	S	C	.	.	H	α-helix	trans	-61.4	-53.5	177.1	0	0	0	0	0	111.7	N62 T67 D68	N62-A64 PolarHBondContact O-N 3Å; A64-T67 PolarHBondContact O-N 2.83Å; A64-D68 PolarHBondContact O-N 3.31Å
65	K	94.4	Very high	94.6	Very high	65 Å²	65	41.3 Å²	41.3	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-67.7	-37.7	-179.8	-68.4	-76.1	173.8	172	0	112.3	V37 L40 E41 N62 D68 H69	V37-K65 HydrophobicContact CG1-CB 3.79Å; V37-K65 HydrophobicContact CG1-CG 3.92Å; L40-K65 HydrophobicContact CD1-CB 4.17Å; E41-K65 WeakPolarHBondContact OE1-CE 3.39Å; E41-K65 IonicContact OE1-NZ 2.66Å; E41-K65 PolarHBondContact OE1-NZ 3.16Å; N62-K65 HydrophobicContact CB-CB 4.33Å; N62-K65 PolarHBondContact O-N 3.39Å; N62-K65 VanDerWaalsContact O-N 3.16Å; N62-K65 VanDerWaalsContact OD1-CB 3.32Å; N62-K65 WeakPolarHBondContact OD1-CB 3.45Å; N62-K65 WeakPolarHBondContact OD1-CG 3.26Å; N62-K65 PolarHBondContact OD1-N 3.25Å; K65-D68 PolarHBondContact O-N 3.46Å; K65-H69 WeakPolarHBondContact O-CB 3.18Å; K65-H69 PolarHBondContact O-N 3.02Å
66	E	94.9	Very high	94.6	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-44	174.1	-71.5	171.5	-148.5	0	0	111.1	H52 L55 R56 H61 N62 H69 L70	H52-E66 PolarHBondContact CE1-O 3.2Å; L55-E66 HydrophobicContact CB-CG 4.27Å; L55-E66 HydrophobicContact CD1-CG 4.37Å; R56-E66 WeakPolarHBondContact CD-OE2 3.45Å; R56-E66 IonicContact CZ-OE2 3.49Å; R56-E66 IonicContact NE-OE2 2.8Å; R56-E66 IonicContact NH1-OE2 3.18Å; R56-E66 PolarHBondContact NH1-OE2 3.09Å; H61-E66 VanDerWaalsContact CA-OE1 3.26Å; H61-E66 WeakPolarHBondContact CA-OE1 3.39Å; H61-E66 IonicContact CG-OE1 3.9Å; H61-E66 IonicContact ND1-OE1 3.71Å; H61-E66 PolarHBondContact ND1-OE1 3.13Å; H61-E66 IonicContact ND1-OE2 3.72Å; H61-E66 PolarHBondContact ND1-OE2 3.24Å; N62-E66 PolarHBondContact N-OE1 3.45Å; N62-E66 WeakPolarHBondContact O-CB 2.99Å; N62-E66 WeakPolarHBondContact O-CG 3.47Å; N62-E66 PolarHBondContact O-N 3.44Å; E66-H69 PolarHBondContact O-N 3.14Å; E66-L70 WeakPolarHBondContact O-CB 3.27Å; E66-L70 PolarHBondContact O-N 3.5Å
67	T	94.6	Very high	94.6	Very high	75 Å²	75	44.8 Å²	44.8	46%	0.46	23%	0.232	S	C	.	.	H	α-helix	trans	-64.1	-44.2	177.6	-61.9	0	0	0	0	111.7	Q63 A64 H69 L70 N71	Q63-T67 WeakPolarHBondContact O-CB 3.32Å; Q63-T67 PolarHBondContact O-N 3.19Å; Q63-T67 PolarHBondContact O-OG1 3.38Å; A64-T67 PolarHBondContact O-N 2.83Å; T67-H69 VanDerWaalsContact C-N 3.32Å; T67-H69 PolarHBondContact O-N 3.23Å; T67-L70 WeakPolarHBondContact O-CB 3.2Å; T67-L70 PolarHBondContact O-N 3.42Å; T67-N71 PolarHBondContact O-N 3.26Å; T67-N71 PolarHBondContact O-ND2 3.33Å
68	D	95.7	Very high	94.7	Very high	92 Å²	92	46.1 Å²	46.1	49%	0.492	24%	0.238	S	C	.	.	H	α-helix	trans	-60.1	-43.5	175.9	-75.1	-13.7	0	0	0	111.4	A64 K65 N71 K72	A64-D68 PolarHBondContact O-N 3.31Å; K65-D68 PolarHBondContact O-N 3.46Å; D68-N71 WeakPolarHBondContact O-CB 3.45Å; D68-N71 PolarHBondContact O-N 3.04Å; D68-K72 PolarHBondContact O-N 3.5Å
69	H	97	Very high	94.9	Very high	9 Å²	9	50.3 Å²	50.3	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-68.9	-37.2	178.3	-168.2	63	0	0	0	112.8	L40 P47 N48 H52 K65 E66 T67 N71 K72 L73	L40-H69 HydrophobicContact CD1-CB 4.02Å; L40-H69 HydrophobicContact CD2-CB 4.23Å; P47-H69 VanDerWaalsContact CB-CE1 3.41Å; P47-H69 WeakPolarHBondContact CB-CE1 3.49Å; N48-H69 PolarHBondContact O-NE2 2.76Å; N48-H69 VanDerWaalsContact O-NE2 3.15Å; H52-H69 AromaticContact CG-CD2 4Å; H52-H69 AromaticContact ND1-CD2 3.54Å; K65-H69 WeakPolarHBondContact O-CB 3.18Å; K65-H69 PolarHBondContact O-N 3.02Å; E66-H69 PolarHBondContact O-N 3.14Å; T67-H69 VanDerWaalsContact C-N 3.32Å; T67-H69 PolarHBondContact O-N 3.23Å; H69-N71 VanDerWaalsContact C-N 3.26Å; H69-N71 PolarHBondContact O-N 3.36Å; H69-K72 WeakPolarHBondContact O-CB 3.48Å; H69-K72 PolarHBondContact O-N 3.29Å; H69-K72 VanDerWaalsContact O-N 3.15Å; H69-L73 WeakPolarHBondContact O-CG 3.41Å; H69-L73 PolarHBondContact O-N 3.11Å
70	L	97.1	Very high	95.2	Very high	21 Å²	21	49.1 Å²	49.1	11%	0.11	26%	0.257	C	S	.	.	H	α-helix	trans	-58.3	-40.7	171.6	-179.5	62.4	0	0	0	111.3	E66 T67 L73 K74 L102	E66-L70 WeakPolarHBondContact O-CB 3.27Å; E66-L70 PolarHBondContact O-N 3.5Å; T67-L70 WeakPolarHBondContact O-CB 3.2Å; T67-L70 PolarHBondContact O-N 3.42Å; L70-L73 WeakPolarHBondContact O-CB 3.2Å; L70-L73 PolarHBondContact O-N 3.23Å; L70-K74 HydrophobicContact CG-CD 4.26Å; L70-K74 WeakPolarHBondContact O-CG 3.48Å; L70-K74 PolarHBondContact O-N 3.48Å; L70-L102 HydrophobicContact CD1-CD2 3.65Å
71	N	96.6	Very high	95.5	Very high	67 Å²	67	47.4 Å²	47.4	36%	0.358	25%	0.249	S	C	.	.	H	α-helix	trans	-65.4	-41.2	175.4	-70.6	-35.6	0	0	0	111.8	T67 D68 H69 L73 K74 N75	T67-N71 PolarHBondContact O-N 3.26Å; T67-N71 PolarHBondContact O-ND2 3.33Å; D68-N71 WeakPolarHBondContact O-CB 3.45Å; D68-N71 PolarHBondContact O-N 3.04Å; H69-N71 VanDerWaalsContact C-N 3.26Å; H69-N71 PolarHBondContact O-N 3.36Å; N71-L73 PolarHBondContact O-N 2.82Å; N71-K74 PolarHBondContact O-N 3.4Å; N71-N75 WeakPolarHBondContact O-CB 3.42Å; N71-N75 VanDerWaalsContact O-CG 3.29Å; N71-N75 PolarHBondContact O-N 3.43Å; N71-N75 PolarHBondContact O-ND2 3.33Å
72	K	96.9	Very high	95.7	Very high	72 Å²	72	48.8 Å²	48.8	31%	0.313	26%	0.255	S	S	.	.	H	α-helix	trans	-60	-43.7	172.3	-66.8	-177.9	-178.9	-180	0	111.7	L40 P47 D68 H69 K74 N75 E76 L77	L40-K72 PolarHBondContact O-NZ 2.94Å; P47-K72 HydrophobicContact CB-CB 3.93Å; P47-K72 HydrophobicContact CG-CB 3.97Å; D68-K72 PolarHBondContact O-N 3.5Å; H69-K72 WeakPolarHBondContact O-CB 3.48Å; H69-K72 PolarHBondContact O-N 3.29Å; H69-K72 VanDerWaalsContact O-N 3.15Å; K72-K74 VanDerWaalsContact C-N 3.33Å; K72-K74 PolarHBondContact O-N 2.88Å; K72-N75 PolarHBondContact O-N 3.15Å; K72-E76 WeakPolarHBondContact O-CB 3.39Å; K72-E76 PolarHBondContact O-N 3.07Å; K72-L77 PolarHBondContact O-N 3.13Å
73	L	97.8	Very high	95.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.271	C	S	.	.	I	π-helix	trans	-58.6	-44.9	175.4	-69.3	173	0	0	0	111.7	P47 P49 H52 H69 L70 N71 N75 L77 H78 Y98 A101	P47-L73 HydrophobicContact CB-CD2 3.8Å; P47-L73 HydrophobicContact CB-CG 4.25Å; P47-L73 HydrophobicContact CG-CD2 4.08Å; P47-L73 VanDerWaalsContact O-CD2 3.3Å; P47-L73 WeakPolarHBondContact O-CD2 3.05Å; P49-L73 HydrophobicContact CB-CD2 3.99Å; H52-L73 HydrophobicContact CB-CD1 3.65Å; H69-L73 WeakPolarHBondContact O-CG 3.41Å; H69-L73 PolarHBondContact O-N 3.11Å; L70-L73 WeakPolarHBondContact O-CB 3.2Å; L70-L73 PolarHBondContact O-N 3.23Å; N71-L73 PolarHBondContact O-N 2.82Å; L73-N75 VanDerWaalsContact C-N 3.26Å; L73-N75 PolarHBondContact O-N 2.8Å; L73-L77 HydrophobicContact CD2-CB 4.26Å; L73-L77 HydrophobicContact CD2-CD2 3.57Å; L73-L77 WeakPolarHBondContact O-CB 3.45Å; L73-H78 PolarHBondContact O-N 3.39Å; L73-Y98 HydrophobicContact CB-CD2 4.37Å; L73-Y98 HydrophobicContact CB-CE2 4.06Å; L73-Y98 WeakPolarHBondContact O-CE2 3.32Å; L73-A101 HydrophobicContact CD1-CB 4.1Å
74	K	97.5	Very high	96	Very high	49 Å²	49	48.6 Å²	48.6	21%	0.213	26%	0.261	C	S	.	.	I	π-helix	trans	-69.1	-21.3	-179.7	-72.8	171.7	62.6	-168.5	0	114.4	L70 N71 K72 H78 Y98 L102 Y107	L70-K74 HydrophobicContact CG-CD 4.26Å; L70-K74 WeakPolarHBondContact O-CG 3.48Å; L70-K74 PolarHBondContact O-N 3.48Å; N71-K74 PolarHBondContact O-N 3.4Å; K72-K74 VanDerWaalsContact C-N 3.33Å; K72-K74 PolarHBondContact O-N 2.88Å; K74-H78 WeakPolarHBondContact O-CB 3.44Å; K74-Y98 WeakPolarHBondContact CA-OH 3.48Å; K74-L102 HydrophobicContact CD-CD2 4.33Å; K74-L102 HydrophobicContact CG-CD2 3.8Å; K74-Y107 HydrophobicContact CD-CE2 4.12Å; K74-Y107 VanDerWaalsContact CE-CZ 3.48Å; K74-Y107 VanDerWaalsContact CE-OH 3.3Å; K74-Y107 WeakPolarHBondContact CE-OH 3.33Å; K74-Y107 VanDerWaalsContact NZ-CZ 3.34Å; K74-Y107 PolarHBondContact NZ-OH 2.89Å
75	N	95.9	Very high	96	Very high	97 Å²	97	46.4 Å²	46.4	52%	0.519	24%	0.24	S	C	.	.	I	π-helix	trans	-103.8	-67.7	-179.2	-65	-28.9	0	0	0	110.8	N71 K72 L73 N79	N71-N75 WeakPolarHBondContact O-CB 3.42Å; N71-N75 VanDerWaalsContact O-CG 3.29Å; N71-N75 PolarHBondContact O-N 3.43Å; N71-N75 PolarHBondContact O-ND2 3.33Å; K72-N75 PolarHBondContact O-N 3.15Å; L73-N75 VanDerWaalsContact C-N 3.26Å; L73-N75 PolarHBondContact O-N 2.8Å; N75-N79 VanDerWaalsContact O-CB 3.25Å; N75-N79 WeakPolarHBondContact O-CB 3.42Å; N75-N79 PolarHBondContact O-N 2.94Å; N75-N79 PolarHBondContact O-ND2 3.03Å
76	E	96.1	Very high	95.9	Very high	90 Å²	90	46.9 Å²	46.9	42%	0.421	25%	0.252	S	S	.	.	I	π-helix	trans	-71.4	-54	-171.5	-61.4	171.1	-150.7	0	0	111.8	P47 K72 H78 N79 D80	P47-E76 HydrophobicContact CG-CB 4.05Å; K72-E76 WeakPolarHBondContact O-CB 3.39Å; K72-E76 PolarHBondContact O-N 3.07Å; E76-H78 PolarHBondContact O-N 3.16Å; E76-N79 PolarHBondContact O-N 3.49Å; E76-D80 PolarHBondContact O-N 3.15Å
77	L	96.7	Very high	95.7	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	28%	0.277	C	S	.	.	I	π-helix	trans	-67.6	-38	179.3	179.3	66.5	0	0	0	111.6	P47 P49 K72 L73 N79 D80 I81 T94 Y98	P47-L77 HydrophobicContact CG-CB 3.98Å; P49-L77 HydrophobicContact CB-CD2 4.09Å; P49-L77 HydrophobicContact CG-CD2 3.81Å; K72-L77 PolarHBondContact O-N 3.13Å; L73-L77 HydrophobicContact CD2-CB 4.26Å; L73-L77 HydrophobicContact CD2-CD2 3.57Å; L73-L77 WeakPolarHBondContact O-CB 3.45Å; L77-N79 VanDerWaalsContact C-N 3.34Å; L77-N79 PolarHBondContact O-N 3.35Å; L77-D80 PolarHBondContact O-N 3.08Å; L77-I81 HydrophobicContact CD1-CD1 4.35Å; L77-I81 HydrophobicContact CD1-CG1 4.34Å; L77-I81 HydrophobicContact CG-CD1 3.97Å; L77-I81 HydrophobicContact CG-CG1 4.4Å; L77-I81 VanDerWaalsContact O-CG1 3.31Å; L77-I81 WeakPolarHBondContact O-CG1 3.3Å; L77-I81 PolarHBondContact O-N 2.9Å; L77-T94 HydrophobicContact CD1-CG2 3.74Å; L77-Y98 HydrophobicContact CD2-CD2 3.93Å; L77-Y98 HydrophobicContact CD2-CG 4.32Å
78	H	97.6	Very high	95.5	Very high	32 Å²	32	53.3 Å²	53.3	15%	0.148	29%	0.292	C	S	.	.	H	α-helix	trans	-56.9	-47.9	173.2	-177.2	80.7	0	0	0	111.7	L73 K74 E76 D80 I81 Q82 S113 F114	L73-H78 PolarHBondContact O-N 3.39Å; K74-H78 WeakPolarHBondContact O-CB 3.44Å; E76-H78 PolarHBondContact O-N 3.16Å; H78-D80 VanDerWaalsContact C-N 3.34Å; H78-D80 PolarHBondContact O-N 3.05Å; H78-I81 PolarHBondContact O-N 2.89Å; H78-Q82 WeakPolarHBondContact O-CB 3.31Å; H78-Q82 PolarHBondContact O-N 3.34Å; H78-S113 PolarHBondContact CE1-O 3.45Å; H78-F114 AromaticContact CE1-CD1 3.67Å; H78-F114 AromaticContact CE1-CE1 3.34Å; H78-F114 WeakPolarHBondContact CE1-CE1 3.31Å; H78-F114 AromaticContact CE1-CZ 3.55Å; H78-F114 AromaticContact ND1-CE1 3.33Å; H78-F114 VanDerWaalsContact ND1-CE1 3.33Å; H78-F114 WeakPolarHBondContact ND1-CE1 3.31Å; H78-F114 AromaticContact ND1-CZ 3.31Å; H78-F114 VanDerWaalsContact ND1-CZ 3.31Å; H78-F114 WeakPolarHBondContact ND1-CZ 3.34Å
79	N	96.6	Very high	95.2	Very high	94 Å²	94	55 Å²	55	50%	0.503	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-35.6	178.1	-73.3	-21.9	0	0	0	112.6	N75 E76 L77 Q82 T83	N75-N79 VanDerWaalsContact O-CB 3.25Å; N75-N79 WeakPolarHBondContact O-CB 3.42Å; N75-N79 PolarHBondContact O-N 2.94Å; N75-N79 PolarHBondContact O-ND2 3.03Å; E76-N79 PolarHBondContact O-N 3.49Å; L77-N79 VanDerWaalsContact C-N 3.34Å; L77-N79 PolarHBondContact O-N 3.35Å; N79-Q82 PolarHBondContact O-N 2.99Å; N79-T83 WeakPolarHBondContact O-CB 3.46Å; N79-T83 PolarHBondContact O-N 2.93Å; N79-T83 PolarHBondContact O-OG1 3.03Å
80	D	96	Very high	94.8	Very high	57 Å²	57	57.9 Å²	57.9	31%	0.305	31%	0.314	S	S	.	.	H	α-helix	trans	-65.6	-45.3	174.3	-179.7	73.7	0	0	0	112	L46 E76 L77 H78 Q82 T83 S84	L46-D80 HydrophobicContact CD1-CB 3.95Å; L46-D80 VanDerWaalsContact CD1-CG 3.42Å; L46-D80 WeakPolarHBondContact CD1-OD2 3.41Å; L46-D80 HydrophobicContact CD2-CB 3.96Å; E76-D80 PolarHBondContact O-N 3.15Å; L77-D80 PolarHBondContact O-N 3.08Å; H78-D80 VanDerWaalsContact C-N 3.34Å; H78-D80 PolarHBondContact O-N 3.05Å; D80-Q82 VanDerWaalsContact C-N 3.33Å; D80-Q82 PolarHBondContact O-N 3.37Å; D80-T83 PolarHBondContact O-N 3.46Å; D80-S84 WeakPolarHBondContact O-CB 3.46Å; D80-S84 PolarHBondContact O-N 3.15Å; D80-S84 PolarHBondContact O-OG 2.61Å; D80-S84 VanDerWaalsContact O-OG 3.13Å
81	I	96.6	Very high	94.7	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-44.4	174.6	-66.1	166.9	0	0	0	110	L77 H78 T83 S84 L85 V91 T94 M95 Y98 F114	L77-I81 HydrophobicContact CD1-CD1 4.35Å; L77-I81 HydrophobicContact CD1-CG1 4.34Å; L77-I81 HydrophobicContact CG-CD1 3.97Å; L77-I81 HydrophobicContact CG-CG1 4.4Å; L77-I81 VanDerWaalsContact O-CG1 3.31Å; L77-I81 WeakPolarHBondContact O-CG1 3.3Å; L77-I81 PolarHBondContact O-N 2.9Å; H78-I81 PolarHBondContact O-N 2.89Å; I81-T83 VanDerWaalsContact C-N 3.34Å; I81-T83 PolarHBondContact O-N 3.27Å; I81-S84 PolarHBondContact O-N 3.26Å; I81-L85 HydrophobicContact CG2-CD1 4.07Å; I81-L85 HydrophobicContact CG2-CG 4.37Å; I81-L85 WeakPolarHBondContact O-CB 3.45Å; I81-L85 VanDerWaalsContact O-CG 3.31Å; I81-L85 WeakPolarHBondContact O-CG 3.44Å; I81-L85 PolarHBondContact O-N 3.06Å; I81-V91 HydrophobicContact CG2-CB 4.34Å; I81-V91 HydrophobicContact CG2-CG1 4.41Å; I81-V91 HydrophobicContact CG2-CG2 4.41Å; I81-T94 HydrophobicContact CD1-CG2 4.09Å; I81-T94 HydrophobicContact CG1-CG2 4.04Å; I81-M95 HydrophobicContact CG2-CE 3.74Å; I81-Y98 HydrophobicContact CD1-CD1 3.96Å; I81-Y98 HydrophobicContact CD1-CG 4.1Å; I81-F114 HydrophobicContact CB-CE1 3.74Å; I81-F114 HydrophobicContact CB-CZ 4.17Å; I81-F114 HydrophobicContact CD1-CZ 4.42Å; I81-F114 HydrophobicContact CG2-CD1 4.09Å; I81-F114 HydrophobicContact CG2-CE1 3.46Å; I81-F114 VanDerWaalsContact CG2-CE1 3.46Å; I81-F114 HydrophobicContact CG2-CZ 3.75Å
82	Q	96.5	Very high	94.8	Very high	37 Å²	37	54 Å²	54	17%	0.173	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-45.5	176.5	177.8	55.5	74.8	0	0	111.3	H78 N79 D80 L85 S86 F114 T115	H78-Q82 WeakPolarHBondContact O-CB 3.31Å; H78-Q82 PolarHBondContact O-N 3.34Å; N79-Q82 PolarHBondContact O-N 2.99Å; D80-Q82 VanDerWaalsContact C-N 3.33Å; D80-Q82 PolarHBondContact O-N 3.37Å; Q82-L85 PolarHBondContact O-N 3.25Å; Q82-S86 PolarHBondContact NE2-OG 3.32Å; Q82-S86 PolarHBondContact O-N 2.96Å; Q82-S86 PolarHBondContact O-OG 3.42Å; Q82-S86 VanDerWaalsContact O-OG 3.12Å; Q82-F114 HydrophobicContact CB-CD1 4.08Å; Q82-F114 HydrophobicContact CB-CE1 4.46Å; Q82-T115 PolarHBondContact NE2-O 3.46Å; Q82-T115 PolarHBondContact OE1-O 3.37Å
83	T	95.4	Very high	94.8	Very high	76 Å²	76	50.7 Å²	50.7	47%	0.466	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-41.2	177.1	-59.8	0	0	0	0	111.5	N79 D80 I81 S86 N87	N79-T83 WeakPolarHBondContact O-CB 3.46Å; N79-T83 PolarHBondContact O-N 2.93Å; N79-T83 PolarHBondContact O-OG1 3.03Å; D80-T83 PolarHBondContact O-N 3.46Å; I81-T83 VanDerWaalsContact C-N 3.34Å; I81-T83 PolarHBondContact O-N 3.27Å; T83-S86 PolarHBondContact O-N 2.84Å; T83-N87 WeakPolarHBondContact O-CB 3.46Å; T83-N87 PolarHBondContact O-N 3.34Å; T83-N87 PolarHBondContact O-ND2 3.43Å
84	S	93.8	Very high	94.7	Very high	19 Å²	19	52.7 Å²	52.7	13%	0.133	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-41.8	176.8	-71.8	0	0	0	0	111.9	D80 I81 N87 S88 K89 V91	D80-S84 WeakPolarHBondContact O-CB 3.46Å; D80-S84 PolarHBondContact O-N 3.15Å; D80-S84 PolarHBondContact O-OG 2.61Å; D80-S84 VanDerWaalsContact O-OG 3.13Å; I81-S84 PolarHBondContact O-N 3.26Å; S84-N87 CarbonylContact O-C 3.18Å; S84-N87 PolarHBondContact O-N 2.93Å; S84-S88 PolarHBondContact O-N 3.15Å; S84-K89 WeakPolarHBondContact O-CB 3.45Å; S84-K89 PolarHBondContact O-N 3.47Å; S84-V91 VanDerWaalsContact CB-CG1 3.45Å
85	L	93.3	Very high	94.7	Very high	15 Å²	15	50.3 Å²	50.3	8%	0.079	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-46.9	173.7	-75.2	170.3	0	0	0	111.9	I81 Q82 N87 S88 V91 M95 F114	I81-L85 HydrophobicContact CG2-CD1 4.07Å; I81-L85 HydrophobicContact CG2-CG 4.37Å; I81-L85 WeakPolarHBondContact O-CB 3.45Å; I81-L85 VanDerWaalsContact O-CG 3.31Å; I81-L85 WeakPolarHBondContact O-CG 3.44Å; I81-L85 PolarHBondContact O-N 3.06Å; Q82-L85 PolarHBondContact O-N 3.25Å; L85-N87 PolarHBondContact O-N 3.44Å; L85-S88 PolarHBondContact O-N 3.4Å; L85-V91 HydrophobicContact CD2-CG2 3.52Å; L85-V91 HydrophobicContact CG-CG2 4.01Å; L85-M95 HydrophobicContact CD1-CE 3.88Å; L85-M95 HydrophobicContact CD2-CE 4.38Å; L85-M95 HydrophobicContact CG-CE 4.49Å; L85-F114 HydrophobicContact CD1-CB 3.75Å; L85-F114 HydrophobicContact CD1-CD1 3.81Å; L85-F114 HydrophobicContact CD1-CG 3.82Å
86	S	92.1	Very high	94.8	Very high	76 Å²	76	45.7 Å²	45.7	53%	0.531	26%	0.257	S	S	.	.	H	α-helix	trans	-60.2	-31.7	176.8	-62.9	0	0	0	0	112.4	Q82 T83 S88	Q82-S86 PolarHBondContact NE2-OG 3.32Å; Q82-S86 PolarHBondContact O-N 2.96Å; Q82-S86 PolarHBondContact O-OG 3.42Å; Q82-S86 VanDerWaalsContact O-OG 3.12Å; T83-S86 PolarHBondContact O-N 2.84Å; S86-S88 VanDerWaalsContact C-N 3.31Å
87	N	90.9	Very high	95	Very high	102 Å²	102	41.9 Å²	41.9	55%	0.545	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	11.6	176.1	-68.7	-51.9	0	0	0	113.9	T83 S84 L85 K89	T83-N87 WeakPolarHBondContact O-CB 3.46Å; T83-N87 PolarHBondContact O-N 3.34Å; T83-N87 PolarHBondContact O-ND2 3.43Å; S84-N87 CarbonylContact O-C 3.18Å; S84-N87 PolarHBondContact O-N 2.93Å; L85-N87 PolarHBondContact O-N 3.44Å; N87-K89 HydrophobicContact CB-CG 4.24Å; N87-K89 PolarHBondContact O-N 3.02Å; N87-K89 VanDerWaalsContact O-N 3.15Å
88	S	88.7	Confident	95.1	Very high	111 Å²	111	41.8 Å²	41.8	78%	0.776	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	30	-178.6	-57.1	0	0	0	0	114.4	S84 L85 S86	S84-S88 PolarHBondContact O-N 3.15Å; L85-S88 PolarHBondContact O-N 3.4Å; S86-S88 VanDerWaalsContact C-N 3.31Å
89	K	89.8	Confident	95.1	Very high	129 Å²	129	40.3 Å²	40.3	56%	0.561	23%	0.232	S	C	*	.			trans	-82.4	150.8	173.4	-63.5	-175.4	-180	-179.2	0	110.4	S84 N87	S84-K89 WeakPolarHBondContact O-CB 3.45Å; S84-K89 PolarHBondContact O-N 3.47Å; N87-K89 HydrophobicContact CB-CG 4.24Å; N87-K89 PolarHBondContact O-N 3.02Å; N87-K89 VanDerWaalsContact O-N 3.15Å
90	T	90.1	Very high	95.2	Very high	69 Å²	69	35.8 Å²	35.8	42%	0.423	21%	0.208	S	C	.	.			trans	-70.6	130.6	175.5	49.3	0	0	0	0	110.5	L145 T146	T90-L145 HydrophobicContact CG2-CB 4.04Å; T90-T146 HydrophobicContact CG2-CG2 4.07Å
91	V	94.9	Very high	95.3	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	19%	0.194	C	C	.	.			trans	-129	6.1	-177.6	-63.2	0	0	0	0	113.3	I81 S84 L85 G93 T94 M95 Q130	I81-V91 HydrophobicContact CG2-CB 4.34Å; I81-V91 HydrophobicContact CG2-CG1 4.41Å; I81-V91 HydrophobicContact CG2-CG2 4.41Å; S84-V91 VanDerWaalsContact CB-CG1 3.45Å; L85-V91 HydrophobicContact CD2-CG2 3.52Å; L85-V91 HydrophobicContact CG-CG2 4.01Å; V91-G93 PolarHBondContact O-N 3.5Å; V91-T94 PolarHBondContact O-N 3.24Å; V91-M95 HydrophobicContact CG2-CE 3.78Å; V91-M95 WeakPolarHBondContact O-CB 3.25Å; V91-M95 PolarHBondContact O-N 2.78Å; V91-Q130 HydrophobicContact CG2-CG 4.36Å
92	T	96.7	Very high	95.4	Very high	1 Å²	1	33 Å²	33	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-48.5	-54.3	-172.8	-50.3	0	0	0	0	112.6	A96 M131 E134	T92-A96 VanDerWaalsContact O-CB 3.24Å; T92-A96 WeakPolarHBondContact O-CB 3.41Å; T92-A96 PolarHBondContact O-N 3.27Å; T92-M131 HydrophobicContact CG2-SD 3.68Å; T92-E134 WeakPolarHBondContact CB-OE1 3.47Å; T92-E134 HydrophobicContact CG2-CG 4.27Å; T92-E134 PolarHBondContact OG1-OE1 3.06Å
93	G	96.9	Very high	95.4	Very high	3 Å²	3	34.2 Å²	34.2	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-47.6	-177.9	0	0	0	0	0	113.4	V91 A96 L97 Q150	V91-G93 PolarHBondContact O-N 3.5Å; G93-A96 PolarHBondContact O-N 2.97Å; G93-L97 PolarHBondContact O-N 3.48Å; G93-Q150 VanDerWaalsContact CA-OE1 3.31Å
94	T	96.7	Very high	95.5	Very high	41 Å²	41	30.6 Å²	30.6	25%	0.252	18%	0.176	S	C	.	.	H	α-helix	trans	-64.9	-42.9	-179.5	-51	0	0	0	0	111.4	L77 I81 V91 A96 L97 Y98	L77-T94 HydrophobicContact CD1-CG2 3.74Å; I81-T94 HydrophobicContact CD1-CG2 4.09Å; I81-T94 HydrophobicContact CG1-CG2 4.04Å; V91-T94 PolarHBondContact O-N 3.24Å; T94-A96 VanDerWaalsContact C-N 3.33Å; T94-A96 PolarHBondContact O-N 3.08Å; T94-L97 PolarHBondContact O-N 3.16Å; T94-Y98 VanDerWaalsContact O-CB 3.29Å; T94-Y98 WeakPolarHBondContact O-CB 3.38Å; T94-Y98 PolarHBondContact O-N 3.3Å
95	M	97.5	Very high	95.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-37.7	176.7	-174.4	177	-76.1	0	0	111.9	I81 L85 V91 S99 F114 L123 H126 L127 Q130	I81-M95 HydrophobicContact CG2-CE 3.74Å; L85-M95 HydrophobicContact CD1-CE 3.88Å; L85-M95 HydrophobicContact CD2-CE 4.38Å; L85-M95 HydrophobicContact CG-CE 4.49Å; V91-M95 HydrophobicContact CG2-CE 3.78Å; V91-M95 WeakPolarHBondContact O-CB 3.25Å; V91-M95 PolarHBondContact O-N 2.78Å; M95-S99 WeakPolarHBondContact O-CB 3.27Å; M95-S99 PolarHBondContact O-N 3.23Å; M95-S99 PolarHBondContact O-OG 2.88Å; M95-F114 HydrophobicContact CE-CD2 4.27Å; M95-F114 HydrophobicContact CE-CE2 4.24Å; M95-L123 HydrophobicContact CG-CD1 3.43Å; M95-L123 VanDerWaalsContact CG-CD1 3.43Å; M95-L123 HydrophobicContact SD-CD1 4.11Å; M95-H126 HydrophobicContact CE-CB 4.1Å; M95-H126 HydrophobicContact SD-CB 3.98Å; M95-L127 HydrophobicContact CB-CD1 4.46Å; M95-L127 HydrophobicContact CG-CB 4.38Å; M95-L127 HydrophobicContact CG-CD1 4.29Å; M95-L127 HydrophobicContact SD-CB 3.93Å; M95-L127 HydrophobicContact SD-CD1 4.32Å; M95-Q130 HydrophobicContact SD-CG 4.46Å
96	A	98.6	Very high	95.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-46.8	175.2	0	0	0	0	0	111.8	T92 G93 T94 Y98 S99 L100 L127 L153 A157	T92-A96 VanDerWaalsContact O-CB 3.24Å; T92-A96 WeakPolarHBondContact O-CB 3.41Å; T92-A96 PolarHBondContact O-N 3.27Å; G93-A96 PolarHBondContact O-N 2.97Å; T94-A96 VanDerWaalsContact C-N 3.33Å; T94-A96 PolarHBondContact O-N 3.08Å; A96-Y98 PolarHBondContact O-N 3.3Å; A96-S99 WeakPolarHBondContact O-CB 3.36Å; A96-S99 PolarHBondContact O-N 2.96Å; A96-L100 WeakPolarHBondContact O-CG 3.29Å; A96-L100 PolarHBondContact O-N 3.21Å; A96-L127 HydrophobicContact CB-CD1 4.41Å; A96-L153 HydrophobicContact CB-CB 4.3Å; A96-L153 HydrophobicContact CB-CD2 4.41Å; A96-L153 HydrophobicContact CB-CG 3.76Å; A96-A157 HydrophobicContact CB-CB 3.77Å
97	L	98.7	Very high	95.7	Very high	10 Å²	10	32.5 Å²	32.5	5%	0.052	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-41.1	174.7	-72.4	169.3	0	0	0	112.4	P49 G93 T94 S99 L100 A101 L153 L375	P49-L97 HydrophobicContact CB-CB 4.04Å; P49-L97 HydrophobicContact CG-CB 3.63Å; G93-L97 PolarHBondContact O-N 3.48Å; T94-L97 PolarHBondContact O-N 3.16Å; L97-S99 VanDerWaalsContact C-N 3.29Å; L97-S99 PolarHBondContact O-N 3.15Å; L97-L100 HydrophobicContact CD2-CD1 4.43Å; L97-L100 PolarHBondContact O-N 3.09Å; L97-A101 WeakPolarHBondContact O-CB 3.4Å; L97-A101 PolarHBondContact O-N 2.76Å; L97-L153 HydrophobicContact CD1-CD2 4.1Å; L97-L153 HydrophobicContact CD2-CD1 4.12Å; L97-L153 HydrophobicContact CD2-CD2 3.9Å; L97-L153 HydrophobicContact CD2-CG 4.5Å; L97-L153 HydrophobicContact CG-CD2 3.58Å; L97-L153 HydrophobicContact CG-CG 4.42Å; L97-L375 HydrophobicContact CD1-CD1 3.49Å; L97-L375 VanDerWaalsContact CD1-CD1 3.49Å
98	Y	98.6	Very high	95.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.5	-43.8	174.7	179.4	-126.5	0	0	0	111.1	L73 K74 L77 I81 T94 A96 L100 A101 L102 I112 F114 L123	L73-Y98 HydrophobicContact CB-CD2 4.37Å; L73-Y98 HydrophobicContact CB-CE2 4.06Å; L73-Y98 WeakPolarHBondContact O-CE2 3.32Å; K74-Y98 WeakPolarHBondContact CA-OH 3.48Å; L77-Y98 HydrophobicContact CD2-CD2 3.93Å; L77-Y98 HydrophobicContact CD2-CG 4.32Å; I81-Y98 HydrophobicContact CD1-CD1 3.96Å; I81-Y98 HydrophobicContact CD1-CG 4.1Å; T94-Y98 VanDerWaalsContact O-CB 3.29Å; T94-Y98 WeakPolarHBondContact O-CB 3.38Å; T94-Y98 PolarHBondContact O-N 3.3Å; A96-Y98 PolarHBondContact O-N 3.3Å; Y98-L100 PolarHBondContact O-N 3.47Å; Y98-A101 PolarHBondContact O-N 3.08Å; Y98-L102 HydrophobicContact CD1-CD1 4.22Å; Y98-L102 HydrophobicContact CD2-CD1 4.32Å; Y98-L102 HydrophobicContact CD2-CG 4.13Å; Y98-L102 HydrophobicContact CE1-CD1 3.74Å; Y98-L102 HydrophobicContact CE2-CD1 3.84Å; Y98-L102 HydrophobicContact CE2-CD2 3.89Å; Y98-L102 HydrophobicContact CE2-CG 3.8Å; Y98-L102 HydrophobicContact CG-CD1 4.49Å; Y98-L102 VanDerWaalsContact O-CG 3.31Å; Y98-L102 WeakPolarHBondContact O-CG 3.33Å; Y98-L102 PolarHBondContact O-N 3.19Å; Y98-I112 HydrophobicContact CE1-CG2 4.09Å; Y98-F114 HydrophobicContact CD1-CZ 4.29Å; Y98-F114 HydrophobicContact CE1-CE2 4.49Å; Y98-F114 HydrophobicContact CE1-CZ 4Å; Y98-L123 HydrophobicContact CD1-CD1 4.18Å; Y98-L123 HydrophobicContact CD1-CD2 4.18Å; Y98-L123 HydrophobicContact CE1-CD2 4.27Å
99	S	98.6	Very high	96.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.3	-44.1	174.7	-55	0	0	0	0	112.1	M95 A96 L97 K103	M95-S99 WeakPolarHBondContact O-CB 3.27Å; M95-S99 PolarHBondContact O-N 3.23Å; M95-S99 PolarHBondContact O-OG 2.88Å; A96-S99 WeakPolarHBondContact O-CB 3.36Å; A96-S99 PolarHBondContact O-N 2.96Å; L97-S99 VanDerWaalsContact C-N 3.29Å; L97-S99 PolarHBondContact O-N 3.15Å; S99-K103 VanDerWaalsContact O-CB 3.25Å; S99-K103 WeakPolarHBondContact O-CB 3.33Å; S99-K103 PolarHBondContact O-N 2.81Å
100	L	98.7	Very high	96.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.3	-43.7	177.7	-68.2	174.6	0	0	0	112.1	L53 A96 L97 Y98 K103 S104 L153 A157 V160	L53-L100 HydrophobicContact CD1-CB 4.29Å; L53-L100 HydrophobicContact CD2-CB 3.87Å; L53-L100 HydrophobicContact CD2-CD1 4.08Å; A96-L100 WeakPolarHBondContact O-CG 3.29Å; A96-L100 PolarHBondContact O-N 3.21Å; L97-L100 HydrophobicContact CD2-CD1 4.43Å; L97-L100 PolarHBondContact O-N 3.09Å; Y98-L100 PolarHBondContact O-N 3.47Å; L100-K103 PolarHBondContact O-N 3.03Å; L100-S104 WeakPolarHBondContact O-CB 3.45Å; L100-S104 PolarHBondContact O-N 2.97Å; L100-S104 PolarHBondContact O-OG 3.49Å; L100-L153 HydrophobicContact CD1-CD1 3.78Å; L100-A157 HydrophobicContact CD2-CB 4.3Å; L100-A157 HydrophobicContact CG-CB 4.17Å; L100-V160 HydrophobicContact CD2-CG2 3.32Å
101	A	98.4	Very high	96.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.7	-41.4	179.6	0	0	0	0	0	112.8	P49 H52 L73 L97 Y98 S104 S105	P49-A101 HydrophobicContact CB-CB 3.88Å; P49-A101 WeakPolarHBondContact O-CB 3.31Å; H52-A101 HydrophobicContact CB-CB 4.24Å; L73-A101 HydrophobicContact CD1-CB 4.1Å; L97-A101 WeakPolarHBondContact O-CB 3.4Å; L97-A101 PolarHBondContact O-N 2.76Å; Y98-A101 PolarHBondContact O-N 3.08Å; A101-S104 WeakPolarHBondContact CA-OG 3.48Å; A101-S104 PolarHBondContact O-OG 2.8Å; A101-S105 PolarHBondContact O-N 3.26Å; A101-S105 PolarHBondContact O-OG 3.47Å
102	L	98.1	Very high	96.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-45	173.8	-69.9	-177.8	0	0	0	111	L70 K74 Y98 S104 S105 C106 Y107 L109 I112 L123	L70-L102 HydrophobicContact CD1-CD2 3.65Å; K74-L102 HydrophobicContact CD-CD2 4.33Å; K74-L102 HydrophobicContact CG-CD2 3.8Å; Y98-L102 HydrophobicContact CD1-CD1 4.22Å; Y98-L102 HydrophobicContact CD2-CD1 4.32Å; Y98-L102 HydrophobicContact CD2-CG 4.13Å; Y98-L102 HydrophobicContact CE1-CD1 3.74Å; Y98-L102 HydrophobicContact CE2-CD1 3.84Å; Y98-L102 HydrophobicContact CE2-CD2 3.89Å; Y98-L102 HydrophobicContact CE2-CG 3.8Å; Y98-L102 HydrophobicContact CG-CD1 4.49Å; Y98-L102 VanDerWaalsContact O-CG 3.31Å; Y98-L102 WeakPolarHBondContact O-CG 3.33Å; Y98-L102 PolarHBondContact O-N 3.19Å; L102-S104 VanDerWaalsContact C-N 3.33Å; L102-S104 PolarHBondContact O-N 3.05Å; L102-S105 CarbonylContact O-C 3.46Å; L102-S105 PolarHBondContact O-N 3.43Å; L102-C106 PolarHBondContact O-N 3Å; L102-Y107 HydrophobicContact CD2-CD1 4.45Å; L102-Y107 VanDerWaalsContact O-CB 3.3Å; L102-Y107 WeakPolarHBondContact O-CB 2.86Å; L102-Y107 PolarHBondContact O-N 3.01Å; L102-Y107 VanDerWaalsContact O-N 3.08Å; L102-L109 HydrophobicContact CB-CD2 3.36Å; L102-L109 HydrophobicContact CD1-CD2 3.79Å; L102-L109 HydrophobicContact CG-CD2 4.27Å; L102-I112 HydrophobicContact CD1-CG1 3.86Å; L102-L123 HydrophobicContact CD1-CD2 3.86Å
103	K	97.4	Very high	96.5	Very high	62 Å²	62	29.2 Å²	29.2	27%	0.27	16%	0.163	S	C	.	.	H	α-helix	trans	-64.2	-37.7	179.3	-177.4	59.2	-175.5	156.4	0	112.1	S99 L100 S105 C106 L109 V297	S99-K103 VanDerWaalsContact O-CB 3.25Å; S99-K103 WeakPolarHBondContact O-CB 3.33Å; S99-K103 PolarHBondContact O-N 2.81Å; L100-K103 PolarHBondContact O-N 3.03Å; K103-S105 PolarHBondContact O-N 3.46Å; K103-C106 PolarHBondContact O-N 2.88Å; K103-L109 HydrophobicContact CB-CD1 4.3Å; K103-V297 HydrophobicContact CB-CG1 3.9Å; K103-V297 HydrophobicContact CG-CG1 3.56Å
104	S	96.8	Very high	96.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-5.9	174.6	69.6	0	0	0	0	113.7	R56 L100 A101 L102 L300	R56-S104 WeakPolarHBondContact CB-O 3.46Å; R56-S104 WeakPolarHBondContact CB-OG 3.26Å; R56-S104 PolarHBondContact NE-O 3.29Å; L100-S104 WeakPolarHBondContact O-CB 3.45Å; L100-S104 PolarHBondContact O-N 2.97Å; L100-S104 PolarHBondContact O-OG 3.49Å; A101-S104 WeakPolarHBondContact CA-OG 3.48Å; A101-S104 PolarHBondContact O-OG 2.8Å; L102-S104 VanDerWaalsContact C-N 3.33Å; L102-S104 PolarHBondContact O-N 3.05Å; S104-L300 WeakPolarHBondContact O-CD2 3.17Å
105	S	95.6	Very high	96.2	Very high	24 Å²	24	30.4 Å²	30.4	17%	0.168	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	16.9	171.4	-44.6	0	0	0	0	111.3	H52 A101 L102 K103 Y107	H52-S105 PolarHBondContact NE2-OG 3.29Å; A101-S105 PolarHBondContact O-N 3.26Å; A101-S105 PolarHBondContact O-OG 3.47Å; L102-S105 CarbonylContact O-C 3.46Å; L102-S105 PolarHBondContact O-N 3.43Å; K103-S105 PolarHBondContact O-N 3.46Å; S105-Y107 PolarHBondContact O-N 2.92Å
106	C	94.1	Very high	95.4	Very high	56 Å²	56	30.7 Å²	30.7	38%	0.378	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	27.3	-175.2	-57.5	0	0	0	0	114.6	L102 K103 C302	L102-C106 PolarHBondContact O-N 3Å; K103-C106 PolarHBondContact O-N 2.88Å; C106-C302 HydrophobicContact CB-CB 3.61Å; C106-C302 WeakPolarHBondContact CB-SG 3.46Å; C106-C302 PolarHBondContact N-SG 3.34Å; C106-C302 VanDerWaalsContact N-SG 3.42Å; C106-C302 WeakPolarHBondContact SG-CB 3.44Å; C106-C302 PolarHBondContact SG-N 2.8Å; C106-C302 VanDerWaalsContact SG-N 3.35Å; C106-C302 CovalentContact SG-SG 2.03Å; C106-C302 PolarHBondContact SG-SG 3.26Å
107	Y	94.4	Very high	94.4	Very high	70 Å²	70	37.5 Å²	37.5	28%	0.275	21%	0.209	S	C	.	.			trans	-74.9	139.6	179.5	-160.8	-93	0	0	0	110.8	K74 L102 S105 L109 T111 I112	K74-Y107 HydrophobicContact CD-CE2 4.12Å; K74-Y107 VanDerWaalsContact CE-CZ 3.48Å; K74-Y107 VanDerWaalsContact CE-OH 3.3Å; K74-Y107 WeakPolarHBondContact CE-OH 3.33Å; K74-Y107 VanDerWaalsContact NZ-CZ 3.34Å; K74-Y107 PolarHBondContact NZ-OH 2.89Å; L102-Y107 HydrophobicContact CD2-CD1 4.45Å; L102-Y107 VanDerWaalsContact O-CB 3.3Å; L102-Y107 WeakPolarHBondContact O-CB 2.86Å; L102-Y107 PolarHBondContact O-N 3.01Å; L102-Y107 VanDerWaalsContact O-N 3.08Å; S105-Y107 PolarHBondContact O-N 2.92Å; Y107-L109 PolarHBondContact O-N 3.45Å; Y107-L109 VanDerWaalsContact O-N 3.13Å; Y107-T111 WeakPolarHBondContact CE1-OG1 3.48Å; Y107-I112 HydrophobicContact CD1-CD1 4.29Å; Y107-I112 HydrophobicContact CD1-CG1 4.18Å; Y107-I112 HydrophobicContact CE1-CD1 3.51Å; Y107-I112 HydrophobicContact CE1-CG1 3.8Å
108	D	93.1	Very high	93.5	Very high	85 Å²	85	44.8 Å²	44.8	46%	0.455	25%	0.248	S	C	.	.			trans	-74.4	104.8	177	-178.7	10	0	0	0	110.9	N110 T111	D108-N110 PolarHBondContact O-N 3.21Å; D108-N110 WeakPolarHBondContact OD1-CB 3.28Å; D108-N110 PolarHBondContact OD1-N 2.95Å; D108-N110 PolarHBondContact OD1-ND2 3.26Å; D108-T111 HydrophobicContact CB-CG2 4.02Å; D108-T111 PolarHBondContact O-N 3.4Å; D108-T111 VanDerWaalsContact O-N 3.1Å; D108-T111 PolarHBondContact O-OG1 3.25Å
109	L	94.8	Very high	92.9	Very high	10 Å²	10	51.4 Å²	51.4	5%	0.052	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-65.9	-16.1	-178.3	-55.8	-172.6	0	0	0	113.5	L102 K103 Y107 T111 I112 L123 L124	L102-L109 HydrophobicContact CB-CD2 3.36Å; L102-L109 HydrophobicContact CD1-CD2 3.79Å; L102-L109 HydrophobicContact CG-CD2 4.27Å; K103-L109 HydrophobicContact CB-CD1 4.3Å; Y107-L109 PolarHBondContact O-N 3.45Å; Y107-L109 VanDerWaalsContact O-N 3.13Å; L109-T111 PolarHBondContact O-N 3.29Å; L109-I112 PolarHBondContact O-N 2.92Å; L109-L123 HydrophobicContact CD2-CD2 4.22Å; L109-L124 HydrophobicContact CB-CD1 4.03Å; L109-L124 HydrophobicContact CB-CG 4.22Å; L109-L124 HydrophobicContact CD1-CD1 3.95Å; L109-L124 HydrophobicContact CD1-CD2 3.9Å; L109-L124 HydrophobicContact CD1-CG 4.13Å
110	N	92.7	Very high	92.5	Very high	109 Å²	109	55 Å²	55	58%	0.583	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-72.1	-19.6	175.1	-60.5	-58.2	0	0	0	112.6	D108 I112	D108-N110 PolarHBondContact O-N 3.21Å; D108-N110 WeakPolarHBondContact OD1-CB 3.28Å; D108-N110 PolarHBondContact OD1-N 2.95Å; D108-N110 PolarHBondContact OD1-ND2 3.26Å; N110-I112 VanDerWaalsContact C-N 3.32Å
111	T	94.2	Very high	92.3	Very high	79 Å²	79	57.3 Å²	57.3	49%	0.485	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-82.7	-10.2	177.6	69.2	0	0	0	0	113.2	Y107 D108 L109	Y107-T111 WeakPolarHBondContact CE1-OG1 3.48Å; D108-T111 HydrophobicContact CB-CG2 4.02Å; D108-T111 PolarHBondContact O-N 3.4Å; D108-T111 VanDerWaalsContact O-N 3.1Å; D108-T111 PolarHBondContact O-OG1 3.25Å; L109-T111 PolarHBondContact O-N 3.29Å
112	I	96.7	Very high	92.2	Very high	14 Å²	14	59.3 Å²	59.3	7%	0.072	33%	0.325	C	S	.	.			trans	-97.9	125.3	178.3	-55.8	-59	0	0	0	109.1	Y98 L102 Y107 L109 N110 F114 T122 L123	Y98-I112 HydrophobicContact CE1-CG2 4.09Å; L102-I112 HydrophobicContact CD1-CG1 3.86Å; Y107-I112 HydrophobicContact CD1-CD1 4.29Å; Y107-I112 HydrophobicContact CD1-CG1 4.18Å; Y107-I112 HydrophobicContact CE1-CD1 3.51Å; Y107-I112 HydrophobicContact CE1-CG1 3.8Å; L109-I112 PolarHBondContact O-N 2.92Å; N110-I112 VanDerWaalsContact C-N 3.32Å; I112-F114 HydrophobicContact CG2-CE2 4.16Å; I112-T122 CarbonylContact O-C 3.54Å; I112-T122 WeakPolarHBondContact O-CA 3.17Å; I112-L123 HydrophobicContact CB-CB 4.07Å; I112-L123 HydrophobicContact CB-CD2 4.4Å; I112-L123 HydrophobicContact CG2-CB 3.95Å; I112-L123 HydrophobicContact CG2-CD2 4.25Å; I112-L123 PolarHBondContact O-N 3.36Å
113	S	96	Very high	92.1	Very high	51 Å²	51	59.3 Å²	59.3	36%	0.357	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.5	179	59.6	0	0	0	0	111.8	H78 E121	H78-S113 PolarHBondContact CE1-O 3.45Å; S113-E121 CarbonylContact C-O 3.37Å; S113-E121 VanDerWaalsContact CA-O 3.23Å; S113-E121 WeakPolarHBondContact CA-O 3.23Å; S113-E121 WeakPolarHBondContact CB-O 3.25Å
114	F	95.6	Very high	92.1	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	147.1	168.4	-63.9	-90.9	0	0	0	109.4	H78 I81 Q82 L85 M95 Y98 I112 S120 E121 L123 H126	H78-F114 AromaticContact CE1-CD1 3.67Å; H78-F114 AromaticContact CE1-CE1 3.34Å; H78-F114 WeakPolarHBondContact CE1-CE1 3.31Å; H78-F114 AromaticContact CE1-CZ 3.55Å; H78-F114 AromaticContact ND1-CE1 3.33Å; H78-F114 VanDerWaalsContact ND1-CE1 3.33Å; H78-F114 WeakPolarHBondContact ND1-CE1 3.31Å; H78-F114 AromaticContact ND1-CZ 3.31Å; H78-F114 VanDerWaalsContact ND1-CZ 3.31Å; H78-F114 WeakPolarHBondContact ND1-CZ 3.34Å; I81-F114 HydrophobicContact CB-CE1 3.74Å; I81-F114 HydrophobicContact CB-CZ 4.17Å; I81-F114 HydrophobicContact CD1-CZ 4.42Å; I81-F114 HydrophobicContact CG2-CD1 4.09Å; I81-F114 HydrophobicContact CG2-CE1 3.46Å; I81-F114 VanDerWaalsContact CG2-CE1 3.46Å; I81-F114 HydrophobicContact CG2-CZ 3.75Å; Q82-F114 HydrophobicContact CB-CD1 4.08Å; Q82-F114 HydrophobicContact CB-CE1 4.46Å; L85-F114 HydrophobicContact CD1-CB 3.75Å; L85-F114 HydrophobicContact CD1-CD1 3.81Å; L85-F114 HydrophobicContact CD1-CG 3.82Å; M95-F114 HydrophobicContact CE-CD2 4.27Å; M95-F114 HydrophobicContact CE-CE2 4.24Å; Y98-F114 HydrophobicContact CD1-CZ 4.29Å; Y98-F114 HydrophobicContact CE1-CE2 4.49Å; Y98-F114 HydrophobicContact CE1-CZ 4Å; I112-F114 HydrophobicContact CG2-CE2 4.16Å; F114-S120 WeakPolarHBondContact O-CA 3.43Å; F114-E121 PolarHBondContact N-O 2.86Å; F114-E121 PolarHBondContact O-N 2.94Å; F114-L123 HydrophobicContact CD2-CD1 4.46Å; F114-L123 HydrophobicContact CE2-CB 4.17Å; F114-L123 HydrophobicContact CE2-CD1 3.62Å; F114-L123 HydrophobicContact CE2-CG 4.43Å; F114-L123 HydrophobicContact CZ-CD1 4.43Å; F114-H126 PolarHBondContact O-NE2 2.99Å
115	T	90.8	Very high	92	Very high	68 Å²	68	60 Å²	60	42%	0.417	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.5	175.2	-57.5	0	0	0	0	109.4	Q82 K119	Q82-T115 PolarHBondContact NE2-O 3.46Å; Q82-T115 PolarHBondContact OE1-O 3.37Å; T115-K119 WeakPolarHBondContact CA-O 3.33Å
116	A	81	Confident	92	Very high	7 Å²	7	58.9 Å²	58.9	6%	0.058	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	133.1	172.5	0	0	0	0	0	109.6	D118 K119	A116-D118 VanDerWaalsContact C-N 3.33Å; A116-D118 PolarHBondContact O-N 2.79Å; A116-K119 PolarHBondContact N-O 3.34Å; A116-K119 PolarHBondContact O-N 3.01Å; A116-K119 VanDerWaalsContact O-N 3.16Å
117	N	77.6	Confident	92.2	Very high	142 Å²	142	56.2 Å²	56.2	76%	0.759	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	50.6	-178	-54.6	-22.1	0	0	0	112.1	K119	N117-K119 PolarHBondContact O-N 3.33Å
118	D	79.4	Confident	92.3	Very high	163 Å²	163	57.9 Å²	57.9	87%	0.872	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	16	-179.9	-52.5	-43.7	0	0	0	115.7	A116	A116-D118 VanDerWaalsContact C-N 3.33Å; A116-D118 PolarHBondContact O-N 2.79Å
119	K	86.8	Confident	92.4	Very high	139 Å²	139	57 Å²	57	60%	0.604	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.2	174.2	-65.9	-175.4	-178.3	-177.4	0	110.6	T115 A116 N117	T115-K119 WeakPolarHBondContact CA-O 3.33Å; A116-K119 PolarHBondContact N-O 3.34Å; A116-K119 PolarHBondContact O-N 3.01Å; A116-K119 VanDerWaalsContact O-N 3.16Å; N117-K119 PolarHBondContact O-N 3.33Å
120	S	91.3	Very high	92.4	Very high	75 Å²	75	57 Å²	57	52%	0.524	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.8	168.3	-175.9	0	0	0	0	109.3	F114	F114-S120 WeakPolarHBondContact O-CA 3.43Å
121	E	93.1	Very high	92.7	Very high	49 Å²	49	52 Å²	52	23%	0.229	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	153.5	174.8	-52.7	173.2	151.9	0	0	108.8	S113 F114 T125 H126 R129	S113-E121 CarbonylContact C-O 3.37Å; S113-E121 VanDerWaalsContact CA-O 3.23Å; S113-E121 WeakPolarHBondContact CA-O 3.23Å; S113-E121 WeakPolarHBondContact CB-O 3.25Å; F114-E121 PolarHBondContact N-O 2.86Å; F114-E121 PolarHBondContact O-N 2.94Å; E121-T125 HydrophobicContact CB-CG2 4.03Å; E121-T125 HydrophobicContact CG-CG2 4.46Å; E121-H126 PolarHBondContact O-CD2 3.43Å; E121-H126 VanDerWaalsContact O-CD2 3.26Å; E121-H126 IonicContact OE2-CE1 3.67Å; E121-H126 IonicContact OE2-ND1 2.81Å; E121-H126 IonicContact OE2-NE2 3.68Å; E121-R129 IonicContact OE1-NH1 2.73Å; E121-R129 IonicContact OE2-CZ 3.88Å; E121-R129 VanDerWaalsContact OE2-CZ 3.32Å; E121-R129 IonicContact OE2-NE 2.65Å; E121-R129 IonicContact OE2-NH1 3.5Å; E121-R129 PolarHBondContact OE2-NH1 3.49Å
122	T	95.9	Very high	92.8	Very high	43 Å²	43	50.4 Å²	50.4	26%	0.264	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	155.8	177.2	61.4	0	0	0	0	111.3	I112 L124 T125 H126	I112-T122 CarbonylContact O-C 3.54Å; I112-T122 WeakPolarHBondContact O-CA 3.17Å; T122-L124 VanDerWaalsContact C-N 3.3Å; T122-L124 PolarHBondContact O-N 3.46Å; T122-T125 WeakPolarHBondContact O-CA 3.34Å; T122-T125 WeakPolarHBondContact O-CB 3.29Å; T122-T125 PolarHBondContact O-N 3.32Å; T122-T125 WeakPolarHBondContact OG1-CB 3.5Å; T122-T125 PolarHBondContact OG1-OG1 2.74Å; T122-H126 PolarHBondContact O-N 2.85Å
123	L	96.9	Very high	92.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-48.1	-49.9	179.6	165.1	60.7	0	0	0	112.4	M95 Y98 L102 L109 I112 F114 T125 H126 L127	M95-L123 HydrophobicContact CG-CD1 3.43Å; M95-L123 VanDerWaalsContact CG-CD1 3.43Å; M95-L123 HydrophobicContact SD-CD1 4.11Å; Y98-L123 HydrophobicContact CD1-CD1 4.18Å; Y98-L123 HydrophobicContact CD1-CD2 4.18Å; Y98-L123 HydrophobicContact CE1-CD2 4.27Å; L102-L123 HydrophobicContact CD1-CD2 3.86Å; L109-L123 HydrophobicContact CD2-CD2 4.22Å; I112-L123 HydrophobicContact CB-CB 4.07Å; I112-L123 HydrophobicContact CB-CD2 4.4Å; I112-L123 HydrophobicContact CG2-CB 3.95Å; I112-L123 HydrophobicContact CG2-CD2 4.25Å; I112-L123 PolarHBondContact O-N 3.36Å; F114-L123 HydrophobicContact CD2-CD1 4.46Å; F114-L123 HydrophobicContact CE2-CB 4.17Å; F114-L123 HydrophobicContact CE2-CD1 3.62Å; F114-L123 HydrophobicContact CE2-CG 4.43Å; F114-L123 HydrophobicContact CZ-CD1 4.43Å; L123-T125 VanDerWaalsContact C-N 3.32Å; L123-T125 PolarHBondContact O-N 3.5Å; L123-H126 PolarHBondContact O-N 3.19Å; L123-L127 PolarHBondContact O-N 3.43Å
124	L	96.9	Very high	92.8	Very high	12 Å²	12	51.2 Å²	51.2	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-70.6	-29.1	-178.3	-62.1	177.7	0	0	0	112.6	L109 T122 L127 K128 L158 I163	L109-L124 HydrophobicContact CB-CD1 4.03Å; L109-L124 HydrophobicContact CB-CG 4.22Å; L109-L124 HydrophobicContact CD1-CD1 3.95Å; L109-L124 HydrophobicContact CD1-CD2 3.9Å; L109-L124 HydrophobicContact CD1-CG 4.13Å; T122-L124 VanDerWaalsContact C-N 3.3Å; T122-L124 PolarHBondContact O-N 3.46Å; L124-L127 PolarHBondContact O-N 2.91Å; L124-K128 WeakPolarHBondContact O-CG 3.43Å; L124-K128 PolarHBondContact O-N 2.82Å; L124-L158 HydrophobicContact CD2-CD2 4.45Å; L124-I163 HydrophobicContact CB-CG1 4.32Å; L124-I163 HydrophobicContact CD1-CD1 4.01Å; L124-I163 HydrophobicContact CD1-CG1 3.7Å; L124-I163 HydrophobicContact CG-CG1 4.47Å
125	T	95.8	Very high	92.9	Very high	64 Å²	64	52.2 Å²	52.2	39%	0.393	27%	0.269	S	S	.	.	H	α-helix	trans	-69.3	-43.9	174.3	-57.5	0	0	0	0	110.7	E121 T122 L123 K128 R129	E121-T125 HydrophobicContact CB-CG2 4.03Å; E121-T125 HydrophobicContact CG-CG2 4.46Å; T122-T125 WeakPolarHBondContact O-CA 3.34Å; T122-T125 WeakPolarHBondContact O-CB 3.29Å; T122-T125 PolarHBondContact O-N 3.32Å; T122-T125 WeakPolarHBondContact OG1-CB 3.5Å; T122-T125 PolarHBondContact OG1-OG1 2.74Å; L123-T125 VanDerWaalsContact C-N 3.32Å; L123-T125 PolarHBondContact O-N 3.5Å; T125-K128 WeakPolarHBondContact O-CB 3.47Å; T125-K128 PolarHBondContact O-N 2.88Å; T125-R129 PolarHBondContact O-N 2.99Å; T125-R129 VanDerWaalsContact O-N 3.09Å
126	H	95.3	Very high	93.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-45.5	171.8	-90	-79	0	0	0	111.8	M95 F114 E121 T122 L123 K128 R129 Q130	M95-H126 HydrophobicContact CE-CB 4.1Å; M95-H126 HydrophobicContact SD-CB 3.98Å; F114-H126 PolarHBondContact O-NE2 2.99Å; E121-H126 PolarHBondContact O-CD2 3.43Å; E121-H126 VanDerWaalsContact O-CD2 3.26Å; E121-H126 IonicContact OE2-CE1 3.67Å; E121-H126 IonicContact OE2-ND1 2.81Å; E121-H126 IonicContact OE2-NE2 3.68Å; T122-H126 PolarHBondContact O-N 2.85Å; L123-H126 PolarHBondContact O-N 3.19Å; H126-K128 VanDerWaalsContact C-N 3.31Å; H126-K128 PolarHBondContact O-N 3.25Å; H126-R129 PolarHBondContact CE1-NH2 3.18Å; H126-R129 PolarHBondContact ND1-NH2 2.83Å; H126-R129 WeakPolarHBondContact O-CA 3.35Å; H126-R129 WeakPolarHBondContact O-CB 3.49Å; H126-R129 PolarHBondContact O-N 2.93Å; H126-Q130 WeakPolarHBondContact O-CG 3.41Å; H126-Q130 PolarHBondContact O-N 2.95Å
127	L	97.4	Very high	93.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.4	-41.5	179	-176.9	58.3	0	0	0	111.4	M95 A96 L123 L124 R129 Q130 M131 A157 L158	M95-L127 HydrophobicContact CB-CD1 4.46Å; M95-L127 HydrophobicContact CG-CB 4.38Å; M95-L127 HydrophobicContact CG-CD1 4.29Å; M95-L127 HydrophobicContact SD-CB 3.93Å; M95-L127 HydrophobicContact SD-CD1 4.32Å; A96-L127 HydrophobicContact CB-CD1 4.41Å; L123-L127 PolarHBondContact O-N 3.43Å; L124-L127 PolarHBondContact O-N 2.91Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 2.7Å; L127-Q130 PolarHBondContact O-N 2.89Å; L127-M131 VanDerWaalsContact O-CG 3.31Å; L127-M131 WeakPolarHBondContact O-CG 3.45Å; L127-M131 PolarHBondContact O-N 3.42Å; L127-A157 HydrophobicContact CD2-CB 3.87Å; L127-L158 HydrophobicContact CB-CD2 4.15Å; L127-L158 HydrophobicContact CD2-CD2 3.9Å; L127-L158 HydrophobicContact CD2-CG 3.89Å; L127-L158 HydrophobicContact CG-CD1 4.48Å; L127-L158 HydrophobicContact CG-CD2 3.98Å; L127-L158 HydrophobicContact CG-CG 4.03Å
128	K	97.3	Very high	94.7	Very high	105 Å²	105	52 Å²	52	46%	0.457	25%	0.252	S	S	.	.	H	α-helix	trans	-57.7	-43.6	172.2	-72.6	173	72.2	178.7	0	111.9	L124 T125 H126 M131 E132 L158 I163	L124-K128 WeakPolarHBondContact O-CG 3.43Å; L124-K128 PolarHBondContact O-N 2.82Å; T125-K128 WeakPolarHBondContact O-CB 3.47Å; T125-K128 PolarHBondContact O-N 2.88Å; H126-K128 VanDerWaalsContact C-N 3.31Å; H126-K128 PolarHBondContact O-N 3.25Å; K128-M131 PolarHBondContact O-N 3.15Å; K128-E132 WeakPolarHBondContact O-CG 3.4Å; K128-E132 PolarHBondContact O-N 2.99Å; K128-L158 HydrophobicContact CG-CD1 4.02Å; K128-L158 HydrophobicContact CG-CD2 3.71Å; K128-I163 HydrophobicContact CD-CG2 3.88Å; K128-I163 HydrophobicContact CG-CG2 4.34Å
129	R	95	Very high	95.3	Very high	67 Å²	67	47.1 Å²	47.1	25%	0.253	23%	0.234	S	C	.	.	H	α-helix	trans	-64.8	-42.1	178.6	-171.3	176.8	70.4	178.6	14.1	112.2	E121 T125 H126 L127 M131 E132 Q133	E121-R129 IonicContact OE1-NH1 2.73Å; E121-R129 IonicContact OE2-CZ 3.88Å; E121-R129 VanDerWaalsContact OE2-CZ 3.32Å; E121-R129 IonicContact OE2-NE 2.65Å; E121-R129 IonicContact OE2-NH1 3.5Å; E121-R129 PolarHBondContact OE2-NH1 3.49Å; T125-R129 PolarHBondContact O-N 2.99Å; T125-R129 VanDerWaalsContact O-N 3.09Å; H126-R129 PolarHBondContact CE1-NH2 3.18Å; H126-R129 PolarHBondContact ND1-NH2 2.83Å; H126-R129 WeakPolarHBondContact O-CA 3.35Å; H126-R129 WeakPolarHBondContact O-CB 3.49Å; H126-R129 PolarHBondContact O-N 2.93Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 2.7Å; R129-M131 VanDerWaalsContact C-N 3.32Å; R129-M131 PolarHBondContact O-N 3.23Å; R129-E132 WeakPolarHBondContact O-CB 3.47Å; R129-E132 PolarHBondContact O-N 3.31Å; R129-Q133 WeakPolarHBondContact O-CG 3.38Å; R129-Q133 PolarHBondContact O-N 3.27Å
130	Q	95.6	Very high	95.5	Very high	11 Å²	11	49.1 Å²	49.1	5%	0.051	24%	0.243	C	C	.	.	H	α-helix	trans	-59.5	-44.3	172.9	-65.8	-62.8	-45.6	0	0	110.7	V91 M95 H126 L127 E132 Q133 E134	V91-Q130 HydrophobicContact CG2-CG 4.36Å; M95-Q130 HydrophobicContact SD-CG 4.46Å; H126-Q130 WeakPolarHBondContact O-CG 3.41Å; H126-Q130 PolarHBondContact O-N 2.95Å; L127-Q130 PolarHBondContact O-N 2.89Å; Q130-E132 VanDerWaalsContact C-N 3.31Å; Q130-E132 PolarHBondContact O-N 3.41Å; Q130-Q133 WeakPolarHBondContact O-CB 3.37Å; Q130-Q133 PolarHBondContact O-N 3.11Å; Q130-Q133 VanDerWaalsContact O-N 3.13Å; Q130-E134 VanDerWaalsContact O-CG 3.29Å; Q130-E134 WeakPolarHBondContact O-CG 3.46Å; Q130-E134 PolarHBondContact O-N 3.14Å
131	M	97.9	Very high	95.3	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-35.4	176.3	-68.2	-51.9	-56.6	0	0	113.3	T92 L127 K128 R129 K135 Y151 V155 L158 V169	T92-M131 HydrophobicContact CG2-SD 3.68Å; L127-M131 VanDerWaalsContact O-CG 3.31Å; L127-M131 WeakPolarHBondContact O-CG 3.45Å; L127-M131 PolarHBondContact O-N 3.42Å; K128-M131 PolarHBondContact O-N 3.15Å; R129-M131 VanDerWaalsContact C-N 3.32Å; R129-M131 PolarHBondContact O-N 3.23Å; M131-K135 WeakPolarHBondContact O-CB 3.26Å; M131-K135 PolarHBondContact O-N 2.96Å; M131-Y151 HydrophobicContact CE-CD1 3.94Å; M131-Y151 HydrophobicContact CE-CD2 3.64Å; M131-Y151 HydrophobicContact CE-CE1 3.91Å; M131-Y151 HydrophobicContact CE-CE2 3.62Å; M131-Y151 HydrophobicContact CE-CG 3.82Å; M131-Y151 VanDerWaalsContact CE-O 3.3Å; M131-Y151 WeakPolarHBondContact CE-O 3.3Å; M131-V155 HydrophobicContact CE-CG2 3.8Å; M131-L158 HydrophobicContact CG-CD1 3.92Å; M131-V169 HydrophobicContact CB-CG1 4.21Å; M131-V169 HydrophobicContact CB-CG2 4.48Å; M131-V169 HydrophobicContact CE-CG1 3.62Å
132	E	96.8	Very high	95.1	Very high	46 Å²	46	52 Å²	52	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-43.4	172.4	-72.3	-63.8	145.4	0	0	111.7	K128 R129 Q130 K135 Y136 N166	K128-E132 WeakPolarHBondContact O-CG 3.4Å; K128-E132 PolarHBondContact O-N 2.99Å; R129-E132 WeakPolarHBondContact O-CB 3.47Å; R129-E132 PolarHBondContact O-N 3.31Å; Q130-E132 VanDerWaalsContact C-N 3.31Å; Q130-E132 PolarHBondContact O-N 3.41Å; E132-K135 WeakPolarHBondContact O-CB 3.04Å; E132-K135 PolarHBondContact O-N 3.2Å; E132-K135 WeakPolarHBondContact OE2-CE 3.35Å; E132-K135 IonicContact OE2-NZ 2.8Å; E132-K135 PolarHBondContact OE2-NZ 3.24Å; E132-Y136 HydrophobicContact CB-CE2 4.28Å; E132-Y136 WeakPolarHBondContact O-CD2 3.23Å; E132-Y136 PolarHBondContact O-N 3.17Å; E132-N166 PolarHBondContact OE1-ND2 3.22Å
133	Q	95.5	Very high	94.8	Very high	82 Å²	82	53.6 Å²	53.6	38%	0.383	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-45.6	176.2	-69.2	172.7	-18.7	0	0	111.8	R129 Q130 K135 Y136 H137 L145	R129-Q133 WeakPolarHBondContact O-CG 3.38Å; R129-Q133 PolarHBondContact O-N 3.27Å; Q130-Q133 WeakPolarHBondContact O-CB 3.37Å; Q130-Q133 PolarHBondContact O-N 3.11Å; Q130-Q133 VanDerWaalsContact O-N 3.13Å; Q133-K135 VanDerWaalsContact C-N 3.35Å; Q133-K135 PolarHBondContact O-N 3.04Å; Q133-Y136 PolarHBondContact O-N 2.95Å; Q133-H137 PolarHBondContact O-N 3.11Å; Q133-L145 HydrophobicContact CB-CD1 3.87Å
134	E	97.1	Very high	94.7	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-56.9	-47.4	173.8	-66.8	-81.1	-170.6	0	0	111.5	T92 Q130 Y136 H137 I138 P144 L145 T146 Y151	T92-E134 WeakPolarHBondContact CB-OE1 3.47Å; T92-E134 HydrophobicContact CG2-CG 4.27Å; T92-E134 PolarHBondContact OG1-OE1 3.06Å; Q130-E134 VanDerWaalsContact O-CG 3.29Å; Q130-E134 WeakPolarHBondContact O-CG 3.46Å; Q130-E134 PolarHBondContact O-N 3.14Å; E134-Y136 PolarHBondContact O-N 3.37Å; E134-H137 PolarHBondContact O-N 2.82Å; E134-I138 WeakPolarHBondContact O-CG1 3.41Å; E134-I138 PolarHBondContact O-N 3.11Å; E134-P144 WeakPolarHBondContact OE2-CA 3.44Å; E134-P144 WeakPolarHBondContact OE2-CB 3.33Å; E134-L145 WeakPolarHBondContact OE2-CA 3.49Å; E134-L145 WeakPolarHBondContact OE2-CB 3.04Å; E134-L145 PolarHBondContact OE2-N 3.23Å; E134-T146 WeakPolarHBondContact OE1-CB 3.27Å; E134-T146 WeakPolarHBondContact OE1-CG2 3.4Å; E134-T146 PolarHBondContact OE1-OG1 3.41Å; E134-T146 PolarHBondContact OE2-N 3.41Å; E134-T146 VanDerWaalsContact OE2-N 3.16Å; E134-T146 PolarHBondContact OE2-OG1 3.33Å; E134-Y151 HydrophobicContact CB-CD2 3.59Å; E134-Y151 HydrophobicContact CB-CE2 3.64Å; E134-Y151 HydrophobicContact CG-CD2 4.27Å
135	K	97.1	Very high	94.5	Very high	22 Å²	22	56.2 Å²	56.2	10%	0.096	27%	0.267	C	S	.	.	H	α-helix	trans	-59.1	-45.6	176.5	172.2	-175.3	55.7	67.7	0	112	M131 E132 Q133 H137 I138 A139 H168 V169 K172	M131-K135 WeakPolarHBondContact O-CB 3.26Å; M131-K135 PolarHBondContact O-N 2.96Å; E132-K135 WeakPolarHBondContact O-CB 3.04Å; E132-K135 PolarHBondContact O-N 3.2Å; E132-K135 WeakPolarHBondContact OE2-CE 3.35Å; E132-K135 IonicContact OE2-NZ 2.8Å; E132-K135 PolarHBondContact OE2-NZ 3.24Å; Q133-K135 VanDerWaalsContact C-N 3.35Å; Q133-K135 PolarHBondContact O-N 3.04Å; K135-H137 VanDerWaalsContact C-N 3.29Å; K135-H137 PolarHBondContact O-N 3.45Å; K135-I138 PolarHBondContact O-N 3.28Å; K135-A139 PolarHBondContact O-N 3.27Å; K135-H168 HydrophobicContact CD-CB 3.71Å; K135-V169 HydrophobicContact CB-CG2 4.23Å; K135-V169 HydrophobicContact CD-CG2 4.06Å; K135-K172 HydrophobicContact CG-CG 4.04Å
136	Y	96	Very high	94.3	Very high	153 Å²	153	53.6 Å²	53.6	60%	0.6	25%	0.251	S	S	*	.	H	α-helix	trans	-62.1	-40.5	178.9	-76.5	-61.1	0	0	0	111.1	E132 Q133 E134 I138 A139 F140	E132-Y136 HydrophobicContact CB-CE2 4.28Å; E132-Y136 WeakPolarHBondContact O-CD2 3.23Å; E132-Y136 PolarHBondContact O-N 3.17Å; Q133-Y136 PolarHBondContact O-N 2.95Å; E134-Y136 PolarHBondContact O-N 3.37Å; Y136-I138 PolarHBondContact O-N 3.03Å; Y136-A139 WeakPolarHBondContact O-CB 3.17Å; Y136-A139 PolarHBondContact O-N 3.31Å; Y136-A139 VanDerWaalsContact O-N 3.16Å; Y136-F140 PolarHBondContact O-N 3.15Å
137	H	95.1	Very high	94.3	Very high	49 Å²	49	56.3 Å²	56.3	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-65.5	-37.9	175.9	-166.6	-94.9	0	0	0	112.3	Q133 E134 K135 A139 F140 S141 R143 P144 L145	Q133-H137 PolarHBondContact O-N 3.11Å; E134-H137 PolarHBondContact O-N 2.82Å; K135-H137 VanDerWaalsContact C-N 3.29Å; K135-H137 PolarHBondContact O-N 3.45Å; H137-A139 VanDerWaalsContact C-N 3.28Å; H137-A139 PolarHBondContact O-N 2.04Å; H137-F140 PolarHBondContact O-N 3.44Å; H137-S141 PolarHBondContact CE1-OG 2.7Å; H137-S141 PolarHBondContact ND1-OG 3.2Å; H137-S141 WeakPolarHBondContact O-CB 3.37Å; H137-S141 PolarHBondContact O-N 3.19Å; H137-S141 PolarHBondContact O-OG 2.8Å; H137-R143 CarbonylContact C-O 3.49Å; H137-R143 VanDerWaalsContact C-O 3.24Å; H137-R143 PolarHBondContact ND1-O 2.94Å; H137-P144 VanDerWaalsContact ND1-C 3.34Å; H137-P144 PolarHBondContact ND1-O 3.17Å; H137-L145 HydrophobicContact CB-CD1 4.36Å; H137-L145 HydrophobicContact CB-CD2 3.86Å; H137-L145 HydrophobicContact CB-CG 3.56Å; H137-L145 WeakPolarHBondContact CD2-CD2 3.16Å; H137-L145 VanDerWaalsContact CG-CD2 3.48Å; H137-L145 PolarHBondContact ND1-N 2.95Å
138	I	95.8	Very high	94.3	Very high	10 Å²	10	57.4 Å²	57.4	5%	0.051	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-40.4	172	-66.7	164.8	0	0	0	111	E134 K135 Y136 F140 H142 R143 P144 Y148 Y151 K172	E134-I138 WeakPolarHBondContact O-CG1 3.41Å; E134-I138 PolarHBondContact O-N 3.11Å; K135-I138 PolarHBondContact O-N 3.28Å; Y136-I138 PolarHBondContact O-N 3.03Å; I138-F140 VanDerWaalsContact C-N 3.32Å; I138-F140 PolarHBondContact O-N 3.18Å; I138-H142 WeakPolarHBondContact O-CA 3.49Å; I138-H142 PolarHBondContact O-N 3.46Å; I138-R143 VanDerWaalsContact CA-O 3.23Å; I138-R143 WeakPolarHBondContact CA-O 3.02Å; I138-R143 VanDerWaalsContact CG1-C 3.43Å; I138-R143 PolarHBondContact N-O 3.24Å; I138-R143 VanDerWaalsContact N-O 3.15Å; I138-P144 HydrophobicContact CD1-CB 4.28Å; I138-P144 HydrophobicContact CG1-CB 4.17Å; I138-Y148 HydrophobicContact CD1-CE1 3.98Å; I138-Y151 HydrophobicContact CD1-CD2 3.88Å; I138-Y151 HydrophobicContact CD1-CE2 3.51Å; I138-K172 HydrophobicContact CD1-CB 4.13Å; I138-K172 HydrophobicContact CD1-CG 4.5Å; I138-K172 HydrophobicContact CG2-CD 3.93Å; I138-K172 HydrophobicContact CG2-CG 4.28Å
139	A	93	Very high	94.4	Very high	60 Å²	60	54.3 Å²	54.3	50%	0.496	26%	0.255	S	S	.	.	H	α-helix	trans	-64.3	-36.3	-178.8	0	0	0	0	0	112.9	K135 Y136 H137	K135-A139 PolarHBondContact O-N 3.27Å; Y136-A139 WeakPolarHBondContact O-CB 3.17Å; Y136-A139 PolarHBondContact O-N 3.31Å; Y136-A139 VanDerWaalsContact O-N 3.16Å; H137-A139 VanDerWaalsContact C-N 3.28Å; H137-A139 PolarHBondContact O-N 2.04Å
140	F	89.8	Confident	94.5	Very high	182 Å²	182	53 Å²	53	80%	0.798	25%	0.252	S	S	*	.	H	α-helix	trans	-92.3	-35.9	-177.4	179.3	-101.5	0	0	0	113.8	Y136 H137 I138	Y136-F140 PolarHBondContact O-N 3.15Å; H137-F140 PolarHBondContact O-N 3.44Å; I138-F140 VanDerWaalsContact C-N 3.32Å; I138-F140 PolarHBondContact O-N 3.18Å
141	S	88.1	Confident	94.6	Very high	33 Å²	33	52.4 Å²	52.4	23%	0.231	25%	0.25	C	C	.	.	H	α-helix	trans	-111.7	1.1	-172	73.7	0	0	0	0	114.1	H137 R143	H137-S141 PolarHBondContact CE1-OG 2.7Å; H137-S141 PolarHBondContact ND1-OG 3.2Å; H137-S141 WeakPolarHBondContact O-CB 3.37Å; H137-S141 PolarHBondContact O-N 3.19Å; H137-S141 PolarHBondContact O-OG 2.8Å; S141-R143 PolarHBondContact O-N 2.9Å; S141-R143 VanDerWaalsContact O-N 3.13Å; S141-R143 VanDerWaalsContact OG-CG 3.27Å; S141-R143 WeakPolarHBondContact OG-CG 3.42Å; S141-R143 PolarHBondContact OG-N 3.19Å; S141-R143 PolarHBondContact OG-O 3.16Å
142	H	89.2	Confident	94.7	Very high	150 Å²	150	52.3 Å²	52.3	69%	0.694	25%	0.249	S	C	*	.	S	Bend	trans	59.5	14.9	-173.1	-57.2	-70.2	0	0	0	114.8	I138	I138-H142 WeakPolarHBondContact O-CA 3.49Å; I138-H142 PolarHBondContact O-N 3.46Å
143	R	89.6	Confident	94.8	Very high	77 Å²	77	50.2 Å²	50.2	29%	0.291	24%	0.239	S	C	.	.	S	Bend	trans	-147.6	154.1	179.2	62.7	-177.9	173.8	122.4	-4.5	112.7	H137 I138 S141 R393	H137-R143 CarbonylContact C-O 3.49Å; H137-R143 VanDerWaalsContact C-O 3.24Å; H137-R143 PolarHBondContact ND1-O 2.94Å; I138-R143 VanDerWaalsContact CA-O 3.23Å; I138-R143 WeakPolarHBondContact CA-O 3.02Å; I138-R143 VanDerWaalsContact CG1-C 3.43Å; I138-R143 PolarHBondContact N-O 3.24Å; I138-R143 VanDerWaalsContact N-O 3.15Å; S141-R143 PolarHBondContact O-N 2.9Å; S141-R143 VanDerWaalsContact O-N 3.13Å; S141-R143 VanDerWaalsContact OG-CG 3.27Å; S141-R143 WeakPolarHBondContact OG-CG 3.42Å; S141-R143 PolarHBondContact OG-N 3.19Å; S141-R143 PolarHBondContact OG-O 3.16Å; R143-R393 VanDerWaalsContact NH1-CG 3.26Å
144	P	93.5	Very high	94.9	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.032	22%	0.221	C	C	.	.			trans	-62.7	160.9	171	24.6	-32.6	0	0	0	111.9	E134 H137 I138 Y148 Y151	E134-P144 WeakPolarHBondContact OE2-CA 3.44Å; E134-P144 WeakPolarHBondContact OE2-CB 3.33Å; H137-P144 VanDerWaalsContact ND1-C 3.34Å; H137-P144 PolarHBondContact ND1-O 3.17Å; I138-P144 HydrophobicContact CD1-CB 4.28Å; I138-P144 HydrophobicContact CG1-CB 4.17Å; P144-Y148 HydrophobicContact CG-CD1 4.28Å; P144-Y148 HydrophobicContact CG-CD2 4.24Å; P144-Y148 HydrophobicContact CG-CE1 4.43Å; P144-Y148 HydrophobicContact CG-CE2 4.39Å; P144-Y148 HydrophobicContact CG-CG 4.18Å; P144-Y151 HydrophobicContact CB-CD2 4.37Å
145	L	92.6	Very high	95	Very high	62 Å²	62	46.3 Å²	46.3	33%	0.325	22%	0.221	S	C	.	.	S	Bend	trans	-60.7	-37.6	169.3	-73.2	163.9	0	0	0	110.3	T90 Q133 E134 H137	T90-L145 HydrophobicContact CG2-CB 4.04Å; Q133-L145 HydrophobicContact CB-CD1 3.87Å; E134-L145 WeakPolarHBondContact OE2-CA 3.49Å; E134-L145 WeakPolarHBondContact OE2-CB 3.04Å; E134-L145 PolarHBondContact OE2-N 3.23Å; H137-L145 HydrophobicContact CB-CD1 4.36Å; H137-L145 HydrophobicContact CB-CD2 3.86Å; H137-L145 HydrophobicContact CB-CG 3.56Å; H137-L145 WeakPolarHBondContact CD2-CD2 3.16Å; H137-L145 VanDerWaalsContact CG-CD2 3.48Å; H137-L145 PolarHBondContact ND1-N 2.95Å
146	T	93.4	Very high	95.1	Very high	10 Å²	10	45.3 Å²	45.3	6%	0.061	22%	0.217	C	C	.	.	S	Bend	trans	-96.4	-105.9	175.6	56.8	0	0	0	0	110.5	T90 E134 Q150 Q390	T90-T146 HydrophobicContact CG2-CG2 4.07Å; E134-T146 WeakPolarHBondContact OE1-CB 3.27Å; E134-T146 WeakPolarHBondContact OE1-CG2 3.4Å; E134-T146 PolarHBondContact OE1-OG1 3.41Å; E134-T146 PolarHBondContact OE2-N 3.41Å; E134-T146 VanDerWaalsContact OE2-N 3.16Å; E134-T146 PolarHBondContact OE2-OG1 3.33Å; T146-Q150 WeakPolarHBondContact OG1-CB 3.37Å; T146-Q390 PolarHBondContact O-NE2 2.83Å
147	N	94.6	Very high	95.2	Very high	57 Å²	57	38 Å²	38	31%	0.305	19%	0.188	S	C	.	.			trans	-151.9	164.8	176	60	47.6	0	0	0	108.6	Y149 Q150 Y151	N147-Y149 PolarHBondContact O-N 3.44Å; N147-Y149 WeakPolarHBondContact OD1-CA 3.5Å; N147-Y149 VanDerWaalsContact OD1-CB 3.26Å; N147-Y149 WeakPolarHBondContact OD1-CB 3.48Å; N147-Y149 PolarHBondContact OD1-N 3.02Å; N147-Y149 VanDerWaalsContact OD1-N 3.14Å; N147-Q150 PolarHBondContact O-N 3.11Å; N147-Q150 PolarHBondContact OD1-N 2.9Å; N147-Y151 PolarHBondContact O-N 3.41Å
148	Y	97.6	Very high	95.4	Very high	23 Å²	23	35.8 Å²	35.8	9%	0.09	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-20	-177.5	-78.6	-69.5	0	0	0	113.2	I138 P144 S152 L173 A176 H181 F182	I138-Y148 HydrophobicContact CD1-CE1 3.98Å; P144-Y148 HydrophobicContact CG-CD1 4.28Å; P144-Y148 HydrophobicContact CG-CD2 4.24Å; P144-Y148 HydrophobicContact CG-CE1 4.43Å; P144-Y148 HydrophobicContact CG-CE2 4.39Å; P144-Y148 HydrophobicContact CG-CG 4.18Å; Y148-S152 VanDerWaalsContact O-CB 3.26Å; Y148-S152 WeakPolarHBondContact O-CB 3.3Å; Y148-S152 PolarHBondContact O-N 3.45Å; Y148-S152 PolarHBondContact O-OG 3.42Å; Y148-L173 HydrophobicContact CD1-CD1 4.3Å; Y148-A176 HydrophobicContact CD1-CB 3.82Å; Y148-A176 HydrophobicContact CD2-CB 4.5Å; Y148-A176 HydrophobicContact CE1-CB 3.34Å; Y148-A176 HydrophobicContact CE2-CB 4.09Å; Y148-A176 HydrophobicContact CG-CB 4.39Å; Y148-A176 VanDerWaalsContact CZ-CB 3.49Å; Y148-H181 HydrophobicContact CE2-CB 4Å; Y148-F182 HydrophobicContact CD1-CD1 4.45Å; Y148-F182 AromaticContact CD1-CE1 3.93Å; Y148-F182 HydrophobicContact CD1-CE1 3.93Å; Y148-F182 HydrophobicContact CD2-CD1 4.03Å; Y148-F182 HydrophobicContact CD2-CE1 4.3Å; Y148-F182 AromaticContact CG-CD1 3.8Å; Y148-F182 HydrophobicContact CG-CD1 3.8Å; Y148-F182 AromaticContact CG-CE1 3.73Å; Y148-F182 HydrophobicContact CG-CE1 3.73Å
149	Y	98.1	Very high	95.5	Very high	39 Å²	39	35.5 Å²	35.5	15%	0.153	18%	0.177	C	C	.	.	H	α-helix	trans	-65.3	-52.3	172.1	-178.1	-81.6	0	0	0	111	N147 Y151 S152 L153 D191 M195 L245 Q284	N147-Y149 PolarHBondContact O-N 3.44Å; N147-Y149 WeakPolarHBondContact OD1-CA 3.5Å; N147-Y149 VanDerWaalsContact OD1-CB 3.26Å; N147-Y149 WeakPolarHBondContact OD1-CB 3.48Å; N147-Y149 PolarHBondContact OD1-N 3.02Å; N147-Y149 VanDerWaalsContact OD1-N 3.14Å; Y149-Y151 VanDerWaalsContact C-N 3.35Å; Y149-Y151 PolarHBondContact O-N 2.95Å; Y149-S152 WeakPolarHBondContact O-CB 3.16Å; Y149-S152 PolarHBondContact O-N 2.85Å; Y149-L153 HydrophobicContact CE1-CD2 4.17Å; Y149-L153 WeakPolarHBondContact O-CB 3.38Å; Y149-L153 PolarHBondContact O-N 3.16Å; Y149-D191 HydrophobicContact CD2-CB 3.95Å; Y149-D191 WeakPolarHBondContact CD2-O 3.38Å; Y149-D191 HydrophobicContact CE2-CB 3.92Å; Y149-M195 HydrophobicContact CD2-CB 3.94Å; Y149-M195 HydrophobicContact CD2-CG 4.45Å; Y149-M195 HydrophobicContact CE1-CE 4.14Å; Y149-M195 HydrophobicContact CE2-CB 4.01Å; Y149-M195 HydrophobicContact CE2-CE 3.84Å; Y149-M195 HydrophobicContact CE2-CG 4.41Å; Y149-M195 VanDerWaalsContact CZ-CE 3.49Å; Y149-M195 VanDerWaalsContact OH-CE 3.27Å; Y149-M195 WeakPolarHBondContact OH-CE 3.42Å; Y149-L245 HydrophobicContact CE2-CD1 3.71Å; Y149-L245 WeakPolarHBondContact OH-CD1 3.35Å; Y149-Q284 PolarHBondContact OH-NE2 3.03Å; Y149-Q284 VanDerWaalsContact OH-NE2 3.1Å
150	Q	98.2	Very high	95.7	Very high	39 Å²	39	32.8 Å²	32.8	18%	0.182	15%	0.154	C	C	.	.	H	α-helix	trans	-66	-37.1	177.6	-68.9	-168.8	51.4	0	0	112	G93 T146 N147 L153 G154	G93-Q150 VanDerWaalsContact CA-OE1 3.31Å; T146-Q150 WeakPolarHBondContact OG1-CB 3.37Å; N147-Q150 PolarHBondContact O-N 3.11Å; N147-Q150 PolarHBondContact OD1-N 2.9Å; Q150-L153 PolarHBondContact O-N 2.91Å; Q150-G154 PolarHBondContact O-N 3.24Å
151	Y	98.5	Very high	96	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58	-48.7	172	-168.4	-86.5	0	0	0	111.5	M131 E134 I138 P144 N147 Y149 L153 G154 V155 V169 L173	M131-Y151 HydrophobicContact CE-CD1 3.94Å; M131-Y151 HydrophobicContact CE-CD2 3.64Å; M131-Y151 HydrophobicContact CE-CE1 3.91Å; M131-Y151 HydrophobicContact CE-CE2 3.62Å; M131-Y151 HydrophobicContact CE-CG 3.82Å; M131-Y151 VanDerWaalsContact CE-O 3.3Å; M131-Y151 WeakPolarHBondContact CE-O 3.3Å; E134-Y151 HydrophobicContact CB-CD2 3.59Å; E134-Y151 HydrophobicContact CB-CE2 3.64Å; E134-Y151 HydrophobicContact CG-CD2 4.27Å; I138-Y151 HydrophobicContact CD1-CD2 3.88Å; I138-Y151 HydrophobicContact CD1-CE2 3.51Å; P144-Y151 HydrophobicContact CB-CD2 4.37Å; N147-Y151 PolarHBondContact O-N 3.41Å; Y149-Y151 VanDerWaalsContact C-N 3.35Å; Y149-Y151 PolarHBondContact O-N 2.95Å; Y151-L153 VanDerWaalsContact C-N 3.31Å; Y151-L153 PolarHBondContact O-N 3.37Å; Y151-G154 PolarHBondContact O-N 3.3Å; Y151-V155 HydrophobicContact CD1-CG2 4.26Å; Y151-V155 HydrophobicContact CE1-CG2 4.1Å; Y151-V155 PolarHBondContact O-N 3.37Å; Y151-V155 VanDerWaalsContact O-N 3.09Å; Y151-V169 HydrophobicContact CE1-CG1 4.1Å; Y151-V169 WeakPolarHBondContact CE1-O 3.44Å; Y151-V169 VanDerWaalsContact OH-C 3.32Å; Y151-V169 WeakPolarHBondContact OH-CA 3.41Å; Y151-V169 VanDerWaalsContact OH-CG1 3.31Å; Y151-V169 WeakPolarHBondContact OH-CG1 3.49Å; Y151-V169 PolarHBondContact OH-O 3.17Å; Y151-L173 HydrophobicContact CD1-CB 4.19Å; Y151-L173 HydrophobicContact CD1-CD1 4.21Å; Y151-L173 HydrophobicContact CE1-CB 3.94Å
152	S	98.8	Very high	96.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-40.3	177.7	-59.5	0	0	0	0	111.6	Y148 Y149 G154 V155 L156 L173 A196 A199	Y148-S152 VanDerWaalsContact O-CB 3.26Å; Y148-S152 WeakPolarHBondContact O-CB 3.3Å; Y148-S152 PolarHBondContact O-N 3.45Å; Y148-S152 PolarHBondContact O-OG 3.42Å; Y149-S152 WeakPolarHBondContact O-CB 3.16Å; Y149-S152 PolarHBondContact O-N 2.85Å; S152-G154 VanDerWaalsContact C-N 3.34Å; S152-G154 PolarHBondContact O-N 2.99Å; S152-V155 PolarHBondContact O-N 3.27Å; S152-L156 WeakPolarHBondContact O-CB 3.39Å; S152-L156 PolarHBondContact O-N 2.94Å; S152-L173 VanDerWaalsContact OG-CD1 3.24Å; S152-L173 WeakPolarHBondContact OG-CD1 3.25Å; S152-A196 WeakPolarHBondContact OG-CA 3.03Å; S152-A196 WeakPolarHBondContact OG-CB 3.48Å; S152-A199 VanDerWaalsContact O-CB 3.24Å; S152-A199 WeakPolarHBondContact O-CB 3.32Å
153	L	98.8	Very high	96.7	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-39.3	177.9	-168.5	55.8	0	0	0	112.1	A96 L97 L100 Y149 Q150 Y151 L156 A157 M195	A96-L153 HydrophobicContact CB-CB 4.3Å; A96-L153 HydrophobicContact CB-CD2 4.41Å; A96-L153 HydrophobicContact CB-CG 3.76Å; L97-L153 HydrophobicContact CD1-CD2 4.1Å; L97-L153 HydrophobicContact CD2-CD1 4.12Å; L97-L153 HydrophobicContact CD2-CD2 3.9Å; L97-L153 HydrophobicContact CD2-CG 4.5Å; L97-L153 HydrophobicContact CG-CD2 3.58Å; L97-L153 HydrophobicContact CG-CG 4.42Å; L100-L153 HydrophobicContact CD1-CD1 3.78Å; Y149-L153 HydrophobicContact CE1-CD2 4.17Å; Y149-L153 WeakPolarHBondContact O-CB 3.38Å; Y149-L153 PolarHBondContact O-N 3.16Å; Q150-L153 PolarHBondContact O-N 2.91Å; Y151-L153 VanDerWaalsContact C-N 3.31Å; Y151-L153 PolarHBondContact O-N 3.37Å; L153-L156 HydrophobicContact CD1-CD2 4.49Å; L153-L156 PolarHBondContact O-N 3.01Å; L153-A157 WeakPolarHBondContact O-CB 3.35Å; L153-A157 PolarHBondContact O-N 3.42Å; L153-M195 HydrophobicContact CB-CG 4.2Å; L153-M195 HydrophobicContact CB-SD 4.37Å; L153-M195 HydrophobicContact CD1-CE 3.98Å; L153-M195 HydrophobicContact CD1-SD 3.69Å
154	G	98.6	Very high	96.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.9	-42	173.2	0	0	0	0	0	113.3	Q150 Y151 S152 A157 L158	Q150-G154 PolarHBondContact O-N 3.24Å; Y151-G154 PolarHBondContact O-N 3.3Å; S152-G154 VanDerWaalsContact C-N 3.34Å; S152-G154 PolarHBondContact O-N 2.99Å; G154-A157 PolarHBondContact O-N 3.34Å; G154-L158 WeakPolarHBondContact O-CG 3.32Å; G154-L158 PolarHBondContact O-N 3.09Å; G154-L158 VanDerWaalsContact O-N 3.11Å
155	V	98.8	Very high	97	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.4	-47.1	172	172.6	0	0	0	0	110.8	M131 Y151 S152 C159 V165 V169 L173 A199 V203	M131-V155 HydrophobicContact CE-CG2 3.8Å; Y151-V155 HydrophobicContact CD1-CG2 4.26Å; Y151-V155 HydrophobicContact CE1-CG2 4.1Å; Y151-V155 PolarHBondContact O-N 3.37Å; Y151-V155 VanDerWaalsContact O-N 3.09Å; S152-V155 PolarHBondContact O-N 3.27Å; V155-C159 WeakPolarHBondContact O-CB 3.45Å; V155-C159 PolarHBondContact O-N 3.3Å; V155-V165 HydrophobicContact CG1-CG1 4.24Å; V155-V165 HydrophobicContact CG1-CG2 4.28Å; V155-V165 HydrophobicContact CG2-CG1 4.34Å; V155-V169 HydrophobicContact CG2-CG1 3.88Å; V155-L173 HydrophobicContact CG2-CD2 4.41Å; V155-A199 HydrophobicContact CB-CB 4.04Å; V155-A199 HydrophobicContact CG1-CB 3.88Å; V155-V203 HydrophobicContact CG1-CG2 3.77Å
156	L	98.8	Very high	97.1	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.5	-51.2	179.1	178.7	62.3	0	0	0	111.3	S152 L153 L158 C159 V160 M195 M198 A199 C202 Y294 L295	S152-L156 WeakPolarHBondContact O-CB 3.39Å; S152-L156 PolarHBondContact O-N 2.94Å; L153-L156 HydrophobicContact CD1-CD2 4.49Å; L153-L156 PolarHBondContact O-N 3.01Å; L156-L158 PolarHBondContact O-N 3.47Å; L156-C159 PolarHBondContact O-N 2.91Å; L156-C159 VanDerWaalsContact O-N 3.14Å; L156-V160 HydrophobicContact CD1-CG1 3.71Å; L156-V160 HydrophobicContact CG-CG1 4.32Å; L156-V160 WeakPolarHBondContact O-CG1 3.24Å; L156-V160 WeakPolarHBondContact O-CG2 3.41Å; L156-V160 PolarHBondContact O-N 2.93Å; L156-M195 HydrophobicContact CD2-SD 3.78Å; L156-M198 HydrophobicContact CD1-CB 4.46Å; L156-M198 HydrophobicContact CD2-CB 4.34Å; L156-A199 HydrophobicContact CB-CB 3.92Å; L156-C202 HydrophobicContact CD1-CB 4.14Å; L156-Y294 HydrophobicContact CD2-CD2 4.16Å; L156-L295 HydrophobicContact CD1-CD1 3.79Å; L156-L295 HydrophobicContact CD1-CG 4.29Å
157	A	98.7	Very high	97.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.6	-43.3	-177.8	0	0	0	0	0	112.7	A96 L100 L127 L153 G154 S161	A96-A157 HydrophobicContact CB-CB 3.77Å; L100-A157 HydrophobicContact CD2-CB 4.3Å; L100-A157 HydrophobicContact CG-CB 4.17Å; L127-A157 HydrophobicContact CD2-CB 3.87Å; L153-A157 WeakPolarHBondContact O-CB 3.35Å; L153-A157 PolarHBondContact O-N 3.42Å; G154-A157 PolarHBondContact O-N 3.34Å; A157-S161 VanDerWaalsContact O-CB 3.27Å; A157-S161 WeakPolarHBondContact O-CB 3.46Å; A157-S161 PolarHBondContact O-N 2.98Å; A157-S161 PolarHBondContact O-OG 3.26Å
158	L	98.4	Very high	97.2	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-48.6	173.5	-71	173.6	0	0	0	111.2	L124 L127 K128 M131 G154 L156 S161 G162 I163 V165	L124-L158 HydrophobicContact CD2-CD2 4.45Å; L127-L158 HydrophobicContact CB-CD2 4.15Å; L127-L158 HydrophobicContact CD2-CD2 3.9Å; L127-L158 HydrophobicContact CD2-CG 3.89Å; L127-L158 HydrophobicContact CG-CD1 4.48Å; L127-L158 HydrophobicContact CG-CD2 3.98Å; L127-L158 HydrophobicContact CG-CG 4.03Å; K128-L158 HydrophobicContact CG-CD1 4.02Å; K128-L158 HydrophobicContact CG-CD2 3.71Å; M131-L158 HydrophobicContact CG-CD1 3.92Å; G154-L158 WeakPolarHBondContact O-CG 3.32Å; G154-L158 PolarHBondContact O-N 3.09Å; G154-L158 VanDerWaalsContact O-N 3.11Å; L156-L158 PolarHBondContact O-N 3.47Å; L158-S161 PolarHBondContact O-N 3.35Å; L158-G162 PolarHBondContact O-N 3.15Å; L158-I163 HydrophobicContact CB-CB 4.37Å; L158-I163 HydrophobicContact CD2-CB 4.34Å; L158-I163 HydrophobicContact CD2-CG2 4.17Å; L158-I163 WeakPolarHBondContact O-CB 3.31Å; L158-I163 PolarHBondContact O-N 3.39Å; L158-V165 HydrophobicContact CB-CG2 3.93Å
159	C	98.3	Very high	97.2	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.027	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-46.7	-176	176.8	0	0	0	0	113.3	V155 L156 S161 G162 V165 C202 V203	V155-C159 WeakPolarHBondContact O-CB 3.45Å; V155-C159 PolarHBondContact O-N 3.3Å; L156-C159 PolarHBondContact O-N 2.91Å; L156-C159 VanDerWaalsContact O-N 3.14Å; C159-S161 PolarHBondContact O-N 2.86Å; C159-G162 PolarHBondContact O-N 3.28Å; C159-V165 HydrophobicContact CB-CG2 4.14Å; C159-C202 HydrophobicContact CB-CB 3.89Å; C159-C202 WeakPolarHBondContact CB-SG 3.48Å; C159-C202 WeakPolarHBondContact SG-CB 3.05Å; C159-C202 PolarHBondContact SG-O 3.3Å; C159-C202 CovalentContact SG-SG 2.04Å; C159-C202 PolarHBondContact SG-SG 3.12Å; C159-V203 HydrophobicContact CB-CG2 4.5Å; C159-V203 PolarHBondContact SG-N 2.83Å; C159-V203 VanDerWaalsContact SG-N 3.44Å
160	V	97.4	Very high	97.2	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-68.3	-23.4	179	-57.5	0	0	0	0	112.3	L100 L156 G162 V297 K298	L100-V160 HydrophobicContact CD2-CG2 3.32Å; L156-V160 HydrophobicContact CD1-CG1 3.71Å; L156-V160 HydrophobicContact CG-CG1 4.32Å; L156-V160 WeakPolarHBondContact O-CG1 3.24Å; L156-V160 WeakPolarHBondContact O-CG2 3.41Å; L156-V160 PolarHBondContact O-N 2.93Å; V160-G162 PolarHBondContact O-N 3.28Å; V160-V297 HydrophobicContact CG2-CG1 4.48Å; V160-K298 HydrophobicContact CB-CB 4.21Å
161	S	96.8	Very high	97.1	Very high	22 Å²	22	28.4 Å²	28.4	15%	0.154	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	5.9	173.1	-55.6	0	0	0	0	113.2	A157 L158 C159 I163	A157-S161 VanDerWaalsContact O-CB 3.27Å; A157-S161 WeakPolarHBondContact O-CB 3.46Å; A157-S161 PolarHBondContact O-N 2.98Å; A157-S161 PolarHBondContact O-OG 3.26Å; L158-S161 PolarHBondContact O-N 3.35Å; C159-S161 PolarHBondContact O-N 2.86Å; S161-I163 VanDerWaalsContact C-N 3.26Å; S161-I163 PolarHBondContact O-N 3.09Å
162	G	94.8	Very high	97.1	Very high	64 Å²	64	31.6 Å²	31.6	66%	0.66	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.1	11	179.7	0	0	0	0	0	114.2	L158 C159 V160	L158-G162 PolarHBondContact O-N 3.15Å; C159-G162 PolarHBondContact O-N 3.28Å; V160-G162 PolarHBondContact O-N 3.28Å
163	I	95.7	Very high	97	Very high	50 Å²	50	31.6 Å²	31.6	26%	0.256	16%	0.164	S	C	.	.	P	Polyproline II helix	trans	-89.3	126	178.1	-55.7	-57.4	0	0	0	109.5	L124 K128 L158 S161 V165	L124-I163 HydrophobicContact CB-CG1 4.32Å; L124-I163 HydrophobicContact CD1-CD1 4.01Å; L124-I163 HydrophobicContact CD1-CG1 3.7Å; L124-I163 HydrophobicContact CG-CG1 4.47Å; K128-I163 HydrophobicContact CD-CG2 3.88Å; K128-I163 HydrophobicContact CG-CG2 4.34Å; L158-I163 HydrophobicContact CB-CB 4.37Å; L158-I163 HydrophobicContact CD2-CB 4.34Å; L158-I163 HydrophobicContact CD2-CG2 4.17Å; L158-I163 WeakPolarHBondContact O-CB 3.31Å; L158-I163 PolarHBondContact O-N 3.39Å; S161-I163 VanDerWaalsContact C-N 3.26Å; S161-I163 PolarHBondContact O-N 3.09Å; I163-V165 PolarHBondContact O-N 3.27Å; I163-V165 VanDerWaalsContact O-N 3.15Å
164	R	94.8	Very high	97	Very high	163 Å²	163	31.5 Å²	31.5	62%	0.615	16%	0.164	S	C	*	.	P	Polyproline II helix	trans	-62.2	117.5	172.2	-177.1	174.4	178.8	-179.9	-0	110.1
165	V	95.6	Very high	96.9	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.024	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-73.7	138.1	174.1	-173.6	0	0	0	0	109.1	V155 L158 C159 I163 N167 V169 S170 V203	V155-V165 HydrophobicContact CG1-CG1 4.24Å; V155-V165 HydrophobicContact CG1-CG2 4.28Å; V155-V165 HydrophobicContact CG2-CG1 4.34Å; L158-V165 HydrophobicContact CB-CG2 3.93Å; C159-V165 HydrophobicContact CB-CG2 4.14Å; I163-V165 PolarHBondContact O-N 3.27Å; I163-V165 VanDerWaalsContact O-N 3.15Å; V165-N167 PolarHBondContact O-N 3.08Å; V165-V169 HydrophobicContact CG1-CB 4.18Å; V165-V169 HydrophobicContact CG1-CG1 3.95Å; V165-S170 WeakPolarHBondContact CG1-OG 3.46Å; V165-V203 HydrophobicContact CB-CG2 4.49Å; V165-V203 HydrophobicContact CG2-CG2 4.29Å
166	N	95.2	Very high	96.8	Very high	64 Å²	64	34.7 Å²	34.7	34%	0.342	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-58.2	129.6	175.2	-178	-34.4	0	0	0	110.1	E132 H168 V169 S170	E132-N166 PolarHBondContact OE1-ND2 3.22Å; N166-H168 PolarHBondContact O-N 3.48Å; N166-H168 WeakPolarHBondContact OD1-CB 3.36Å; N166-H168 PolarHBondContact OD1-N 2.71Å; N166-V169 HydrophobicContact CB-CB 4.16Å; N166-V169 HydrophobicContact CB-CG2 3.87Å; N166-V169 WeakPolarHBondContact O-CA 3.37Å; N166-V169 WeakPolarHBondContact O-CB 3.47Å; N166-V169 PolarHBondContact O-N 3.03Å; N166-S170 PolarHBondContact O-N 3.16Å; N166-S170 VanDerWaalsContact O-N 3.09Å
167	N	94.9	Very high	96.7	Very high	37 Å²	37	34.8 Å²	34.8	20%	0.198	18%	0.178	C	C	.	.	H	α-helix	trans	-54.6	-38.7	-179.3	-66.3	5.2	0	0	0	112.3	V165 V169 S170 H171 S208 Y209 H211	V165-N167 PolarHBondContact O-N 3.08Å; N167-V169 VanDerWaalsContact C-N 3.32Å; N167-V169 PolarHBondContact O-N 3.38Å; N167-S170 PolarHBondContact O-N 2.79Å; N167-H171 WeakPolarHBondContact O-CB 3.18Å; N167-H171 PolarHBondContact O-N 3.37Å; N167-S208 PolarHBondContact OD1-O 3.36Å; N167-S208 VanDerWaalsContact OD1-O 3.12Å; N167-Y209 HydrophobicContact CB-CD2 4.45Å; N167-Y209 HydrophobicContact CB-CE2 4.35Å; N167-H211 PolarHBondContact ND2-CE1 3.44Å
168	H	95.3	Very high	96.5	Very high	122 Å²	122	37.3 Å²	37.3	57%	0.565	19%	0.19	S	C	*	.	H	α-helix	trans	-67.7	-33.3	177.7	-63.4	-63	0	0	0	112.6	K135 N166 K172	K135-H168 HydrophobicContact CD-CB 3.71Å; N166-H168 PolarHBondContact O-N 3.48Å; N166-H168 WeakPolarHBondContact OD1-CB 3.36Å; N166-H168 PolarHBondContact OD1-N 2.71Å; H168-K172 WeakPolarHBondContact O-CG 3.12Å; H168-K172 PolarHBondContact O-N 3.16Å; H168-K172 VanDerWaalsContact O-N 3.09Å
169	V	97.3	Very high	96.3	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-50.3	175.5	169.4	0	0	0	0	109.4	M131 K135 Y151 V155 V165 N166 N167 H171 K172 L173	M131-V169 HydrophobicContact CB-CG1 4.21Å; M131-V169 HydrophobicContact CB-CG2 4.48Å; M131-V169 HydrophobicContact CE-CG1 3.62Å; K135-V169 HydrophobicContact CB-CG2 4.23Å; K135-V169 HydrophobicContact CD-CG2 4.06Å; Y151-V169 HydrophobicContact CE1-CG1 4.1Å; Y151-V169 WeakPolarHBondContact CE1-O 3.44Å; Y151-V169 VanDerWaalsContact OH-C 3.32Å; Y151-V169 WeakPolarHBondContact OH-CA 3.41Å; Y151-V169 VanDerWaalsContact OH-CG1 3.31Å; Y151-V169 WeakPolarHBondContact OH-CG1 3.49Å; Y151-V169 PolarHBondContact OH-O 3.17Å; V155-V169 HydrophobicContact CG2-CG1 3.88Å; V165-V169 HydrophobicContact CG1-CB 4.18Å; V165-V169 HydrophobicContact CG1-CG1 3.95Å; N166-V169 HydrophobicContact CB-CB 4.16Å; N166-V169 HydrophobicContact CB-CG2 3.87Å; N166-V169 WeakPolarHBondContact O-CA 3.37Å; N166-V169 WeakPolarHBondContact O-CB 3.47Å; N166-V169 PolarHBondContact O-N 3.03Å; N167-V169 VanDerWaalsContact C-N 3.32Å; N167-V169 PolarHBondContact O-N 3.38Å; V169-H171 VanDerWaalsContact C-N 3.34Å; V169-H171 PolarHBondContact O-N 3.38Å; V169-K172 PolarHBondContact O-N 3.42Å; V169-L173 PolarHBondContact O-N 3.05Å
170	S	97.1	Very high	96.1	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-41.3	176.3	-56.4	0	0	0	0	112.1	V165 N166 N167 K172 L173 I174	V165-S170 WeakPolarHBondContact CG1-OG 3.46Å; N166-S170 PolarHBondContact O-N 3.16Å; N166-S170 VanDerWaalsContact O-N 3.09Å; N167-S170 PolarHBondContact O-N 2.79Å; S170-K172 VanDerWaalsContact C-N 3.34Å; S170-K172 PolarHBondContact O-N 2.86Å; S170-L173 WeakPolarHBondContact O-CB 3.32Å; S170-L173 PolarHBondContact O-N 3.46Å; S170-I174 WeakPolarHBondContact O-CG1 3.46Å; S170-I174 PolarHBondContact O-N 3.26Å
171	H	96.6	Very high	95.9	Very high	56 Å²	56	48.3 Å²	48.3	26%	0.259	24%	0.244	S	C	.	.	H	α-helix	trans	-63.4	-35.5	179.7	-178.1	-123.1	0	0	0	112.7	N167 V169 L173 I174 K175 Y209 E215	N167-H171 WeakPolarHBondContact O-CB 3.18Å; N167-H171 PolarHBondContact O-N 3.37Å; V169-H171 VanDerWaalsContact C-N 3.34Å; V169-H171 PolarHBondContact O-N 3.38Å; H171-L173 VanDerWaalsContact C-N 3.28Å; H171-L173 PolarHBondContact O-N 3.12Å; H171-I174 PolarHBondContact O-N 3.38Å; H171-K175 VanDerWaalsContact NE2-CE 3.27Å; H171-K175 WeakPolarHBondContact NE2-CE 3.36Å; H171-K175 WeakPolarHBondContact O-CG 3.24Å; H171-K175 PolarHBondContact O-N 3.44Å; H171-Y209 HydrophobicContact CB-CE2 4.31Å; H171-Y209 PolarHBondContact CD2-OH 3.05Å; H171-E215 IonicContact CD2-OE1 3.82Å; H171-E215 IonicContact CD2-OE2 3.69Å; H171-E215 IonicContact NE2-OE1 3.83Å
172	K	97.5	Very high	95.9	Very high	67 Å²	67	47.3 Å²	47.3	29%	0.291	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-37.3	171.8	-70.9	-52.5	-174.6	-175.5	0	112.4	K135 I138 H168 V169 S170 A176	K135-K172 HydrophobicContact CG-CG 4.04Å; I138-K172 HydrophobicContact CD1-CB 4.13Å; I138-K172 HydrophobicContact CD1-CG 4.5Å; I138-K172 HydrophobicContact CG2-CD 3.93Å; I138-K172 HydrophobicContact CG2-CG 4.28Å; H168-K172 WeakPolarHBondContact O-CG 3.12Å; H168-K172 PolarHBondContact O-N 3.16Å; H168-K172 VanDerWaalsContact O-N 3.09Å; V169-K172 PolarHBondContact O-N 3.42Å; S170-K172 VanDerWaalsContact C-N 3.34Å; S170-K172 PolarHBondContact O-N 2.86Å; K172-A176 WeakPolarHBondContact O-CB 3.31Å; K172-A176 PolarHBondContact O-N 3.34Å
173	L	97.8	Very high	95.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.2	-40.5	177.3	-174.2	58.6	0	0	0	111.8	Y148 Y151 S152 V155 V169 S170 H171 A176 A177 F182 A196 A199 L200	Y148-L173 HydrophobicContact CD1-CD1 4.3Å; Y151-L173 HydrophobicContact CD1-CB 4.19Å; Y151-L173 HydrophobicContact CD1-CD1 4.21Å; Y151-L173 HydrophobicContact CE1-CB 3.94Å; S152-L173 VanDerWaalsContact OG-CD1 3.24Å; S152-L173 WeakPolarHBondContact OG-CD1 3.25Å; V155-L173 HydrophobicContact CG2-CD2 4.41Å; V169-L173 PolarHBondContact O-N 3.05Å; S170-L173 WeakPolarHBondContact O-CB 3.32Å; S170-L173 PolarHBondContact O-N 3.46Å; H171-L173 VanDerWaalsContact C-N 3.28Å; H171-L173 PolarHBondContact O-N 3.12Å; L173-A176 PolarHBondContact O-N 2.72Å; L173-A177 PolarHBondContact O-N 3Å; L173-F182 HydrophobicContact CD1-CE1 3.83Å; L173-F182 HydrophobicContact CD1-CZ 3.58Å; L173-F182 HydrophobicContact CG-CZ 4.49Å; L173-A196 HydrophobicContact CD1-CB 3.96Å; L173-A196 HydrophobicContact CD2-CB 4.3Å; L173-A196 HydrophobicContact CG-CB 4.29Å; L173-A199 HydrophobicContact CD2-CB 4.25Å; L173-L200 HydrophobicContact CB-CD2 4.41Å; L173-L200 HydrophobicContact CD2-CD2 4.03Å; L173-L200 HydrophobicContact CD2-CG 3.96Å; L173-L200 HydrophobicContact CG-CD1 4.33Å; L173-L200 HydrophobicContact CG-CD2 4.3Å; L173-L200 HydrophobicContact CG-CG 4.28Å
174	I	97.8	Very high	95.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.4	-54	172.7	-71	168.7	0	0	0	110.1	S170 H171 A176 A177 E178 L200 Y209 E215 L216 T219	S170-I174 WeakPolarHBondContact O-CG1 3.46Å; S170-I174 PolarHBondContact O-N 3.26Å; H171-I174 PolarHBondContact O-N 3.38Å; I174-A176 VanDerWaalsContact C-N 3.27Å; I174-A176 PolarHBondContact O-N 3.25Å; I174-A177 WeakPolarHBondContact O-CB 3.33Å; I174-A177 PolarHBondContact O-N 2.85Å; I174-A177 VanDerWaalsContact O-N 3.08Å; I174-E178 HydrophobicContact CG2-CG 4.45Å; I174-E178 WeakPolarHBondContact O-CG 3.45Å; I174-E178 PolarHBondContact O-N 2.94Å; I174-L200 HydrophobicContact CD1-CD2 4.44Å; I174-L200 HydrophobicContact CG1-CD1 4.12Å; I174-L200 HydrophobicContact CG1-CD2 3.82Å; I174-Y209 HydrophobicContact CD1-CD1 4.11Å; I174-Y209 HydrophobicContact CD1-CE1 3.44Å; I174-Y209 VanDerWaalsContact CD1-CE1 3.44Å; I174-Y209 HydrophobicContact CD1-CE2 4.11Å; I174-Y209 VanDerWaalsContact CD1-CZ 3.46Å; I174-E215 HydrophobicContact CG2-CG 3.89Å; I174-L216 HydrophobicContact CD1-CB 4.46Å; I174-L216 HydrophobicContact CD1-CD1 4.03Å; I174-L216 HydrophobicContact CG1-CD1 4.24Å; I174-T219 HydrophobicContact CG2-CG2 4.42Å
175	K	97	Very high	94.5	Very high	67 Å²	67	44.2 Å²	44.2	29%	0.291	21%	0.212	S	C	.	.	H	α-helix	trans	-62.2	-32	178.6	-67.4	-42.5	-168.7	-164	0	113.4	H171 E178 N179 E215	H171-K175 VanDerWaalsContact NE2-CE 3.27Å; H171-K175 WeakPolarHBondContact NE2-CE 3.36Å; H171-K175 WeakPolarHBondContact O-CG 3.24Å; H171-K175 PolarHBondContact O-N 3.44Å; K175-E178 WeakPolarHBondContact CD-OE2 3.43Å; K175-E178 WeakPolarHBondContact CE-OE2 3.39Å; K175-E178 IonicContact NZ-OE1 3.91Å; K175-E178 PolarHBondContact NZ-OE1 3.13Å; K175-E178 IonicContact NZ-OE2 2.84Å; K175-E178 PolarHBondContact NZ-OE2 2.83Å; K175-N179 WeakPolarHBondContact O-CB 3.4Å; K175-N179 VanDerWaalsContact O-CG 3.31Å; K175-N179 PolarHBondContact O-N 3.05Å; K175-N179 VanDerWaalsContact O-N 3.08Å; K175-N179 PolarHBondContact O-ND2 3.45Å; K175-E215 WeakPolarHBondContact CE-OE1 3.43Å; K175-E215 IonicContact NZ-OE1 2.72Å; K175-E215 PolarHBondContact NZ-OE1 3.3Å
176	A	96.9	Very high	93.9	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-68.2	-38.7	174.8	0	0	0	0	0	112.3	Y148 K172 L173 I174 E180 H181 F182	Y148-A176 HydrophobicContact CD1-CB 3.82Å; Y148-A176 HydrophobicContact CD2-CB 4.5Å; Y148-A176 HydrophobicContact CE1-CB 3.34Å; Y148-A176 HydrophobicContact CE2-CB 4.09Å; Y148-A176 HydrophobicContact CG-CB 4.39Å; Y148-A176 VanDerWaalsContact CZ-CB 3.49Å; K172-A176 WeakPolarHBondContact O-CB 3.31Å; K172-A176 PolarHBondContact O-N 3.34Å; L173-A176 PolarHBondContact O-N 2.72Å; I174-A176 VanDerWaalsContact C-N 3.27Å; I174-A176 PolarHBondContact O-N 3.25Å; A176-E180 PolarHBondContact O-N 2.82Å; A176-H181 HydrophobicContact CB-CB 4.21Å; A176-H181 PolarHBondContact O-N 2.87Å; A176-F182 HydrophobicContact CB-CD1 4.25Å; A176-F182 HydrophobicContact CB-CE1 3.5Å; A176-F182 HydrophobicContact CB-CZ 4.13Å
177	A	96.8	Very high	93.5	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-43.4	175.4	0	0	0	0	0	112.2	L173 I174 N179 E180 F182 T219 I223	L173-A177 PolarHBondContact O-N 3Å; I174-A177 WeakPolarHBondContact O-CB 3.33Å; I174-A177 PolarHBondContact O-N 2.85Å; I174-A177 VanDerWaalsContact O-N 3.08Å; A177-N179 PolarHBondContact O-N 2.98Å; A177-E180 PolarHBondContact O-N 2.83Å; A177-F182 HydrophobicContact CB-CE2 3.56Å; A177-F182 HydrophobicContact CB-CZ 3.75Å; A177-T219 HydrophobicContact CB-CG2 3.68Å; A177-I223 HydrophobicContact CB-CD1 4.01Å; A177-I223 HydrophobicContact CB-CG1 4.1Å
178	E	95.4	Very high	93.4	Very high	53 Å²	53	54.6 Å²	54.6	25%	0.248	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-44.9	177.3	-73.3	178.5	175.1	0	0	112	I174 K175 E180 E215 K222	I174-E178 HydrophobicContact CG2-CG 4.45Å; I174-E178 WeakPolarHBondContact O-CG 3.45Å; I174-E178 PolarHBondContact O-N 2.94Å; K175-E178 WeakPolarHBondContact CD-OE2 3.43Å; K175-E178 WeakPolarHBondContact CE-OE2 3.39Å; K175-E178 IonicContact NZ-OE1 3.91Å; K175-E178 PolarHBondContact NZ-OE1 3.13Å; K175-E178 IonicContact NZ-OE2 2.84Å; K175-E178 PolarHBondContact NZ-OE2 2.83Å; E178-E180 VanDerWaalsContact C-N 3.28Å; E178-E180 PolarHBondContact O-N 3.28Å; E178-E215 WeakPolarHBondContact OE1-CG 3.24Å; E178-K222 PolarHBondContact O-NZ 3.13Å
179	N	94.1	Very high	93.5	Very high	96 Å²	96	50 Å²	50	51%	0.513	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	7.6	-178.8	-62	-48.1	0	0	0	113.7	K175 A177 H181	K175-N179 WeakPolarHBondContact O-CB 3.4Å; K175-N179 VanDerWaalsContact O-CG 3.31Å; K175-N179 PolarHBondContact O-N 3.05Å; K175-N179 VanDerWaalsContact O-N 3.08Å; K175-N179 PolarHBondContact O-ND2 3.45Å; A177-N179 PolarHBondContact O-N 2.98Å; N179-H181 VanDerWaalsContact C-N 3.25Å; N179-H181 WeakPolarHBondContact CB-NE2 3.27Å; N179-H181 PolarHBondContact O-CD2 3.38Å; N179-H181 VanDerWaalsContact O-CD2 3.24Å; N179-H181 PolarHBondContact O-N 3.03Å
180	E	93.1	Very high	93.5	Very high	55 Å²	55	50.5 Å²	50.5	26%	0.257	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	35.9	176.5	-51.6	-171.6	-176.4	0	0	113.7	A176 A177 E178 F182 R183 K222 K226	A176-E180 PolarHBondContact O-N 2.82Å; A177-E180 PolarHBondContact O-N 2.83Å; E178-E180 VanDerWaalsContact C-N 3.28Å; E178-E180 PolarHBondContact O-N 3.28Å; E180-F182 PolarHBondContact O-N 3.32Å; E180-R183 WeakPolarHBondContact O-CD 3.5Å; E180-R183 WeakPolarHBondContact O-CG 3.47Å; E180-R183 PolarHBondContact O-NE 3.27Å; E180-K222 VanDerWaalsContact OE1-CE 3.24Å; E180-K222 WeakPolarHBondContact OE1-CE 3.4Å; E180-K222 IonicContact OE1-NZ 3.83Å; E180-K222 PolarHBondContact OE1-NZ 3.5Å; E180-K226 VanDerWaalsContact CD-NZ 3.3Å; E180-K226 IonicContact OE1-NZ 3.41Å; E180-K226 IonicContact OE2-NZ 3.19Å; E180-K226 PolarHBondContact OE2-NZ 2.72Å
181	H	93.9	Very high	93.6	Very high	89 Å²	89	52.3 Å²	52.3	41%	0.412	26%	0.258	S	S	.	.			trans	-78.3	1.1	179.4	-64.8	167.2	0	0	0	113.8	Y148 A176 N179 R183	Y148-H181 HydrophobicContact CE2-CB 4Å; A176-H181 HydrophobicContact CB-CB 4.21Å; A176-H181 PolarHBondContact O-N 2.87Å; N179-H181 VanDerWaalsContact C-N 3.25Å; N179-H181 WeakPolarHBondContact CB-NE2 3.27Å; N179-H181 PolarHBondContact O-CD2 3.38Å; N179-H181 VanDerWaalsContact O-CD2 3.24Å; N179-H181 PolarHBondContact O-N 3.03Å; H181-R183 PolarHBondContact O-N 3.02Å
182	F	95.4	Very high	93.7	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.009	25%	0.25	C	C	.	.			trans	-81	62.2	177.1	-59.8	-21.4	0	0	0	110.6	Y148 L173 A176 A177 E180 S189 T192 Y193 A196	Y148-F182 HydrophobicContact CD1-CD1 4.45Å; Y148-F182 AromaticContact CD1-CE1 3.93Å; Y148-F182 HydrophobicContact CD1-CE1 3.93Å; Y148-F182 HydrophobicContact CD2-CD1 4.03Å; Y148-F182 HydrophobicContact CD2-CE1 4.3Å; Y148-F182 AromaticContact CG-CD1 3.8Å; Y148-F182 HydrophobicContact CG-CD1 3.8Å; Y148-F182 AromaticContact CG-CE1 3.73Å; Y148-F182 HydrophobicContact CG-CE1 3.73Å; L173-F182 HydrophobicContact CD1-CE1 3.83Å; L173-F182 HydrophobicContact CD1-CZ 3.58Å; L173-F182 HydrophobicContact CG-CZ 4.49Å; A176-F182 HydrophobicContact CB-CD1 4.25Å; A176-F182 HydrophobicContact CB-CE1 3.5Å; A176-F182 HydrophobicContact CB-CZ 4.13Å; A177-F182 HydrophobicContact CB-CE2 3.56Å; A177-F182 HydrophobicContact CB-CZ 3.75Å; E180-F182 PolarHBondContact O-N 3.32Å; F182-S189 PolarHBondContact O-N 3.37Å; F182-T192 HydrophobicContact CB-CG2 3.72Å; F182-T192 HydrophobicContact CD1-CG2 3.49Å; F182-T192 VanDerWaalsContact CD1-CG2 3.49Å; F182-T192 HydrophobicContact CD2-CG2 4.06Å; F182-T192 HydrophobicContact CE1-CG2 4.09Å; F182-T192 HydrophobicContact CG-CG2 3.49Å; F182-T192 VanDerWaalsContact CG-CG2 3.49Å; F182-Y193 HydrophobicContact CB-CD2 3.93Å; F182-Y193 HydrophobicContact CB-CE2 3.66Å; F182-Y193 AromaticContact CD2-CD1 3.54Å; F182-Y193 HydrophobicContact CD2-CD1 3.54Å; F182-Y193 HydrophobicContact CD2-CD2 4.01Å; F182-Y193 AromaticContact CD2-CE1 3.54Å; F182-Y193 HydrophobicContact CD2-CE1 3.54Å; F182-Y193 HydrophobicContact CD2-CE2 4.03Å; F182-Y193 AromaticContact CD2-CG 3.75Å; F182-Y193 HydrophobicContact CD2-CG 3.75Å; F182-Y193 AromaticContact CD2-CZ 3.79Å; F182-Y193 HydrophobicContact CE2-CD1 4.05Å; F182-Y193 HydrophobicContact CE2-CE1 4.14Å; F182-Y193 HydrophobicContact CG-CE2 4.37Å; F182-A196 HydrophobicContact CE2-CB 3.57Å; F182-A196 HydrophobicContact CZ-CB 3.67Å
183	R	89.8	Confident	93.7	Very high	118 Å²	118	47.1 Å²	47.1	45%	0.445	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.9	-175.5	-68.5	179.3	172.3	-153.1	-2.9	111.7	E180 H181 T187 E188	E180-R183 WeakPolarHBondContact O-CD 3.5Å; E180-R183 WeakPolarHBondContact O-CG 3.47Å; E180-R183 PolarHBondContact O-NE 3.27Å; H181-R183 PolarHBondContact O-N 3.02Å; R183-T187 CarbonylContact C-O 3.57Å; R183-T187 VanDerWaalsContact CA-O 3.29Å; R183-T187 WeakPolarHBondContact CA-O 3.35Å; R183-E188 HydrophobicContact CG-CG 4.25Å; R183-E188 IonicContact NH2-OE1 2.83Å
184	H	84.1	Confident	93.8	Very high	69 Å²	69	47.1 Å²	47.1	32%	0.319	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	95.7	168.8	-172.5	80.3	0	0	0	107.4	E186 T187 Y395 Y427	H184-E186 PolarHBondContact O-N 3.2Å; H184-T187 PolarHBondContact N-O 3.09Å; H184-T187 PolarHBondContact O-N 2.95Å; H184-Y395 AromaticContact CD2-CZ 3.98Å; H184-Y395 AromaticContact CE1-CD1 3.95Å; H184-Y395 AromaticContact CE1-CE1 3.68Å; H184-Y395 AromaticContact NE2-CD1 3.7Å; H184-Y395 AromaticContact NE2-CE1 3.02Å; H184-Y395 WeakPolarHBondContact NE2-CE1 3.42Å; H184-Y395 AromaticContact NE2-CE2 3.81Å; H184-Y395 AromaticContact NE2-CZ 3.1Å; H184-Y395 PolarHBondContact NE2-OH 3.36Å; H184-Y427 AromaticContact CE1-CD1 3.29Å; H184-Y427 WeakPolarHBondContact CE1-CD1 3.48Å; H184-Y427 AromaticContact CE1-CD2 3.52Å; H184-Y427 AromaticContact CE1-CE1 3.55Å; H184-Y427 AromaticContact CE1-CE2 3.78Å; H184-Y427 AromaticContact CE1-CG 3.23Å; H184-Y427 AromaticContact CE1-CZ 3.77Å; H184-Y427 AromaticContact ND1-CD1 3.95Å; H184-Y427 AromaticContact ND1-CD2 3.28Å; H184-Y427 VanDerWaalsContact ND1-CD2 3.28Å; H184-Y427 WeakPolarHBondContact ND1-CD2 3.33Å; H184-Y427 AromaticContact ND1-CE2 3.64Å; H184-Y427 AromaticContact ND1-CG 3.43Å; H184-Y427 AromaticContact NE2-CD1 3.89Å; H184-Y427 AromaticContact NE2-CG 3.87Å
185	G	83.1	Confident	93.8	Very high	24 Å²	24	47.1 Å²	47.1	25%	0.247	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	64	-127.3	-165.4	0	0	0	0	0	109.2	T187 Y427	G185-T187 VanDerWaalsContact C-N 3.33Å; G185-Y427 PolarHBondContact N-OXT 3.45Å
186	E	82.1	Confident	93.9	Very high	170 Å²	170	43.9 Å²	43.9	79%	0.794	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-4.7	179.8	-59.1	-52.8	134.6	0	0	113.8	H184	H184-E186 PolarHBondContact O-N 3.2Å
187	T	87.8	Confident	94	Very high	100 Å²	100	43.9 Å²	43.9	61%	0.613	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.7	-174.5	-54.4	0	0	0	0	111.6	R183 H184 G185	R183-T187 CarbonylContact C-O 3.57Å; R183-T187 VanDerWaalsContact CA-O 3.29Å; R183-T187 WeakPolarHBondContact CA-O 3.35Å; H184-T187 PolarHBondContact N-O 3.09Å; H184-T187 PolarHBondContact O-N 2.95Å; G185-T187 VanDerWaalsContact C-N 3.33Å
188	E	92.5	Very high	94.1	Very high	53 Å²	53	43.8 Å²	43.8	25%	0.248	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	138.5	172.3	-64.1	-168.7	147.7	0	0	111.3	R183 Y193 K226	R183-E188 HydrophobicContact CG-CG 4.25Å; R183-E188 IonicContact NH2-OE1 2.83Å; E188-Y193 HydrophobicContact CB-CE2 4.46Å; E188-K226 IonicContact OE1-NZ 2.9Å; E188-K226 PolarHBondContact OE1-NZ 3.16Å; E188-K226 IonicContact OE2-NZ 3.51Å
189	S	96.5	Very high	94.2	Very high	27 Å²	27	41.3 Å²	41.3	19%	0.189	21%	0.209	C	C	.	.			trans	-96.8	102.1	178.4	175.9	0	0	0	0	110.6	F182 D191 T192 Y193	F182-S189 PolarHBondContact O-N 3.37Å; S189-D191 VanDerWaalsContact C-N 3.27Å; S189-D191 PolarHBondContact O-N 3.3Å; S189-T192 WeakPolarHBondContact CB-OG1 3.32Å; S189-T192 WeakPolarHBondContact O-CB 3.45Å; S189-T192 PolarHBondContact O-N 3.41Å; S189-T192 VanDerWaalsContact O-N 3.13Å; S189-T192 WeakPolarHBondContact OG-CB 3.41Å; S189-T192 PolarHBondContact OG-N 3.19Å; S189-T192 PolarHBondContact OG-OG1 2.95Å; S189-Y193 WeakPolarHBondContact O-CD2 3.23Å; S189-Y193 PolarHBondContact O-N 3.46Å
190	I	98.1	Very high	94.5	Very high	12 Å²	12	36.7 Å²	36.7	6%	0.062	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-37.9	177	-57.2	-44.5	0	0	0	111.3	T192 Y193 A194 L227 S230 I237 A246	I190-T192 VanDerWaalsContact C-N 3.28Å; I190-T192 PolarHBondContact O-N 3.41Å; I190-Y193 PolarHBondContact O-N 2.98Å; I190-A194 WeakPolarHBondContact O-CB 3.26Å; I190-A194 PolarHBondContact O-N 3.3Å; I190-L227 HydrophobicContact CG2-CD2 3.77Å; I190-S230 WeakPolarHBondContact CD1-OG 3.47Å; I190-I237 HydrophobicContact CG2-CG2 3.87Å; I190-A246 HydrophobicContact CG2-CB 4.16Å
191	D	98.5	Very high	94.7	Very high	39 Å²	39	35 Å²	35	21%	0.209	18%	0.177	C	C	.	.	H	α-helix	trans	-58	-41.3	174.3	-54.9	-84.6	0	0	0	112	Y149 S189 A194 M195 S242 L245	Y149-D191 HydrophobicContact CD2-CB 3.95Å; Y149-D191 WeakPolarHBondContact CD2-O 3.38Å; Y149-D191 HydrophobicContact CE2-CB 3.92Å; S189-D191 VanDerWaalsContact C-N 3.27Å; S189-D191 PolarHBondContact O-N 3.3Å; D191-A194 PolarHBondContact O-N 2.99Å; D191-M195 WeakPolarHBondContact O-CB 3.46Å; D191-M195 PolarHBondContact O-N 2.95Å; D191-S242 VanDerWaalsContact OD1-CA 3.31Å; D191-S242 WeakPolarHBondContact OD1-CA 3.29Å; D191-S242 WeakPolarHBondContact OD1-CB 3.13Å; D191-S242 PolarHBondContact OD1-OG 3.29Å; D191-S242 PolarHBondContact OD2-OG 2.99Å; D191-L245 HydrophobicContact CB-CD1 4.37Å
192	T	98.6	Very high	94.9	Very high	13 Å²	13	30.9 Å²	30.9	8%	0.08	16%	0.158	C	C	.	.	H	α-helix	trans	-69.3	-44.8	178.3	-59	0	0	0	0	111.1	F182 S189 I190 A194 M195 A196	F182-T192 HydrophobicContact CB-CG2 3.72Å; F182-T192 HydrophobicContact CD1-CG2 3.49Å; F182-T192 VanDerWaalsContact CD1-CG2 3.49Å; F182-T192 HydrophobicContact CD2-CG2 4.06Å; F182-T192 HydrophobicContact CE1-CG2 4.09Å; F182-T192 HydrophobicContact CG-CG2 3.49Å; F182-T192 VanDerWaalsContact CG-CG2 3.49Å; S189-T192 WeakPolarHBondContact CB-OG1 3.32Å; S189-T192 WeakPolarHBondContact O-CB 3.45Å; S189-T192 PolarHBondContact O-N 3.41Å; S189-T192 VanDerWaalsContact O-N 3.13Å; S189-T192 WeakPolarHBondContact OG-CB 3.41Å; S189-T192 PolarHBondContact OG-N 3.19Å; S189-T192 PolarHBondContact OG-OG1 2.95Å; I190-T192 VanDerWaalsContact C-N 3.28Å; I190-T192 PolarHBondContact O-N 3.41Å; T192-A194 VanDerWaalsContact C-N 3.31Å; T192-A194 PolarHBondContact O-N 2.75Å; T192-M195 PolarHBondContact O-N 2.93Å; T192-A196 VanDerWaalsContact O-CB 3.24Å; T192-A196 WeakPolarHBondContact O-CB 3.41Å; T192-A196 PolarHBondContact O-N 3.49Å
193	Y	98.8	Very high	95.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57.7	-44.6	173.6	-86.9	-75.5	0	0	0	111.7	F182 E188 S189 I190 A196 G197 I223 K226	F182-Y193 HydrophobicContact CB-CD2 3.93Å; F182-Y193 HydrophobicContact CB-CE2 3.66Å; F182-Y193 AromaticContact CD2-CD1 3.54Å; F182-Y193 HydrophobicContact CD2-CD1 3.54Å; F182-Y193 HydrophobicContact CD2-CD2 4.01Å; F182-Y193 AromaticContact CD2-CE1 3.54Å; F182-Y193 HydrophobicContact CD2-CE1 3.54Å; F182-Y193 HydrophobicContact CD2-CE2 4.03Å; F182-Y193 AromaticContact CD2-CG 3.75Å; F182-Y193 HydrophobicContact CD2-CG 3.75Å; F182-Y193 AromaticContact CD2-CZ 3.79Å; F182-Y193 HydrophobicContact CE2-CD1 4.05Å; F182-Y193 HydrophobicContact CE2-CE1 4.14Å; F182-Y193 HydrophobicContact CG-CE2 4.37Å; E188-Y193 HydrophobicContact CB-CE2 4.46Å; S189-Y193 WeakPolarHBondContact O-CD2 3.23Å; S189-Y193 PolarHBondContact O-N 3.46Å; I190-Y193 PolarHBondContact O-N 2.98Å; Y193-A196 PolarHBondContact O-N 2.87Å; Y193-G197 PolarHBondContact O-N 3.09Å; Y193-I223 HydrophobicContact CD1-CB 4.37Å; Y193-I223 HydrophobicContact CD1-CG1 4.04Å; Y193-I223 HydrophobicContact CD1-CG2 4.19Å; Y193-I223 HydrophobicContact CE1-CG1 4.46Å; Y193-I223 VanDerWaalsContact O-CG2 3.25Å; Y193-I223 WeakPolarHBondContact O-CG2 3.38Å; Y193-K226 HydrophobicContact CD1-CB 4.13Å; Y193-K226 HydrophobicContact CD1-CG 4.44Å; Y193-K226 HydrophobicContact CE1-CB 4.13Å; Y193-K226 HydrophobicContact CE1-CG 3.94Å; Y193-K226 HydrophobicContact CG-CB 4.46Å
194	A	98.9	Very high	95.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.6	-48.5	179	0	0	0	0	0	112	I190 D191 T192 A196 G197 M198 L227 L245 A249	I190-A194 WeakPolarHBondContact O-CB 3.26Å; I190-A194 PolarHBondContact O-N 3.3Å; D191-A194 PolarHBondContact O-N 2.99Å; T192-A194 VanDerWaalsContact C-N 3.31Å; T192-A194 PolarHBondContact O-N 2.75Å; A194-A196 PolarHBondContact O-N 3.26Å; A194-G197 PolarHBondContact O-N 3.46Å; A194-M198 PolarHBondContact O-N 3.36Å; A194-L227 HydrophobicContact CB-CD2 4.25Å; A194-L245 HydrophobicContact CB-CB 3.88Å; A194-A249 HydrophobicContact CB-CB 3.86Å; A194-A249 VanDerWaalsContact O-CB 3.29Å; A194-A249 WeakPolarHBondContact O-CB 3.43Å
195	M	98.9	Very high	96	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64	-41.6	178.6	-164.8	55.7	67.2	0	0	111.8	Y149 L153 L156 D191 T192 M198 A199 L245 Y294	Y149-M195 HydrophobicContact CD2-CB 3.94Å; Y149-M195 HydrophobicContact CD2-CG 4.45Å; Y149-M195 HydrophobicContact CE1-CE 4.14Å; Y149-M195 HydrophobicContact CE2-CB 4.01Å; Y149-M195 HydrophobicContact CE2-CE 3.84Å; Y149-M195 HydrophobicContact CE2-CG 4.41Å; Y149-M195 VanDerWaalsContact CZ-CE 3.49Å; Y149-M195 VanDerWaalsContact OH-CE 3.27Å; Y149-M195 WeakPolarHBondContact OH-CE 3.42Å; L153-M195 HydrophobicContact CB-CG 4.2Å; L153-M195 HydrophobicContact CB-SD 4.37Å; L153-M195 HydrophobicContact CD1-CE 3.98Å; L153-M195 HydrophobicContact CD1-SD 3.69Å; L156-M195 HydrophobicContact CD2-SD 3.78Å; D191-M195 WeakPolarHBondContact O-CB 3.46Å; D191-M195 PolarHBondContact O-N 2.95Å; T192-M195 PolarHBondContact O-N 2.93Å; M195-M198 HydrophobicContact CE-CE 4.11Å; M195-M198 PolarHBondContact O-N 2.87Å; M195-M198 HydrophobicContact SD-CE 4.02Å; M195-A199 WeakPolarHBondContact O-CB 3.31Å; M195-A199 PolarHBondContact O-N 3.37Å; M195-L245 HydrophobicContact CE-CD1 4.48Å; M195-L245 HydrophobicContact CE-CD2 4.27Å; M195-Y294 HydrophobicContact CE-CD2 4.05Å; M195-Y294 HydrophobicContact CE-CE2 3.83Å; M195-Y294 HydrophobicContact SD-CD2 4.39Å
196	A	98.8	Very high	96.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-43.8	176.3	0	0	0	0	0	111.9	S152 L173 F182 T192 Y193 A194 A199 L200 I223	S152-A196 WeakPolarHBondContact OG-CA 3.03Å; S152-A196 WeakPolarHBondContact OG-CB 3.48Å; L173-A196 HydrophobicContact CD1-CB 3.96Å; L173-A196 HydrophobicContact CD2-CB 4.3Å; L173-A196 HydrophobicContact CG-CB 4.29Å; F182-A196 HydrophobicContact CE2-CB 3.57Å; F182-A196 HydrophobicContact CZ-CB 3.67Å; T192-A196 VanDerWaalsContact O-CB 3.24Å; T192-A196 WeakPolarHBondContact O-CB 3.41Å; T192-A196 PolarHBondContact O-N 3.49Å; Y193-A196 PolarHBondContact O-N 2.87Å; A194-A196 PolarHBondContact O-N 3.26Å; A196-A199 PolarHBondContact O-N 3.15Å; A196-L200 VanDerWaalsContact O-CB 3.32Å; A196-L200 WeakPolarHBondContact O-CB 3.42Å; A196-L200 WeakPolarHBondContact O-CG 3.33Å; A196-L200 PolarHBondContact O-N 3.24Å; A196-I223 HydrophobicContact CB-CD1 4.27Å
197	G	98.8	Very high	96.9	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.6	-48.6	176.4	0	0	0	0	0	112	Y193 A194 A199 Q201	Y193-G197 PolarHBondContact O-N 3.09Å; A194-G197 PolarHBondContact O-N 3.46Å; G197-A199 PolarHBondContact O-N 3.19Å; G197-Q201 WeakPolarHBondContact O-CB 3.28Å; G197-Q201 PolarHBondContact O-N 3.5Å
198	M	98.8	Very high	96.7	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-47.5	174.8	-75.8	-168.4	-74.2	0	0	112.3	L156 A194 M195 Q201 C202 L245 Q248 A249 A252 Y294 L295	L156-M198 HydrophobicContact CD1-CB 4.46Å; L156-M198 HydrophobicContact CD2-CB 4.34Å; A194-M198 PolarHBondContact O-N 3.36Å; M195-M198 HydrophobicContact CE-CE 4.11Å; M195-M198 PolarHBondContact O-N 2.87Å; M195-M198 HydrophobicContact SD-CE 4.02Å; M198-Q201 PolarHBondContact O-N 3.04Å; M198-C202 PolarHBondContact O-N 3.23Å; M198-L245 HydrophobicContact CE-CD2 4.28Å; M198-Q248 HydrophobicContact CE-CB 4.38Å; M198-Q248 HydrophobicContact SD-CB 3.8Å; M198-A249 HydrophobicContact CG-CB 3.93Å; M198-A252 HydrophobicContact CG-CB 4.04Å; M198-Y294 HydrophobicContact CE-CD2 4.12Å; M198-L295 HydrophobicContact CB-CD1 3.53Å; M198-L295 HydrophobicContact CG-CD1 3.82Å; M198-L295 WeakPolarHBondContact O-CD1 3.49Å; M198-L295 HydrophobicContact SD-CD1 4.29Å
199	A	98.8	Very high	96.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.2	-50.3	-179.2	0	0	0	0	0	112.3	S152 V155 L156 L173 M195 A196 G197 Q201 C202 V203	S152-A199 VanDerWaalsContact O-CB 3.24Å; S152-A199 WeakPolarHBondContact O-CB 3.32Å; V155-A199 HydrophobicContact CB-CB 4.04Å; V155-A199 HydrophobicContact CG1-CB 3.88Å; L156-A199 HydrophobicContact CB-CB 3.92Å; L173-A199 HydrophobicContact CD2-CB 4.25Å; M195-A199 WeakPolarHBondContact O-CB 3.31Å; M195-A199 PolarHBondContact O-N 3.37Å; A196-A199 PolarHBondContact O-N 3.15Å; G197-A199 PolarHBondContact O-N 3.19Å; A199-Q201 VanDerWaalsContact C-N 3.35Å; A199-Q201 PolarHBondContact O-N 3.1Å; A199-C202 WeakPolarHBondContact O-CB 3.48Å; A199-C202 PolarHBondContact O-N 3.45Å; A199-V203 WeakPolarHBondContact O-CG2 3.27Å; A199-V203 PolarHBondContact O-N 2.97Å
200	L	98.7	Very high	95.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.1	-35.8	-179.8	-72	-179	0	0	0	112.1	L173 I174 A196 C202 V203 K204 L216 T219 L220 I223	L173-L200 HydrophobicContact CB-CD2 4.41Å; L173-L200 HydrophobicContact CD2-CD2 4.03Å; L173-L200 HydrophobicContact CD2-CG 3.96Å; L173-L200 HydrophobicContact CG-CD1 4.33Å; L173-L200 HydrophobicContact CG-CD2 4.3Å; L173-L200 HydrophobicContact CG-CG 4.28Å; I174-L200 HydrophobicContact CD1-CD2 4.44Å; I174-L200 HydrophobicContact CG1-CD1 4.12Å; I174-L200 HydrophobicContact CG1-CD2 3.82Å; A196-L200 VanDerWaalsContact O-CB 3.32Å; A196-L200 WeakPolarHBondContact O-CB 3.42Å; A196-L200 WeakPolarHBondContact O-CG 3.33Å; A196-L200 PolarHBondContact O-N 3.24Å; L200-C202 VanDerWaalsContact C-N 3.34Å; L200-V203 PolarHBondContact O-N 3.42Å; L200-K204 PolarHBondContact O-N 3.4Å; L200-L216 HydrophobicContact CB-CD1 3.87Å; L200-L216 HydrophobicContact CD1-CD1 4.37Å; L200-L216 HydrophobicContact CD2-CD1 4.02Å; L200-L216 HydrophobicContact CG-CD1 4.3Å; L200-T219 HydrophobicContact CD1-CG2 3.89Å; L200-L220 HydrophobicContact CB-CD2 3.83Å; L200-L220 HydrophobicContact CB-CG 4.46Å; L200-I223 HydrophobicContact CD1-CD1 3.94Å
201	Q	98.6	Very high	95	Very high	19 Å²	19	26.7 Å²	26.7	9%	0.089	16%	0.162	C	C	.	.	H	α-helix	trans	-65.3	-38.8	174.1	-175.3	62.2	59	0	0	111.6	G197 M198 A199 K204 N205 L220 A252 M253 L295	G197-Q201 WeakPolarHBondContact O-CB 3.28Å; G197-Q201 PolarHBondContact O-N 3.5Å; M198-Q201 PolarHBondContact O-N 3.04Å; A199-Q201 VanDerWaalsContact C-N 3.35Å; A199-Q201 PolarHBondContact O-N 3.1Å; Q201-K204 PolarHBondContact O-N 3.3Å; Q201-N205 PolarHBondContact NE2-OD1 3.13Å; Q201-N205 WeakPolarHBondContact O-CB 3.42Å; Q201-N205 PolarHBondContact O-N 3.01Å; Q201-N205 PolarHBondContact O-OD1 3.49Å; Q201-L220 HydrophobicContact CB-CD2 4.1Å; Q201-A252 VanDerWaalsContact CG-O 3.25Å; Q201-A252 WeakPolarHBondContact CG-O 3.48Å; Q201-M253 HydrophobicContact CB-CG 4.1Å; Q201-M253 HydrophobicContact CG-CG 4.25Å; Q201-L295 HydrophobicContact CB-CD2 4.27Å; Q201-L295 HydrophobicContact CG-CD2 4.06Å
202	C	98.4	Very high	94.5	Very high	3 Å²	3	28 Å²	28	2%	0.02	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-46.7	171.9	-176.1	0	0	0	0	111	L156 C159 M198 A199 L200 K204 N205 S206 L295	L156-C202 HydrophobicContact CD1-CB 4.14Å; C159-C202 HydrophobicContact CB-CB 3.89Å; C159-C202 WeakPolarHBondContact CB-SG 3.48Å; C159-C202 WeakPolarHBondContact SG-CB 3.05Å; C159-C202 PolarHBondContact SG-O 3.3Å; C159-C202 CovalentContact SG-SG 2.04Å; C159-C202 PolarHBondContact SG-SG 3.12Å; M198-C202 PolarHBondContact O-N 3.23Å; A199-C202 WeakPolarHBondContact O-CB 3.48Å; A199-C202 PolarHBondContact O-N 3.45Å; L200-C202 VanDerWaalsContact C-N 3.34Å; C202-K204 VanDerWaalsContact C-N 3.32Å; C202-K204 PolarHBondContact O-N 2.98Å; C202-N205 PolarHBondContact O-N 3.44Å; C202-S206 PolarHBondContact O-N 3.46Å; C202-L295 HydrophobicContact CB-CD2 4.24Å; C202-L295 HydrophobicContact CB-CG 4.24Å
203	V	97.8	Very high	94.2	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-58	-45.6	178.4	170.1	0	0	0	0	110.6	V155 C159 V165 A199 L200 S206 G207 S208	V155-V203 HydrophobicContact CG1-CG2 3.77Å; C159-V203 HydrophobicContact CB-CG2 4.5Å; C159-V203 PolarHBondContact SG-N 2.83Å; C159-V203 VanDerWaalsContact SG-N 3.44Å; V165-V203 HydrophobicContact CB-CG2 4.49Å; V165-V203 HydrophobicContact CG2-CG2 4.29Å; A199-V203 WeakPolarHBondContact O-CG2 3.27Å; A199-V203 PolarHBondContact O-N 2.97Å; L200-V203 PolarHBondContact O-N 3.42Å; V203-S206 PolarHBondContact O-N 3.08Å; V203-S206 PolarHBondContact O-OG 3.39Å; V203-G207 PolarHBondContact O-N 3.46Å; V203-S208 PolarHBondContact O-N 3.28Å
204	K	96.9	Very high	94	Very high	84 Å²	84	37.1 Å²	37.1	37%	0.365	22%	0.218	S	C	.	.	H	α-helix	trans	-55.1	-53.6	172.9	-178.4	175	174.8	170.9	0	111.4	L200 Q201 C202 S206 G207 L216 D217 L220	L200-K204 PolarHBondContact O-N 3.4Å; Q201-K204 PolarHBondContact O-N 3.3Å; C202-K204 VanDerWaalsContact C-N 3.32Å; C202-K204 PolarHBondContact O-N 2.98Å; K204-S206 PolarHBondContact O-N 2.73Å; K204-S206 VanDerWaalsContact O-N 3.16Å; K204-G207 PolarHBondContact O-N 3.29Å; K204-L216 HydrophobicContact CB-CD2 3.77Å; K204-L216 HydrophobicContact CB-CG 4.42Å; K204-L216 HydrophobicContact CG-CD2 4.41Å; K204-D217 VanDerWaalsContact CD-OD1 3.27Å; K204-D217 WeakPolarHBondContact CD-OD1 3.44Å; K204-D217 WeakPolarHBondContact CE-OD1 3.26Å; K204-D217 IonicContact NZ-OD1 3.11Å; K204-D217 PolarHBondContact NZ-OD1 2.62Å; K204-D217 IonicContact NZ-OD2 3.27Å; K204-D217 PolarHBondContact NZ-OD2 3.27Å; K204-L220 HydrophobicContact CB-CD1 4.27Å; K204-L220 HydrophobicContact CD-CD1 3.61Å
205	N	95.9	Very high	93.9	Very high	99 Å²	99	38.6 Å²	38.6	53%	0.529	23%	0.226	S	C	.	.	H	α-helix	trans	-63.5	-22.5	-178.3	-67.8	-3.3	0	0	0	113.5	Q201 C202	Q201-N205 PolarHBondContact NE2-OD1 3.13Å; Q201-N205 WeakPolarHBondContact O-CB 3.42Å; Q201-N205 PolarHBondContact O-N 3.01Å; Q201-N205 PolarHBondContact O-OD1 3.49Å; C202-N205 PolarHBondContact O-N 3.44Å
206	S	94	Very high	93.8	Very high	47 Å²	47	38.8 Å²	38.8	33%	0.329	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.4	176.4	75.1	0	0	0	0	114.1	C202 V203 K204 S208	C202-S206 PolarHBondContact O-N 3.46Å; V203-S206 PolarHBondContact O-N 3.08Å; V203-S206 PolarHBondContact O-OG 3.39Å; K204-S206 PolarHBondContact O-N 2.73Å; K204-S206 VanDerWaalsContact O-N 3.16Å; S206-S208 PolarHBondContact O-N 3.32Å; S206-S208 WeakPolarHBondContact OG-CB 3.29Å; S206-S208 PolarHBondContact OG-N 3.05Å; S206-S208 PolarHBondContact OG-OG 3.04Å
207	G	90.9	Very high	93.7	Very high	48 Å²	48	41.4 Å²	41.4	50%	0.495	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	3.7	-170.8	0	0	0	0	0	114.5	V203 K204 Y209 A210	V203-G207 PolarHBondContact O-N 3.46Å; K204-G207 PolarHBondContact O-N 3.29Å; G207-Y209 PolarHBondContact O-N 3.32Å; G207-A210 PolarHBondContact O-N 2.88Å
208	S	83.1	Confident	93.6	Very high	16 Å²	16	46.6 Å²	46.6	11%	0.112	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	6	-173.8	-61.8	0	0	0	0	115	N167 V203 S206	N167-S208 PolarHBondContact OD1-O 3.36Å; N167-S208 VanDerWaalsContact OD1-O 3.12Å; V203-S208 PolarHBondContact O-N 3.28Å; S206-S208 PolarHBondContact O-N 3.32Å; S206-S208 WeakPolarHBondContact OG-CB 3.29Å; S206-S208 PolarHBondContact OG-N 3.05Å; S206-S208 PolarHBondContact OG-OG 3.04Å
209	Y	86.2	Confident	93.6	Very high	6 Å²	6	46.7 Å²	46.7	2%	0.024	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	29.6	179.1	-155.1	-101.1	0	0	0	112.9	N167 H171 I174 G207 H211 N212 E215 L216	N167-Y209 HydrophobicContact CB-CD2 4.45Å; N167-Y209 HydrophobicContact CB-CE2 4.35Å; H171-Y209 HydrophobicContact CB-CE2 4.31Å; H171-Y209 PolarHBondContact CD2-OH 3.05Å; I174-Y209 HydrophobicContact CD1-CD1 4.11Å; I174-Y209 HydrophobicContact CD1-CE1 3.44Å; I174-Y209 VanDerWaalsContact CD1-CE1 3.44Å; I174-Y209 HydrophobicContact CD1-CE2 4.11Å; I174-Y209 VanDerWaalsContact CD1-CZ 3.46Å; G207-Y209 PolarHBondContact O-N 3.32Å; Y209-H211 VanDerWaalsContact C-N 3.26Å; Y209-H211 AromaticContact CD2-CE1 3.58Å; Y209-H211 AromaticContact CE2-CE1 3.65Å; Y209-H211 AromaticContact CG-CE1 3.96Å; Y209-H211 PolarHBondContact O-N 3.47Å; Y209-H211 VanDerWaalsContact O-N 3.13Å; Y209-N212 HydrophobicContact CD1-CB 4.05Å; Y209-N212 HydrophobicContact CE1-CB 3.42Å; Y209-N212 VanDerWaalsContact CE1-CB 3.42Å; Y209-N212 PolarHBondContact O-N 3.24Å; Y209-E215 PolarHBondContact OH-OE2 3.34Å; Y209-L216 HydrophobicContact CD1-CB 4Å; Y209-L216 HydrophobicContact CD1-CD2 4.01Å; Y209-L216 HydrophobicContact CE1-CB 4.36Å; Y209-L216 HydrophobicContact CG-CD2 4.32Å
210	A	80.3	Confident	93.6	Very high	77 Å²	77	47 Å²	47	64%	0.636	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-59.1	-28.8	-172.3	0	0	0	0	0	115.5	G207 N212	G207-A210 PolarHBondContact O-N 2.88Å; A210-N212 VanDerWaalsContact C-N 3.28Å; A210-N212 PolarHBondContact O-N 2.99Å
211	H	85.6	Confident	93.5	Very high	109 Å²	109	51.4 Å²	51.4	51%	0.505	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-61.9	-28	-179.9	63	-63.5	0	0	0	114.7	N167 Y209	N167-H211 PolarHBondContact ND2-CE1 3.44Å; Y209-H211 VanDerWaalsContact C-N 3.26Å; Y209-H211 AromaticContact CD2-CE1 3.58Å; Y209-H211 AromaticContact CE2-CE1 3.65Å; Y209-H211 AromaticContact CG-CE1 3.96Å; Y209-H211 PolarHBondContact O-N 3.47Å; Y209-H211 VanDerWaalsContact O-N 3.13Å
212	N	88.5	Confident	93.5	Very high	66 Å²	66	53.6 Å²	53.6	35%	0.353	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-131.1	44.5	-179.4	-76.3	14.2	0	0	0	110.5	Y209 A210 E214 E215 L216	Y209-N212 HydrophobicContact CD1-CB 4.05Å; Y209-N212 HydrophobicContact CE1-CB 3.42Å; Y209-N212 VanDerWaalsContact CE1-CB 3.42Å; Y209-N212 PolarHBondContact O-N 3.24Å; A210-N212 VanDerWaalsContact C-N 3.28Å; A210-N212 PolarHBondContact O-N 2.99Å; N212-E214 VanDerWaalsContact C-N 3.28Å; N212-E214 PolarHBondContact O-N 2.91Å; N212-E215 HydrophobicContact CB-CB 4.31Å; N212-E215 PolarHBondContact ND2-OE2 2.93Å; N212-E215 PolarHBondContact O-N 2.88Å; N212-L216 PolarHBondContact O-N 2.88Å
213	A	91.6	Very high	93.5	Very high	48 Å²	48	53.4 Å²	53.4	40%	0.397	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-36.3	-175	0	0	0	0	0	113.2	L216 D217	A213-L216 PolarHBondContact O-N 3.46Å; A213-D217 WeakPolarHBondContact O-CB 3.49Å; A213-D217 VanDerWaalsContact O-CG 3.28Å; A213-D217 PolarHBondContact O-N 3.41Å
214	E	94.3	Very high	93.6	Very high	156 Å²	156	55.4 Å²	55.4	73%	0.729	31%	0.31	S	S	*	.	H	α-helix	trans	-63.6	-44.5	178.7	-174.2	-179.7	-176.6	0	0	112.5	N212 L216 D217 L218	N212-E214 VanDerWaalsContact C-N 3.28Å; N212-E214 PolarHBondContact O-N 2.91Å; E214-L216 VanDerWaalsContact C-N 3.32Å; E214-L216 PolarHBondContact O-N 3.05Å; E214-D217 PolarHBondContact O-N 2.94Å; E214-L218 HydrophobicContact CG-CD1 4.32Å; E214-L218 WeakPolarHBondContact O-CG 3.49Å; E214-L218 PolarHBondContact O-N 3.19Å
215	E	96.1	Very high	93.6	Very high	32 Å²	32	57 Å²	57	15%	0.15	32%	0.319	C	S	.	.	H	α-helix	trans	-59.5	-44.2	176.2	-179	-173.7	-146.5	0	0	111.3	H171 I174 K175 E178 Y209 N212 D217 L218 T219	H171-E215 IonicContact CD2-OE1 3.82Å; H171-E215 IonicContact CD2-OE2 3.69Å; H171-E215 IonicContact NE2-OE1 3.83Å; I174-E215 HydrophobicContact CG2-CG 3.89Å; K175-E215 WeakPolarHBondContact CE-OE1 3.43Å; K175-E215 IonicContact NZ-OE1 2.72Å; K175-E215 PolarHBondContact NZ-OE1 3.3Å; E178-E215 WeakPolarHBondContact OE1-CG 3.24Å; Y209-E215 PolarHBondContact OH-OE2 3.34Å; N212-E215 HydrophobicContact CB-CB 4.31Å; N212-E215 PolarHBondContact ND2-OE2 2.93Å; N212-E215 PolarHBondContact O-N 2.88Å; E215-D217 VanDerWaalsContact C-N 3.33Å; E215-D217 PolarHBondContact O-N 2.95Å; E215-L218 PolarHBondContact O-N 3.46Å; E215-T219 WeakPolarHBondContact O-CB 3.39Å; E215-T219 PolarHBondContact O-N 2.74Å; E215-T219 PolarHBondContact O-OG1 3.07Å
216	L	96.9	Very high	93.6	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-40.1	177.1	179.1	55.8	0	0	0	111.6	I174 L200 K204 Y209 N212 A213 E214 T219 L220	I174-L216 HydrophobicContact CD1-CB 4.46Å; I174-L216 HydrophobicContact CD1-CD1 4.03Å; I174-L216 HydrophobicContact CG1-CD1 4.24Å; L200-L216 HydrophobicContact CB-CD1 3.87Å; L200-L216 HydrophobicContact CD1-CD1 4.37Å; L200-L216 HydrophobicContact CD2-CD1 4.02Å; L200-L216 HydrophobicContact CG-CD1 4.3Å; K204-L216 HydrophobicContact CB-CD2 3.77Å; K204-L216 HydrophobicContact CB-CG 4.42Å; K204-L216 HydrophobicContact CG-CD2 4.41Å; Y209-L216 HydrophobicContact CD1-CB 4Å; Y209-L216 HydrophobicContact CD1-CD2 4.01Å; Y209-L216 HydrophobicContact CE1-CB 4.36Å; Y209-L216 HydrophobicContact CG-CD2 4.32Å; N212-L216 PolarHBondContact O-N 2.88Å; A213-L216 PolarHBondContact O-N 3.46Å; E214-L216 VanDerWaalsContact C-N 3.32Å; E214-L216 PolarHBondContact O-N 3.05Å; L216-T219 PolarHBondContact O-N 3.41Å; L216-L220 HydrophobicContact CD1-CD1 4.25Å; L216-L220 HydrophobicContact CD1-CG 4.31Å; L216-L220 HydrophobicContact CG-CD1 4.16Å; L216-L220 WeakPolarHBondContact O-CG 3.37Å; L216-L220 PolarHBondContact O-N 3.39Å
217	D	96.9	Very high	93.8	Very high	56 Å²	56	52 Å²	52	30%	0.299	29%	0.286	S	S	.	.	H	α-helix	trans	-67.2	-44.2	178.8	-76.4	0.6	0	0	0	112.3	K204 A213 E214 E215 T219 L220 N221	K204-D217 VanDerWaalsContact CD-OD1 3.27Å; K204-D217 WeakPolarHBondContact CD-OD1 3.44Å; K204-D217 WeakPolarHBondContact CE-OD1 3.26Å; K204-D217 IonicContact NZ-OD1 3.11Å; K204-D217 PolarHBondContact NZ-OD1 2.62Å; K204-D217 IonicContact NZ-OD2 3.27Å; K204-D217 PolarHBondContact NZ-OD2 3.27Å; A213-D217 WeakPolarHBondContact O-CB 3.49Å; A213-D217 VanDerWaalsContact O-CG 3.28Å; A213-D217 PolarHBondContact O-N 3.41Å; E214-D217 PolarHBondContact O-N 2.94Å; E215-D217 VanDerWaalsContact C-N 3.33Å; E215-D217 PolarHBondContact O-N 2.95Å; D217-T219 VanDerWaalsContact C-N 3.27Å; D217-T219 PolarHBondContact O-N 3.32Å; D217-L220 PolarHBondContact O-N 3.28Å; D217-N221 WeakPolarHBondContact O-CB 3.41Å; D217-N221 VanDerWaalsContact O-CG 3.31Å; D217-N221 PolarHBondContact O-N 2.99Å; D217-N221 PolarHBondContact O-ND2 2.9Å
218	L	97.4	Very high	94.2	Very high	108 Å²	108	52 Å²	52	57%	0.565	28%	0.275	S	S	*	.	H	α-helix	trans	-59.5	-41.7	173.1	-70.9	171.7	0	0	0	111.2	E214 E215 N221 K222	E214-L218 HydrophobicContact CG-CD1 4.32Å; E214-L218 WeakPolarHBondContact O-CG 3.49Å; E214-L218 PolarHBondContact O-N 3.19Å; E215-L218 PolarHBondContact O-N 3.46Å; L218-N221 PolarHBondContact O-N 2.88Å; L218-K222 PolarHBondContact O-N 3Å
219	T	98.1	Very high	94.8	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-65.3	-46.6	178.1	-62.5	0	0	0	0	112.2	I174 A177 L200 E215 L216 D217 N221 K222 I223	I174-T219 HydrophobicContact CG2-CG2 4.42Å; A177-T219 HydrophobicContact CB-CG2 3.68Å; L200-T219 HydrophobicContact CD1-CG2 3.89Å; E215-T219 WeakPolarHBondContact O-CB 3.39Å; E215-T219 PolarHBondContact O-N 2.74Å; E215-T219 PolarHBondContact O-OG1 3.07Å; L216-T219 PolarHBondContact O-N 3.41Å; D217-T219 VanDerWaalsContact C-N 3.27Å; D217-T219 PolarHBondContact O-N 3.32Å; T219-N221 VanDerWaalsContact C-N 3.3Å; T219-N221 PolarHBondContact O-N 3.04Å; T219-K222 PolarHBondContact O-N 3.02Å; T219-K222 VanDerWaalsContact O-N 3.16Å; T219-I223 HydrophobicContact CG2-CD1 4.11Å; T219-I223 WeakPolarHBondContact O-CG1 3.49Å; T219-I223 PolarHBondContact O-N 2.86Å
220	L	98.5	Very high	95.3	Very high	6 Å²	6	56.4 Å²	56.4	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-42	176.1	-75.3	166.8	0	0	0	111.4	L200 Q201 K204 L216 D217 I223 K224 M253	L200-L220 HydrophobicContact CB-CD2 3.83Å; L200-L220 HydrophobicContact CB-CG 4.46Å; Q201-L220 HydrophobicContact CB-CD2 4.1Å; K204-L220 HydrophobicContact CB-CD1 4.27Å; K204-L220 HydrophobicContact CD-CD1 3.61Å; L216-L220 HydrophobicContact CD1-CD1 4.25Å; L216-L220 HydrophobicContact CD1-CG 4.31Å; L216-L220 HydrophobicContact CG-CD1 4.16Å; L216-L220 WeakPolarHBondContact O-CG 3.37Å; L216-L220 PolarHBondContact O-N 3.39Å; D217-L220 PolarHBondContact O-N 3.28Å; L220-I223 PolarHBondContact O-N 3.23Å; L220-K224 WeakPolarHBondContact O-CB 3.49Å; L220-K224 PolarHBondContact O-N 3.23Å; L220-M253 HydrophobicContact CD2-CG 4.16Å; L220-M253 HydrophobicContact CD2-SD 3.76Å
221	N	98.1	Very high	96.2	Very high	93 Å²	93	57.9 Å²	57.9	50%	0.497	30%	0.301	S	S	.	.	H	α-helix	trans	-61.2	-44.7	174.1	-75.1	-28.9	0	0	0	111.6	D217 L218 T219 I223 K224 Q225	D217-N221 WeakPolarHBondContact O-CB 3.41Å; D217-N221 VanDerWaalsContact O-CG 3.31Å; D217-N221 PolarHBondContact O-N 2.99Å; D217-N221 PolarHBondContact O-ND2 2.9Å; L218-N221 PolarHBondContact O-N 2.88Å; T219-N221 VanDerWaalsContact C-N 3.3Å; T219-N221 PolarHBondContact O-N 3.04Å; N221-I223 PolarHBondContact O-N 3.36Å; N221-K224 PolarHBondContact O-N 3.48Å; N221-Q225 WeakPolarHBondContact O-CG 3.48Å; N221-Q225 PolarHBondContact O-N 3.39Å
222	K	98.2	Very high	96.7	Very high	65 Å²	65	57.7 Å²	57.7	28%	0.283	30%	0.295	S	S	.	.	H	α-helix	trans	-60	-45.4	176.1	-177.9	171.5	179	166.1	0	112	E178 E180 L218 T219 Q225 K226	E178-K222 PolarHBondContact O-NZ 3.13Å; E180-K222 VanDerWaalsContact OE1-CE 3.24Å; E180-K222 WeakPolarHBondContact OE1-CE 3.4Å; E180-K222 IonicContact OE1-NZ 3.83Å; E180-K222 PolarHBondContact OE1-NZ 3.5Å; L218-K222 PolarHBondContact O-N 3Å; T219-K222 PolarHBondContact O-N 3.02Å; T219-K222 VanDerWaalsContact O-N 3.16Å; K222-Q225 PolarHBondContact O-N 2.81Å; K222-K226 WeakPolarHBondContact O-CG 3.5Å; K222-K226 PolarHBondContact O-N 2.93Å
223	I	98.6	Very high	97.1	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-48	176.6	-66.7	172.2	0	0	0	110.3	A177 Y193 A196 L200 T219 L220 N221 Q225 K226 L227 M253	A177-I223 HydrophobicContact CB-CD1 4.01Å; A177-I223 HydrophobicContact CB-CG1 4.1Å; Y193-I223 HydrophobicContact CD1-CB 4.37Å; Y193-I223 HydrophobicContact CD1-CG1 4.04Å; Y193-I223 HydrophobicContact CD1-CG2 4.19Å; Y193-I223 HydrophobicContact CE1-CG1 4.46Å; Y193-I223 VanDerWaalsContact O-CG2 3.25Å; Y193-I223 WeakPolarHBondContact O-CG2 3.38Å; A196-I223 HydrophobicContact CB-CD1 4.27Å; L200-I223 HydrophobicContact CD1-CD1 3.94Å; T219-I223 HydrophobicContact CG2-CD1 4.11Å; T219-I223 WeakPolarHBondContact O-CG1 3.49Å; T219-I223 PolarHBondContact O-N 2.86Å; L220-I223 PolarHBondContact O-N 3.23Å; N221-I223 PolarHBondContact O-N 3.36Å; I223-Q225 VanDerWaalsContact C-N 3.32Å; I223-Q225 PolarHBondContact O-N 3.3Å; I223-K226 PolarHBondContact O-N 3.04Å; I223-L227 HydrophobicContact CG2-CD1 4.29Å; I223-L227 HydrophobicContact CG2-CG 4.48Å; I223-L227 WeakPolarHBondContact O-CG 3.46Å; I223-L227 PolarHBondContact O-N 2.7Å; I223-M253 HydrophobicContact CG2-CE 4.12Å; I223-M253 HydrophobicContact CG2-SD 4.32Å
224	K	98.3	Very high	97.4	Very high	43 Å²	43	62 Å²	62	19%	0.187	32%	0.322	C	S	.	.	H	α-helix	trans	-56.6	-44.7	177.3	-177.9	168.7	-179	161.8	0	111.8	L220 N221 L227 L228 L250 M253 S255	L220-K224 WeakPolarHBondContact O-CB 3.49Å; L220-K224 PolarHBondContact O-N 3.23Å; N221-K224 PolarHBondContact O-N 3.48Å; K224-L227 PolarHBondContact O-N 3.14Å; K224-L228 HydrophobicContact CG-CD1 4.16Å; K224-L228 WeakPolarHBondContact O-CG 3.26Å; K224-L228 PolarHBondContact O-N 3.26Å; K224-L250 HydrophobicContact CG-CD2 3.88Å; K224-M253 HydrophobicContact CB-CE 4.03Å; K224-S255 WeakPolarHBondContact CE-OG 3.15Å; K224-S255 PolarHBondContact NZ-OG 3.35Å
225	Q	97.3	Very high	97.6	Very high	118 Å²	118	54.6 Å²	54.6	55%	0.551	29%	0.289	S	S	*	.	H	α-helix	trans	-65.3	-41.4	176.8	-67.1	-53.5	-33.9	0	0	112.7	N221 K222 I223 L227 L228 A229	N221-Q225 WeakPolarHBondContact O-CG 3.48Å; N221-Q225 PolarHBondContact O-N 3.39Å; K222-Q225 PolarHBondContact O-N 2.81Å; I223-Q225 VanDerWaalsContact C-N 3.32Å; I223-Q225 PolarHBondContact O-N 3.3Å; Q225-L227 PolarHBondContact O-N 3.48Å; Q225-L228 PolarHBondContact O-N 2.66Å; Q225-A229 VanDerWaalsContact O-CB 3.24Å; Q225-A229 WeakPolarHBondContact O-CB 3.34Å; Q225-A229 PolarHBondContact O-N 2.75Å
226	K	97.5	Very high	97.7	Very high	39 Å²	39	53.8 Å²	53.8	17%	0.17	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-48.4	175	-76.5	-77.3	-172.2	167.7	0	111.1	E180 E188 Y193 K222 I223 L228 A229 S230	E180-K226 VanDerWaalsContact CD-NZ 3.3Å; E180-K226 IonicContact OE1-NZ 3.41Å; E180-K226 IonicContact OE2-NZ 3.19Å; E180-K226 PolarHBondContact OE2-NZ 2.72Å; E188-K226 IonicContact OE1-NZ 2.9Å; E188-K226 PolarHBondContact OE1-NZ 3.16Å; E188-K226 IonicContact OE2-NZ 3.51Å; Y193-K226 HydrophobicContact CD1-CB 4.13Å; Y193-K226 HydrophobicContact CD1-CG 4.44Å; Y193-K226 HydrophobicContact CE1-CB 4.13Å; Y193-K226 HydrophobicContact CE1-CG 3.94Å; Y193-K226 HydrophobicContact CG-CB 4.46Å; K222-K226 WeakPolarHBondContact O-CG 3.5Å; K222-K226 PolarHBondContact O-N 2.93Å; I223-K226 PolarHBondContact O-N 3.04Å; K226-L228 PolarHBondContact O-N 2.84Å; K226-A229 PolarHBondContact O-N 3.29Å; K226-S230 PolarHBondContact O-N 3.34Å; K226-S230 VanDerWaalsContact O-N 3.07Å; K226-S230 PolarHBondContact O-OG 3.36Å
227	L	98.3	Very high	97.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-46.8	176.9	-65.6	177.4	0	0	0	112	I190 A194 I223 K224 Q225 A229 S230 I237 A246 A249 L250 M253	I190-L227 HydrophobicContact CG2-CD2 3.77Å; A194-L227 HydrophobicContact CB-CD2 4.25Å; I223-L227 HydrophobicContact CG2-CD1 4.29Å; I223-L227 HydrophobicContact CG2-CG 4.48Å; I223-L227 WeakPolarHBondContact O-CG 3.46Å; I223-L227 PolarHBondContact O-N 2.7Å; K224-L227 PolarHBondContact O-N 3.14Å; Q225-L227 PolarHBondContact O-N 3.48Å; L227-A229 PolarHBondContact O-N 3.36Å; L227-S230 PolarHBondContact O-N 3.25Å; L227-I237 WeakPolarHBondContact O-CG2 3.3Å; L227-A246 HydrophobicContact CD2-CB 4.19Å; L227-A249 HydrophobicContact CD1-CB 3.81Å; L227-L250 HydrophobicContact CB-CD2 4.23Å; L227-L250 HydrophobicContact CD1-CD2 4.31Å; L227-L250 HydrophobicContact CD1-CG 4.33Å; L227-M253 HydrophobicContact CD1-CE 3.9Å
228	L	97.3	Very high	97.7	Very high	50 Å²	50	52.2 Å²	52.2	26%	0.262	28%	0.282	S	S	.	.	H	α-helix	trans	-66.1	-38	179.7	-68.7	171.3	0	0	0	112.6	K224 Q225 K226 S230 R231 L250	K224-L228 HydrophobicContact CG-CD1 4.16Å; K224-L228 WeakPolarHBondContact O-CG 3.26Å; K224-L228 PolarHBondContact O-N 3.26Å; Q225-L228 PolarHBondContact O-N 2.66Å; K226-L228 PolarHBondContact O-N 2.84Å; L228-S230 VanDerWaalsContact C-N 3.26Å; L228-S230 PolarHBondContact O-N 3.28Å; L228-R231 WeakPolarHBondContact O-CB 3.36Å; L228-R231 PolarHBondContact O-N 2.98Å; L228-L250 HydrophobicContact CD2-CD1 3.97Å; L228-L250 HydrophobicContact CD2-CD2 4.06Å; L228-L250 HydrophobicContact CG-CD2 4.04Å
229	A	96.9	Very high	97.7	Very high	84 Å²	84	49.1 Å²	49.1	69%	0.694	27%	0.266	S	S	*	.	H	α-helix	trans	-68.5	-25.2	178.2	0	0	0	0	0	112.8	Q225 K226 L227 R231	Q225-A229 VanDerWaalsContact O-CB 3.24Å; Q225-A229 WeakPolarHBondContact O-CB 3.34Å; Q225-A229 PolarHBondContact O-N 2.75Å; K226-A229 PolarHBondContact O-N 3.29Å; L227-A229 PolarHBondContact O-N 3.36Å; A229-R231 PolarHBondContact O-N 2.82Å
230	S	97.2	Very high	97.7	Very high	29 Å²	29	50.8 Å²	50.8	20%	0.203	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	7.5	176.9	-55.5	0	0	0	0	114	I190 K226 L227 L228 R232 G238	I190-S230 WeakPolarHBondContact CD1-OG 3.47Å; K226-S230 PolarHBondContact O-N 3.34Å; K226-S230 VanDerWaalsContact O-N 3.07Å; K226-S230 PolarHBondContact O-OG 3.36Å; L227-S230 PolarHBondContact O-N 3.25Å; L228-S230 VanDerWaalsContact C-N 3.26Å; L228-S230 PolarHBondContact O-N 3.28Å; S230-R232 PolarHBondContact O-N 3.44Å; S230-G238 PolarHBondContact O-N 3.09Å
231	R	97.9	Very high	97.7	Very high	109 Å²	109	51.5 Å²	51.5	41%	0.411	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-72.5	122.3	174.6	-172.5	168.9	57.4	-171.3	-2.5	111.1	L228 A229 H236 I237	L228-R231 WeakPolarHBondContact O-CB 3.36Å; L228-R231 PolarHBondContact O-N 2.98Å; A229-R231 PolarHBondContact O-N 2.82Å; R231-H236 CarbonylContact C-O 3.55Å; R231-H236 WeakPolarHBondContact CA-O 3.49Å; R231-I237 HydrophobicContact CB-CG1 4.17Å; R231-I237 HydrophobicContact CG-CG1 4.31Å
232	R	97.5	Very high	97.7	Very high	104 Å²	104	47.3 Å²	47.3	39%	0.392	25%	0.254	S	S	.	.			trans	-76.1	166.2	175.4	-73	165.6	52.5	153.6	-8.8	111.7	S230 D234 G235 H236 G238 E240	S230-R232 PolarHBondContact O-N 3.44Å; R232-D234 WeakPolarHBondContact CB-OD1 3.47Å; R232-D234 IonicContact CZ-OD2 2.82Å; R232-D234 VanDerWaalsContact CZ-OD2 3.31Å; R232-D234 IonicContact NE-OD1 3.69Å; R232-D234 IonicContact NE-OD2 3.56Å; R232-D234 PolarHBondContact NE-OD2 3.49Å; R232-D234 VanDerWaalsContact NE-OD2 3.11Å; R232-D234 IonicContact NH2-OD2 3.32Å; R232-D234 PolarHBondContact NH2-OD2 2.65Å; R232-D234 PolarHBondContact O-N 3.07Å; R232-G235 PolarHBondContact O-N 3.34Å; R232-H236 WeakPolarHBondContact CB-O 3.47Å; R232-H236 PolarHBondContact N-O 3Å; R232-G238 WeakPolarHBondContact CD-O 3.31Å; R232-E240 IonicContact CZ-OE1 3.5Å; R232-E240 IonicContact NH2-OE1 2.71Å; R232-E240 PolarHBondContact NH2-OE1 3.45Å
233	S	97	Very high	97.7	Very high	136 Å²	136	44.2 Å²	44.2	95%	0.951	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.3	175.4	51.6	0	0	0	0	113.7	G235	S233-G235 VanDerWaalsContact C-N 3.26Å
234	D	96.8	Very high	97.7	Very high	68 Å²	68	44.2 Å²	44.2	36%	0.364	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.2	174.3	61.9	19.5	0	0	0	113.7	R232 H236 A266	R232-D234 WeakPolarHBondContact CB-OD1 3.47Å; R232-D234 IonicContact CZ-OD2 2.82Å; R232-D234 VanDerWaalsContact CZ-OD2 3.31Å; R232-D234 IonicContact NE-OD1 3.69Å; R232-D234 IonicContact NE-OD2 3.56Å; R232-D234 PolarHBondContact NE-OD2 3.49Å; R232-D234 VanDerWaalsContact NE-OD2 3.11Å; R232-D234 IonicContact NH2-OD2 3.32Å; R232-D234 PolarHBondContact NH2-OD2 2.65Å; R232-D234 PolarHBondContact O-N 3.07Å; D234-H236 WeakPolarHBondContact OD1-CB 3.26Å; D234-H236 IonicContact OD1-CG 3.84Å; D234-H236 PolarHBondContact OD1-N 2.93Å; D234-H236 IonicContact OD1-ND1 3.8Å; D234-H236 PolarHBondContact OD1-ND1 3.5Å; D234-H236 IonicContact OD2-ND1 3.08Å; D234-A266 WeakPolarHBondContact O-CB 3.32Å
235	G	97.8	Very high	97.7	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.021	23%	0.232	C	C	.	.	S	Bend	trans	92.8	-12.2	177.3	0	0	0	0	0	115.3	R232 S233 S263	R232-G235 PolarHBondContact O-N 3.34Å; S233-G235 VanDerWaalsContact C-N 3.26Å; G235-S263 VanDerWaalsContact O-CA 3.28Å; G235-S263 WeakPolarHBondContact O-CA 3.27Å; G235-S263 WeakPolarHBondContact O-CB 3.41Å; G235-S263 PolarHBondContact O-OG 2.81Å
236	H	98.6	Very high	97.8	Very high	14 Å²	14	36.5 Å²	36.5	7%	0.065	21%	0.206	C	C	.	.			trans	-69.8	145.2	175.8	-68	102.2	0	0	0	111.6	R231 R232 D234 T243 A266	R231-H236 CarbonylContact C-O 3.55Å; R231-H236 WeakPolarHBondContact CA-O 3.49Å; R232-H236 WeakPolarHBondContact CB-O 3.47Å; R232-H236 PolarHBondContact N-O 3Å; D234-H236 WeakPolarHBondContact OD1-CB 3.26Å; D234-H236 IonicContact OD1-CG 3.84Å; D234-H236 PolarHBondContact OD1-N 2.93Å; D234-H236 IonicContact OD1-ND1 3.8Å; D234-H236 PolarHBondContact OD1-ND1 3.5Å; D234-H236 IonicContact OD2-ND1 3.08Å; H236-T243 WeakPolarHBondContact CA-OG1 3.21Å; H236-T243 WeakPolarHBondContact CB-OG1 3.48Å; H236-T243 PolarHBondContact CD2-OG1 3.28Å; H236-A266 PolarHBondContact NE2-O 3.43Å
237	I	98.4	Very high	97.9	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.015	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-100.5	111.4	175	-60.1	170.5	0	0	0	108.2	I190 L227 R231 N239 T243 A246 V247 L250	I190-I237 HydrophobicContact CG2-CG2 3.87Å; L227-I237 WeakPolarHBondContact O-CG2 3.3Å; R231-I237 HydrophobicContact CB-CG1 4.17Å; R231-I237 HydrophobicContact CG-CG1 4.31Å; I237-N239 PolarHBondContact O-N 3.3Å; I237-N239 VanDerWaalsContact O-N 3.16Å; I237-T243 PolarHBondContact N-OG1 3.42Å; I237-T243 PolarHBondContact O-OG1 3.09Å; I237-A246 HydrophobicContact CB-CB 3.79Å; I237-A246 HydrophobicContact CD1-CB 4.05Å; I237-A246 HydrophobicContact CG2-CB 3.58Å; I237-V247 HydrophobicContact CD1-CG2 4.4Å; I237-L250 HydrophobicContact CD1-CD1 3.76Å
238	G	96.5	Very high	97.9	Very high	24 Å²	24	34.7 Å²	34.7	25%	0.247	20%	0.198	C	C	.	.	S	Bend	trans	76.1	-90.1	-167.4	0	0	0	0	0	111	S230 R232	S230-G238 PolarHBondContact O-N 3.09Å; R232-G238 WeakPolarHBondContact CD-O 3.31Å
239	N	96.6	Very high	98	Very high	42 Å²	42	32.3 Å²	32.3	23%	0.225	19%	0.185	C	C	.	.	S	Bend	trans	-141.5	-177.4	174.1	69.4	32.1	0	0	0	110.7	I237 F241 S242 T243	I237-N239 PolarHBondContact O-N 3.3Å; I237-N239 VanDerWaalsContact O-N 3.16Å; N239-F241 PolarHBondContact O-N 3.25Å; N239-F241 WeakPolarHBondContact OD1-CA 3.36Å; N239-F241 PolarHBondContact OD1-N 2.93Å; N239-S242 PolarHBondContact O-N 3.49Å; N239-S242 PolarHBondContact OD1-N 3.29Å; N239-S242 PolarHBondContact OD1-OG 2.9Å; N239-T243 PolarHBondContact O-N 3.24Å; N239-T243 VanDerWaalsContact O-N 3.17Å; N239-T243 PolarHBondContact O-OG1 3.47Å
240	E	97.9	Very high	98	Very high	38 Å²	38	28.4 Å²	28.4	18%	0.178	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-37.5	-178.2	-61.2	74.9	-168	0	0	111.9	R232 T275 Y276	R232-E240 IonicContact CZ-OE1 3.5Å; R232-E240 IonicContact NH2-OE1 2.71Å; R232-E240 PolarHBondContact NH2-OE1 3.45Å; E240-T275 HydrophobicContact CB-CG2 4.05Å; E240-T275 HydrophobicContact CG-CG2 4.37Å; E240-Y276 VanDerWaalsContact O-CE1 3.23Å; E240-Y276 WeakPolarHBondContact O-CE1 3.39Å; E240-Y276 PolarHBondContact O-OH 3.33Å
241	F	98.1	Very high	98.1	Very high	21 Å²	21	28.3 Å²	28.3	9%	0.092	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-29.1	-175.6	-56.5	-71.7	0	0	0	113.7	N239 T275 Y276 A281 T406 E407	N239-F241 PolarHBondContact O-N 3.25Å; N239-F241 WeakPolarHBondContact OD1-CA 3.36Å; N239-F241 PolarHBondContact OD1-N 2.93Å; F241-T275 HydrophobicContact CE1-CG2 4.15Å; F241-T275 HydrophobicContact CZ-CG2 3.91Å; F241-Y276 HydrophobicContact CD1-CD1 4.05Å; F241-Y276 HydrophobicContact CD1-CE1 4.14Å; F241-Y276 HydrophobicContact CE1-CD1 4.07Å; F241-Y276 HydrophobicContact CE1-CE1 4.41Å; F241-A281 HydrophobicContact CD1-CB 3.89Å; F241-A281 HydrophobicContact CE1-CB 4.12Å; F241-T406 WeakPolarHBondContact CD2-O 3.37Å; F241-T406 WeakPolarHBondContact CE2-O 3.05Å; F241-E407 HydrophobicContact CE2-CG 3.82Å; F241-E407 HydrophobicContact CZ-CG 3.64Å
242	S	98.4	Very high	98.1	Very high	4 Å²	4	24 Å²	24	3%	0.028	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-22.5	176.2	-50.5	0	0	0	0	113.3	D191 N239 G244 L245 A246	D191-S242 VanDerWaalsContact OD1-CA 3.31Å; D191-S242 WeakPolarHBondContact OD1-CA 3.29Å; D191-S242 WeakPolarHBondContact OD1-CB 3.13Å; D191-S242 PolarHBondContact OD1-OG 3.29Å; D191-S242 PolarHBondContact OD2-OG 2.99Å; N239-S242 PolarHBondContact O-N 3.49Å; N239-S242 PolarHBondContact OD1-N 3.29Å; N239-S242 PolarHBondContact OD1-OG 2.9Å; S242-G244 VanDerWaalsContact C-N 3.3Å; S242-G244 PolarHBondContact O-N 2.94Å; S242-L245 PolarHBondContact O-N 3.28Å; S242-A246 PolarHBondContact O-N 3.36Å
243	T	98.7	Very high	98.1	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.6	-37.9	-172.2	-61.6	0	0	0	0	112.5	H236 I237 N239 A246 V247 M267	H236-T243 WeakPolarHBondContact CA-OG1 3.21Å; H236-T243 WeakPolarHBondContact CB-OG1 3.48Å; H236-T243 PolarHBondContact CD2-OG1 3.28Å; I237-T243 PolarHBondContact N-OG1 3.42Å; I237-T243 PolarHBondContact O-OG1 3.09Å; N239-T243 PolarHBondContact O-N 3.24Å; N239-T243 VanDerWaalsContact O-N 3.17Å; N239-T243 PolarHBondContact O-OG1 3.47Å; T243-A246 PolarHBondContact O-N 3.47Å; T243-V247 HydrophobicContact CG2-CG2 4.26Å; T243-V247 WeakPolarHBondContact O-CG2 3.46Å; T243-V247 PolarHBondContact O-N 2.86Å; T243-M267 HydrophobicContact CG2-CE 4.36Å; T243-M267 HydrophobicContact CG2-CG 3.56Å; T243-M267 HydrophobicContact CG2-SD 3.78Å
244	G	98.6	Very high	98.1	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-55.8	-55.8	177.2	0	0	0	0	0	112.3	S242 A246 V247 Q248 M267 Q284 A288	S242-G244 VanDerWaalsContact C-N 3.3Å; S242-G244 PolarHBondContact O-N 2.94Å; G244-A246 PolarHBondContact O-N 2.86Å; G244-V247 PolarHBondContact O-N 3.19Å; G244-Q248 WeakPolarHBondContact O-CG 3.31Å; G244-Q248 PolarHBondContact O-N 2.82Å; G244-M267 VanDerWaalsContact CA-SD 3.54Å; G244-Q284 CarbonylContact C-O 3.27Å; G244-A288 WeakPolarHBondContact O-CB 3.46Å
245	L	98.9	Very high	98.1	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64	-39.5	178.2	-66.2	178.9	0	0	0	112.3	Y149 D191 A194 M195 M198 S242 V247 Q248 A249 Q284 Y294	Y149-L245 HydrophobicContact CE2-CD1 3.71Å; Y149-L245 WeakPolarHBondContact OH-CD1 3.35Å; D191-L245 HydrophobicContact CB-CD1 4.37Å; A194-L245 HydrophobicContact CB-CB 3.88Å; M195-L245 HydrophobicContact CE-CD1 4.48Å; M195-L245 HydrophobicContact CE-CD2 4.27Å; M198-L245 HydrophobicContact CE-CD2 4.28Å; S242-L245 PolarHBondContact O-N 3.28Å; L245-V247 PolarHBondContact O-N 3.23Å; L245-Q248 WeakPolarHBondContact O-CB 3.45Å; L245-Q248 PolarHBondContact O-N 3.13Å; L245-A249 WeakPolarHBondContact O-CB 3.29Å; L245-A249 PolarHBondContact O-N 3.48Å; L245-Q284 HydrophobicContact CD2-CB 4.17Å; L245-Q284 HydrophobicContact CD2-CG 4.26Å; L245-Q284 HydrophobicContact CG-CB 4.19Å; L245-Q284 HydrophobicContact CG-CG 4.47Å; L245-Y294 HydrophobicContact CD2-CE2 3.96Å
246	A	98.8	Very high	97.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.3	-45.1	178.3	0	0	0	0	0	111.9	I190 L227 I237 S242 T243 G244 A249 L250	I190-A246 HydrophobicContact CG2-CB 4.16Å; L227-A246 HydrophobicContact CD2-CB 4.19Å; I237-A246 HydrophobicContact CB-CB 3.79Å; I237-A246 HydrophobicContact CD1-CB 4.05Å; I237-A246 HydrophobicContact CG2-CB 3.58Å; S242-A246 PolarHBondContact O-N 3.36Å; T243-A246 PolarHBondContact O-N 3.47Å; G244-A246 PolarHBondContact O-N 2.86Å; A246-A249 PolarHBondContact O-N 3.4Å; A246-L250 WeakPolarHBondContact O-CG 3.5Å; A246-L250 PolarHBondContact O-N 2.96Å
247	V	98.8	Very high	97.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.7	-42.4	175.4	171.8	0	0	0	0	110.9	I237 T243 G244 L245 A249 L250 L251 C260 M264 M267 A288	I237-V247 HydrophobicContact CD1-CG2 4.4Å; T243-V247 HydrophobicContact CG2-CG2 4.26Å; T243-V247 WeakPolarHBondContact O-CG2 3.46Å; T243-V247 PolarHBondContact O-N 2.86Å; G244-V247 PolarHBondContact O-N 3.19Å; L245-V247 PolarHBondContact O-N 3.23Å; V247-A249 VanDerWaalsContact C-N 3.29Å; V247-A249 PolarHBondContact O-N 3.43Å; V247-L250 PolarHBondContact O-N 2.89Å; V247-L251 HydrophobicContact CG1-CD1 4.05Å; V247-L251 HydrophobicContact CG1-CG 4.34Å; V247-L251 WeakPolarHBondContact O-CG 3.24Å; V247-L251 PolarHBondContact O-N 3.44Å; V247-C260 HydrophobicContact CG1-CB 4.05Å; V247-M264 HydrophobicContact CG1-CG 4.4Å; V247-M267 HydrophobicContact CB-CE 4.21Å; V247-M267 HydrophobicContact CG1-CE 4.41Å; V247-M267 HydrophobicContact CG2-CE 3.92Å; V247-A288 HydrophobicContact CB-CB 4.04Å; V247-A288 HydrophobicContact CG1-CB 3.96Å
248	Q	98.8	Very high	97.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-44	174.1	-66.7	-172.9	52.1	0	0	111.8	M198 G244 L245 L251 A252 Q284 A288 T293	M198-Q248 HydrophobicContact CE-CB 4.38Å; M198-Q248 HydrophobicContact SD-CB 3.8Å; G244-Q248 WeakPolarHBondContact O-CG 3.31Å; G244-Q248 PolarHBondContact O-N 2.82Å; L245-Q248 WeakPolarHBondContact O-CB 3.45Å; L245-Q248 PolarHBondContact O-N 3.13Å; Q248-L251 PolarHBondContact O-N 3.04Å; Q248-A252 VanDerWaalsContact O-CB 3.3Å; Q248-A252 WeakPolarHBondContact O-CB 3.26Å; Q248-A252 PolarHBondContact O-N 2.82Å; Q248-Q284 PolarHBondContact NE2-O 2.99Å; Q248-A288 HydrophobicContact CG-CB 3.88Å; Q248-T293 HydrophobicContact CB-CG2 4.17Å; Q248-T293 WeakPolarHBondContact O-CG2 3.34Å
249	A	98.8	Very high	96.8	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.9	-42.4	179.4	0	0	0	0	0	112.5	A194 M198 L227 L245 A246 V247 A252 M253	A194-A249 HydrophobicContact CB-CB 3.86Å; A194-A249 VanDerWaalsContact O-CB 3.29Å; A194-A249 WeakPolarHBondContact O-CB 3.43Å; M198-A249 HydrophobicContact CG-CB 3.93Å; L227-A249 HydrophobicContact CD1-CB 3.81Å; L245-A249 WeakPolarHBondContact O-CB 3.29Å; L245-A249 PolarHBondContact O-N 3.48Å; A246-A249 PolarHBondContact O-N 3.4Å; V247-A249 VanDerWaalsContact C-N 3.29Å; V247-A249 PolarHBondContact O-N 3.43Å; A249-A252 PolarHBondContact O-N 3.03Å; A249-M253 HydrophobicContact CB-CE 4.26Å; A249-M253 WeakPolarHBondContact O-CB 3.44Å; A249-M253 WeakPolarHBondContact O-CE 3.4Å; A249-M253 VanDerWaalsContact O-CG 3.31Å; A249-M253 WeakPolarHBondContact O-CG 3.42Å; A249-M253 PolarHBondContact O-N 2.87Å
250	L	98.8	Very high	96.8	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-60.5	-47	176	-71.8	172.4	0	0	0	111.4	K224 L227 L228 I237 A246 V247 M253 G254 S255	K224-L250 HydrophobicContact CG-CD2 3.88Å; L227-L250 HydrophobicContact CB-CD2 4.23Å; L227-L250 HydrophobicContact CD1-CD2 4.31Å; L227-L250 HydrophobicContact CD1-CG 4.33Å; L228-L250 HydrophobicContact CD2-CD1 3.97Å; L228-L250 HydrophobicContact CD2-CD2 4.06Å; L228-L250 HydrophobicContact CG-CD2 4.04Å; I237-L250 HydrophobicContact CD1-CD1 3.76Å; A246-L250 WeakPolarHBondContact O-CG 3.5Å; A246-L250 PolarHBondContact O-N 2.96Å; V247-L250 PolarHBondContact O-N 2.89Å; L250-M253 CarbonylContact O-C 3.57Å; L250-M253 PolarHBondContact O-N 3.23Å; L250-G254 PolarHBondContact O-N 2.88Å; L250-S255 VanDerWaalsContact O-CB 3.26Å; L250-S255 WeakPolarHBondContact O-CB 3.24Å; L250-S255 PolarHBondContact O-N 2.66Å; L250-S255 PolarHBondContact O-OG 2.98Å
251	L	98.5	Very high	96.6	Very high	27 Å²	27	26.3 Å²	26.3	14%	0.141	17%	0.17	C	C	.	.	H	α-helix	trans	-62.5	-43.3	176.4	-66.5	176	0	0	0	111.6	V247 Q248 M253 G254 V257 T293	V247-L251 HydrophobicContact CG1-CD1 4.05Å; V247-L251 HydrophobicContact CG1-CG 4.34Å; V247-L251 WeakPolarHBondContact O-CG 3.24Å; V247-L251 PolarHBondContact O-N 3.44Å; Q248-L251 PolarHBondContact O-N 3.04Å; L251-M253 VanDerWaalsContact C-N 3.28Å; L251-M253 PolarHBondContact O-N 3.24Å; L251-G254 PolarHBondContact O-N 3.39Å; L251-G254 VanDerWaalsContact O-N 3.09Å; L251-V257 HydrophobicContact CD2-CG2 4.01Å; L251-T293 HydrophobicContact CB-CG2 3.91Å
252	A	98.1	Very high	96.6	Very high	18 Å²	18	29 Å²	29	15%	0.149	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-40.2	176.5	0	0	0	0	0	112	M198 Q201 Q248 A249 G254 T293 L295	M198-A252 HydrophobicContact CG-CB 4.04Å; Q201-A252 VanDerWaalsContact CG-O 3.25Å; Q201-A252 WeakPolarHBondContact CG-O 3.48Å; Q248-A252 VanDerWaalsContact O-CB 3.3Å; Q248-A252 WeakPolarHBondContact O-CB 3.26Å; Q248-A252 PolarHBondContact O-N 2.82Å; A249-A252 PolarHBondContact O-N 3.03Å; A252-G254 PolarHBondContact O-N 3.17Å; A252-T293 HydrophobicContact CB-CG2 4.3Å; A252-L295 HydrophobicContact CB-CD1 3.91Å; A252-L295 HydrophobicContact CB-CD2 3.97Å; A252-L295 HydrophobicContact CB-CG 4.45Å
253	M	97.8	Very high	96.6	Very high	19 Å²	19	28.9 Å²	28.9	9%	0.094	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	20.5	177.2	-62.8	-176.2	-64.5	0	0	113.4	Q201 L220 I223 K224 L227 A249 L250 L251 S255	Q201-M253 HydrophobicContact CB-CG 4.1Å; Q201-M253 HydrophobicContact CG-CG 4.25Å; L220-M253 HydrophobicContact CD2-CG 4.16Å; L220-M253 HydrophobicContact CD2-SD 3.76Å; I223-M253 HydrophobicContact CG2-CE 4.12Å; I223-M253 HydrophobicContact CG2-SD 4.32Å; K224-M253 HydrophobicContact CB-CE 4.03Å; L227-M253 HydrophobicContact CD1-CE 3.9Å; A249-M253 HydrophobicContact CB-CE 4.26Å; A249-M253 WeakPolarHBondContact O-CB 3.44Å; A249-M253 WeakPolarHBondContact O-CE 3.4Å; A249-M253 VanDerWaalsContact O-CG 3.31Å; A249-M253 WeakPolarHBondContact O-CG 3.42Å; A249-M253 PolarHBondContact O-N 2.87Å; L250-M253 CarbonylContact O-C 3.57Å; L250-M253 PolarHBondContact O-N 3.23Å; L251-M253 VanDerWaalsContact C-N 3.28Å; L251-M253 PolarHBondContact O-N 3.24Å; M253-S255 PolarHBondContact O-N 2.74Å
254	G	96	Very high	96.5	Very high	55 Å²	55	29.1 Å²	29.1	57%	0.567	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.5	23.3	170.3	0	0	0	0	0	115.3	L250 L251 A252	L250-G254 PolarHBondContact O-N 2.88Å; L251-G254 PolarHBondContact O-N 3.39Å; L251-G254 VanDerWaalsContact O-N 3.09Å; A252-G254 PolarHBondContact O-N 3.17Å
255	S	96.4	Very high	96.5	Very high	11 Å²	11	31.8 Å²	31.8	8%	0.077	20%	0.201	C	C	.	.			trans	-69	144.7	162.6	-65	0	0	0	0	110.6	K224 L250 M253	K224-S255 WeakPolarHBondContact CE-OG 3.15Å; K224-S255 PolarHBondContact NZ-OG 3.35Å; L250-S255 VanDerWaalsContact O-CB 3.26Å; L250-S255 WeakPolarHBondContact O-CB 3.24Å; L250-S255 PolarHBondContact O-N 2.66Å; L250-S255 PolarHBondContact O-OG 2.98Å; M253-S255 PolarHBondContact O-N 2.74Å
256	E	94.1	Very high	96.5	Very high	136 Å²	136	32.1 Å²	32.1	64%	0.636	20%	0.204	S	C	*	.			trans	-72	152.2	174.4	-66.4	-59.8	148.5	0	0	110.8	G258 D259	E256-G258 PolarHBondContact O-N 3.41Å; E256-D259 PolarHBondContact N-OD2 2.86Å; E256-D259 WeakPolarHBondContact O-CB 3.42Å; E256-D259 PolarHBondContact O-N 3.27Å; E256-D259 VanDerWaalsContact O-N 3.08Å
257	V	90.6	Very high	96.4	Very high	47 Å²	47	32.1 Å²	32.1	29%	0.285	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-59.3	-34	176.7	177.1	0	0	0	0	111	L251 D259 C260 S261 M264 R291	L251-V257 HydrophobicContact CD2-CG2 4.01Å; V257-D259 VanDerWaalsContact C-N 3.3Å; V257-D259 PolarHBondContact O-N 2.87Å; V257-C260 PolarHBondContact O-N 3.32Å; V257-C260 VanDerWaalsContact O-N 3.15Å; V257-S261 PolarHBondContact O-N 3.27Å; V257-M264 HydrophobicContact CG1-SD 4.17Å; V257-R291 HydrophobicContact CG1-CG 4.37Å; V257-R291 HydrophobicContact CG2-CG 4.43Å
258	G	89.7	Confident	96.4	Very high	51 Å²	51	34.1 Å²	34.1	53%	0.526	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-58.6	-38.7	176.2	0	0	0	0	0	113.2	E256 C260 S261	E256-G258 PolarHBondContact O-N 3.41Å; G258-C260 PolarHBondContact O-N 3.31Å; G258-S261 VanDerWaalsContact O-CB 3.24Å; G258-S261 WeakPolarHBondContact O-CB 3.36Å; G258-S261 PolarHBondContact O-N 3.36Å; G258-S261 VanDerWaalsContact O-N 3.16Å; G258-S261 PolarHBondContact O-OG 2.67Å
259	D	91	Very high	96.3	Very high	95 Å²	95	37.6 Å²	37.6	51%	0.508	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-66.8	-25.9	179.5	-60.7	-27.2	0	0	0	112.3	E256 V257	E256-D259 PolarHBondContact N-OD2 2.86Å; E256-D259 WeakPolarHBondContact O-CB 3.42Å; E256-D259 PolarHBondContact O-N 3.27Å; E256-D259 VanDerWaalsContact O-N 3.08Å; V257-D259 VanDerWaalsContact C-N 3.3Å; V257-D259 PolarHBondContact O-N 2.87Å
260	C	95.8	Very high	96.3	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.014	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-93.4	-3.8	179.7	-59.1	0	0	0	0	113.1	V247 V257 G258 V262 S263 M264	V247-C260 HydrophobicContact CG1-CB 4.05Å; V257-C260 PolarHBondContact O-N 3.32Å; V257-C260 VanDerWaalsContact O-N 3.15Å; G258-C260 PolarHBondContact O-N 3.31Å; C260-V262 VanDerWaalsContact C-N 3.34Å; C260-V262 PolarHBondContact O-N 3.27Å; C260-S263 PolarHBondContact O-N 3.13Å; C260-S263 VanDerWaalsContact O-N 3.09Å; C260-M264 HydrophobicContact CB-CG 4.39Å; C260-M264 WeakPolarHBondContact O-CG 3.25Å; C260-M264 PolarHBondContact O-N 3.42Å
261	S	95.1	Very high	96.2	Very high	64 Å²	64	38.2 Å²	38.2	45%	0.448	24%	0.238	S	C	.	.	H	α-helix	trans	-54.8	-44.3	-171	57.2	0	0	0	0	113.8	V257 G258 M264 E265	V257-S261 PolarHBondContact O-N 3.27Å; G258-S261 VanDerWaalsContact O-CB 3.24Å; G258-S261 WeakPolarHBondContact O-CB 3.36Å; G258-S261 PolarHBondContact O-N 3.36Å; G258-S261 VanDerWaalsContact O-N 3.16Å; G258-S261 PolarHBondContact O-OG 2.67Å; S261-M264 PolarHBondContact O-N 2.9Å; S261-E265 PolarHBondContact O-N 3.16Å
262	V	97.1	Very high	96.1	Very high	78 Å²	78	41.3 Å²	41.3	47%	0.473	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-47.5	177.4	176.2	0	0	0	0	111.2	C260 E265 A266	C260-V262 VanDerWaalsContact C-N 3.34Å; C260-V262 PolarHBondContact O-N 3.27Å; V262-E265 PolarHBondContact O-N 3.25Å; V262-A266 PolarHBondContact O-N 2.88Å
263	S	98.4	Very high	95.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.007	27%	0.27	C	S	.	.	H	α-helix	trans	-70.6	-32.9	179.9	-57.1	0	0	0	0	112.4	G235 C260 A266 M267	G235-S263 VanDerWaalsContact O-CA 3.28Å; G235-S263 WeakPolarHBondContact O-CA 3.27Å; G235-S263 WeakPolarHBondContact O-CB 3.41Å; G235-S263 PolarHBondContact O-OG 2.81Å; C260-S263 PolarHBondContact O-N 3.13Å; C260-S263 VanDerWaalsContact O-N 3.09Å; S263-A266 PolarHBondContact O-N 3.5Å; S263-M267 WeakPolarHBondContact O-CG 3.37Å; S263-M267 PolarHBondContact O-N 2.98Å
264	M	97.6	Very high	95.7	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.02	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-42	171.1	-70.2	-171.9	122.7	0	0	111.9	V247 V257 C260 S261 M267 R268 A288 R291	V247-M264 HydrophobicContact CG1-CG 4.4Å; V257-M264 HydrophobicContact CG1-SD 4.17Å; C260-M264 HydrophobicContact CB-CG 4.39Å; C260-M264 WeakPolarHBondContact O-CG 3.25Å; C260-M264 PolarHBondContact O-N 3.42Å; S261-M264 PolarHBondContact O-N 2.9Å; M264-M267 HydrophobicContact CB-CE 4.49Å; M264-M267 HydrophobicContact CG-CE 4.23Å; M264-M267 PolarHBondContact O-N 3.3Å; M264-R268 WeakPolarHBondContact O-CG 3.42Å; M264-R268 PolarHBondContact O-N 3.19Å; M264-A288 WeakPolarHBondContact CE-O 2.98Å; M264-R291 HydrophobicContact CE-CG 3.85Å
265	E	97.6	Very high	95.7	Very high	57 Å²	57	47.7 Å²	47.7	27%	0.266	28%	0.275	S	S	.	.	H	α-helix	trans	-71.1	-34.8	177.9	-168.3	54.6	-146.4	0	0	112.8	S261 V262 R268 T269 R272	S261-E265 PolarHBondContact O-N 3.16Å; V262-E265 PolarHBondContact O-N 3.25Å; E265-R268 PolarHBondContact O-N 3.38Å; E265-R268 IonicContact OE2-CZ 3.47Å; E265-R268 IonicContact OE2-NH1 2.65Å; E265-R268 PolarHBondContact OE2-NH1 3.41Å; E265-T269 WeakPolarHBondContact O-CB 3.34Å; E265-T269 PolarHBondContact O-N 2.96Å; E265-T269 PolarHBondContact O-OG1 3.16Å; E265-R272 IonicContact OE1-NH1 2.93Å; E265-R272 PolarHBondContact OE1-NH1 3.33Å; E265-R272 VanDerWaalsContact OE1-NH1 3.08Å
266	A	98.2	Very high	95.7	Very high	7 Å²	7	47.3 Å²	47.3	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-48.6	171	0	0	0	0	0	111.1	D234 H236 V262 S263 R268 T269 A270	D234-A266 WeakPolarHBondContact O-CB 3.32Å; H236-A266 PolarHBondContact NE2-O 3.43Å; V262-A266 PolarHBondContact O-N 2.88Å; S263-A266 PolarHBondContact O-N 3.5Å; A266-R268 PolarHBondContact O-N 3.42Å; A266-T269 WeakPolarHBondContact O-CB 3.35Å; A266-T269 PolarHBondContact O-N 3.35Å; A266-T269 VanDerWaalsContact O-N 3.16Å; A266-A270 PolarHBondContact O-N 3.5Å
267	M	98.1	Very high	95.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-41.6	174.5	-70.8	-173.3	-65.9	0	0	112.6	T243 G244 V247 S263 M264 T269 A270 A271 Y276 T285 A288 L289	T243-M267 HydrophobicContact CG2-CE 4.36Å; T243-M267 HydrophobicContact CG2-CG 3.56Å; T243-M267 HydrophobicContact CG2-SD 3.78Å; G244-M267 VanDerWaalsContact CA-SD 3.54Å; V247-M267 HydrophobicContact CB-CE 4.21Å; V247-M267 HydrophobicContact CG1-CE 4.41Å; V247-M267 HydrophobicContact CG2-CE 3.92Å; S263-M267 WeakPolarHBondContact O-CG 3.37Å; S263-M267 PolarHBondContact O-N 2.98Å; M264-M267 HydrophobicContact CB-CE 4.49Å; M264-M267 HydrophobicContact CG-CE 4.23Å; M264-M267 PolarHBondContact O-N 3.3Å; M267-T269 VanDerWaalsContact C-N 3.29Å; M267-T269 PolarHBondContact O-N 3.38Å; M267-A270 PolarHBondContact O-N 2.9Å; M267-A271 VanDerWaalsContact O-CB 3.27Å; M267-A271 WeakPolarHBondContact O-CB 3.42Å; M267-A271 PolarHBondContact O-N 3.26Å; M267-Y276 HydrophobicContact CB-CE2 4.48Å; M267-Y276 WeakPolarHBondContact O-CE2 3.43Å; M267-T285 HydrophobicContact CB-CG2 4.29Å; M267-T285 HydrophobicContact CG-CG2 4.33Å; M267-T285 HydrophobicContact SD-CG2 3.81Å; M267-A288 HydrophobicContact CE-CB 4.01Å; M267-A288 HydrophobicContact SD-CB 4.45Å; M267-L289 HydrophobicContact CB-CD2 3.9Å; M267-L289 HydrophobicContact CB-CG 4.47Å; M267-L289 HydrophobicContact CE-CD2 4.07Å; M267-L289 HydrophobicContact CE-CG 4.41Å
268	R	97.9	Very high	95.9	Very high	41 Å²	41	42.2 Å²	42.2	16%	0.155	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-38.6	176.4	-68.3	-172.9	-161.4	108.3	5.1	111.9	N25 L28 M264 E265 A266 A271 R272 L289	N25-R268 WeakPolarHBondContact OD1-CD 3.36Å; L28-R268 HydrophobicContact CD2-CB 3.8Å; L28-R268 HydrophobicContact CD2-CG 3.92Å; M264-R268 WeakPolarHBondContact O-CG 3.42Å; M264-R268 PolarHBondContact O-N 3.19Å; E265-R268 PolarHBondContact O-N 3.38Å; E265-R268 IonicContact OE2-CZ 3.47Å; E265-R268 IonicContact OE2-NH1 2.65Å; E265-R268 PolarHBondContact OE2-NH1 3.41Å; A266-R268 PolarHBondContact O-N 3.42Å; R268-A271 PolarHBondContact O-N 3.49Å; R268-R272 VanDerWaalsContact O-CG 3.3Å; R268-R272 WeakPolarHBondContact O-CG 3.36Å; R268-R272 PolarHBondContact O-N 2.95Å; R268-L289 HydrophobicContact CG-CD2 3.74Å
269	T	97.4	Very high	96.2	Very high	74 Å²	74	42 Å²	42	45%	0.454	24%	0.235	S	C	.	.	H	α-helix	trans	-65.7	-44.7	177.2	-58.8	0	0	0	0	111.4	E265 A266 M267 R272 S273	E265-T269 WeakPolarHBondContact O-CB 3.34Å; E265-T269 PolarHBondContact O-N 2.96Å; E265-T269 PolarHBondContact O-OG1 3.16Å; A266-T269 WeakPolarHBondContact O-CB 3.35Å; A266-T269 PolarHBondContact O-N 3.35Å; A266-T269 VanDerWaalsContact O-N 3.16Å; M267-T269 VanDerWaalsContact C-N 3.29Å; M267-T269 PolarHBondContact O-N 3.38Å; T269-R272 PolarHBondContact O-N 2.89Å; T269-S273 PolarHBondContact O-N 3.36Å; T269-S273 VanDerWaalsContact O-N 3.11Å; T269-S273 PolarHBondContact O-OG 2.91Å
270	A	97.6	Very high	96.5	Very high	6 Å²	6	37.8 Å²	37.8	5%	0.05	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-43.5	174.6	0	0	0	0	0	111.6	A266 M267 R272 S273 N274 T275 Y276	A266-A270 PolarHBondContact O-N 3.5Å; M267-A270 PolarHBondContact O-N 2.9Å; A270-R272 PolarHBondContact O-N 2.92Å; A270-S273 CarbonylContact O-C 3.59Å; A270-S273 WeakPolarHBondContact O-CA 3.06Å; A270-S273 PolarHBondContact O-N 3.42Å; A270-S273 VanDerWaalsContact O-N 3.08Å; A270-N274 PolarHBondContact O-N 3.01Å; A270-T275 HydrophobicContact CB-CG2 4.37Å; A270-T275 WeakPolarHBondContact O-CB 3.35Å; A270-T275 PolarHBondContact O-N 3.42Å; A270-T275 PolarHBondContact O-OG1 3.43Å; A270-T275 VanDerWaalsContact O-OG1 3.13Å; A270-Y276 HydrophobicContact CB-CE2 3.86Å
271	A	97.1	Very high	96.6	Very high	10 Å²	10	37.7 Å²	37.7	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-44.3	176.6	0	0	0	0	0	112.4	L28 L32 M267 R268 S273 N274 Y276	L28-A271 HydrophobicContact CD1-CB 3.93Å; L28-A271 HydrophobicContact CD2-CB 4.17Å; L28-A271 HydrophobicContact CG-CB 4.41Å; L32-A271 HydrophobicContact CD1-CB 4.24Å; L32-A271 HydrophobicContact CD2-CB 4.39Å; M267-A271 VanDerWaalsContact O-CB 3.27Å; M267-A271 WeakPolarHBondContact O-CB 3.42Å; M267-A271 PolarHBondContact O-N 3.26Å; R268-A271 PolarHBondContact O-N 3.49Å; A271-S273 PolarHBondContact O-N 3.19Å; A271-N274 PolarHBondContact O-N 3.02Å; A271-Y276 HydrophobicContact CB-CD2 3.76Å; A271-Y276 HydrophobicContact CB-CE2 4.05Å
272	R	95.8	Very high	96.7	Very high	92 Å²	92	34.9 Å²	34.9	35%	0.347	19%	0.192	S	C	.	.	H	α-helix	trans	-62.4	-28.4	174.3	-73.9	174.6	-176.2	117.5	7.3	113	S24 N25 L28 E265 R268 T269 A270 N274	S24-R272 PolarHBondContact OG-NH2 2.72Å; N25-R272 PolarHBondContact OD1-NH2 3.43Å; L28-R272 HydrophobicContact CD1-CG 4.08Å; L28-R272 HydrophobicContact CD2-CG 4.21Å; E265-R272 IonicContact OE1-NH1 2.93Å; E265-R272 PolarHBondContact OE1-NH1 3.33Å; E265-R272 VanDerWaalsContact OE1-NH1 3.08Å; R268-R272 VanDerWaalsContact O-CG 3.3Å; R268-R272 WeakPolarHBondContact O-CG 3.36Å; R268-R272 PolarHBondContact O-N 2.95Å; T269-R272 PolarHBondContact O-N 2.89Å; A270-R272 PolarHBondContact O-N 2.92Å; R272-N274 PolarHBondContact O-N 3.3Å
273	S	94.6	Very high	96.8	Very high	88 Å²	88	31.2 Å²	31.2	62%	0.615	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	8.4	176.7	-52	0	0	0	0	112.8	T269 A270 A271 T275	T269-S273 PolarHBondContact O-N 3.36Å; T269-S273 VanDerWaalsContact O-N 3.11Å; T269-S273 PolarHBondContact O-OG 2.91Å; A270-S273 CarbonylContact O-C 3.59Å; A270-S273 WeakPolarHBondContact O-CA 3.06Å; A270-S273 PolarHBondContact O-N 3.42Å; A270-S273 VanDerWaalsContact O-N 3.08Å; A271-S273 PolarHBondContact O-N 3.19Å; S273-T275 PolarHBondContact O-N 3.3Å
274	N	93.8	Very high	96.8	Very high	99 Å²	99	31.3 Å²	31.3	53%	0.529	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	27.3	-177.6	-163.5	54.3	0	0	0	114.2	A270 A271 R272 Y276	A270-N274 PolarHBondContact O-N 3.01Å; A271-N274 PolarHBondContact O-N 3.02Å; R272-N274 PolarHBondContact O-N 3.3Å; N274-Y276 VanDerWaalsContact C-N 3.28Å; N274-Y276 PolarHBondContact O-N 2.77Å
275	T	96.2	Very high	96.8	Very high	38 Å²	38	31.2 Å²	31.2	23%	0.233	17%	0.17	C	C	.	.			trans	-62.8	-36.4	174.5	-56.6	0	0	0	0	111.5	E240 F241 A270 S273 H277	E240-T275 HydrophobicContact CB-CG2 4.05Å; E240-T275 HydrophobicContact CG-CG2 4.37Å; F241-T275 HydrophobicContact CE1-CG2 4.15Å; F241-T275 HydrophobicContact CZ-CG2 3.91Å; A270-T275 HydrophobicContact CB-CG2 4.37Å; A270-T275 WeakPolarHBondContact O-CB 3.35Å; A270-T275 PolarHBondContact O-N 3.42Å; A270-T275 PolarHBondContact O-OG1 3.43Å; A270-T275 VanDerWaalsContact O-OG1 3.13Å; S273-T275 PolarHBondContact O-N 3.3Å; T275-H277 VanDerWaalsContact C-N 3.34Å; T275-H277 PolarHBondContact O-N 3.05Å
276	Y	96.2	Very high	96.8	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.016	16%	0.157	C	C	.	.			trans	-91.9	64.2	178.6	-50	-52.4	0	0	0	111.2	E240 F241 M267 A270 A271 N274 A281 I282 T285	E240-Y276 VanDerWaalsContact O-CE1 3.23Å; E240-Y276 WeakPolarHBondContact O-CE1 3.39Å; E240-Y276 PolarHBondContact O-OH 3.33Å; F241-Y276 HydrophobicContact CD1-CD1 4.05Å; F241-Y276 HydrophobicContact CD1-CE1 4.14Å; F241-Y276 HydrophobicContact CE1-CD1 4.07Å; F241-Y276 HydrophobicContact CE1-CE1 4.41Å; M267-Y276 HydrophobicContact CB-CE2 4.48Å; M267-Y276 WeakPolarHBondContact O-CE2 3.43Å; A270-Y276 HydrophobicContact CB-CE2 3.86Å; A271-Y276 HydrophobicContact CB-CD2 3.76Å; A271-Y276 HydrophobicContact CB-CE2 4.05Å; N274-Y276 VanDerWaalsContact C-N 3.28Å; N274-Y276 PolarHBondContact O-N 2.77Å; Y276-A281 HydrophobicContact CD1-CB 4.18Å; Y276-I282 VanDerWaalsContact O-CD1 3.26Å; Y276-I282 WeakPolarHBondContact O-CD1 3.44Å; Y276-I282 WeakPolarHBondContact O-CG1 3.34Å; Y276-T285 HydrophobicContact CD2-CG2 4.07Å; Y276-T285 HydrophobicContact CE2-CG2 3.71Å
277	H	93.2	Very high	96.8	Very high	61 Å²	61	28.2 Å²	28.2	28%	0.282	15%	0.154	S	C	.	.			trans	-88.5	-21.8	176.5	64.2	77.7	0	0	0	113	T275 E407 D411	T275-H277 VanDerWaalsContact C-N 3.34Å; T275-H277 PolarHBondContact O-N 3.05Å; H277-E407 IonicContact CD2-OE1 3.83Å; H277-E407 IonicContact CE1-OE1 3.48Å; H277-E407 IonicContact NE2-OE1 3.8Å; H277-E407 PolarHBondContact NE2-OE1 3.31Å; H277-E407 VanDerWaalsContact NE2-OE1 3.15Å; H277-D411 VanDerWaalsContact CE1-CB 3.41Å; H277-D411 WeakPolarHBondContact CE1-CB 3.3Å; H277-D411 IonicContact CE1-OD1 3.31Å; H277-D411 PolarHBondContact CE1-OD1 2.62Å; H277-D411 IonicContact ND1-OD1 3.52Å; H277-D411 PolarHBondContact ND1-OD1 2.74Å
278	N	95.5	Very high	96.8	Very high	15 Å²	15	28.2 Å²	28.2	8%	0.08	15%	0.154	C	C	.	.	S	Bend	trans	-73.6	127.8	172.2	-174.8	-59.6	0	0	0	110.1	M280 A281 I282 W376 D411	N278-M280 PolarHBondContact O-N 3.32Å; N278-M280 WeakPolarHBondContact OD1-CA 3.19Å; N278-M280 WeakPolarHBondContact OD1-CB 3.35Å; N278-M280 PolarHBondContact OD1-N 2.99Å; N278-A281 HydrophobicContact CB-CB 4.11Å; N278-A281 WeakPolarHBondContact O-CB 3.47Å; N278-A281 PolarHBondContact O-N 3.49Å; N278-I282 PolarHBondContact O-N 2.93Å; N278-I282 VanDerWaalsContact O-N 3.11Å; N278-W376 PolarHBondContact ND2-O 3.15Å; N278-D411 PolarHBondContact ND2-OD2 3.2Å
279	P	96.3	Very high	96.8	Very high	47 Å²	47	26.7 Å²	26.7	31%	0.305	15%	0.149	S	C	.	.	H	α-helix	trans	-56.8	-33.2	-179.8	-26.9	35	0	0	0	114.2	L36 V51 I282 S283	L36-P279 HydrophobicContact CD2-CB 4.27Å; L36-P279 VanDerWaalsContact CD2-O 3.29Å; L36-P279 WeakPolarHBondContact CD2-O 3.2Å; V51-P279 HydrophobicContact CG2-CB 3.91Å; P279-I282 PolarHBondContact O-N 2.89Å; P279-S283 WeakPolarHBondContact O-CB 3.35Å; P279-S283 PolarHBondContact O-N 3.42Å
280	M	96.5	Very high	96.6	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-68	-36.2	175	-169.2	68.8	-158.5	0	0	112.1	N48 S50 N278 S283 Q284 L375 W376	N48-M280 PolarHBondContact ND2-SD 3.37Å; S50-M280 VanDerWaalsContact CB-CE 3.48Å; S50-M280 VanDerWaalsContact CB-SD 3.52Å; S50-M280 WeakPolarHBondContact OG-CE 3.18Å; N278-M280 PolarHBondContact O-N 3.32Å; N278-M280 WeakPolarHBondContact OD1-CA 3.19Å; N278-M280 WeakPolarHBondContact OD1-CB 3.35Å; N278-M280 PolarHBondContact OD1-N 2.99Å; M280-S283 WeakPolarHBondContact CA-OG 3.47Å; M280-S283 PolarHBondContact O-N 3.34Å; M280-S283 PolarHBondContact O-OG 3.26Å; M280-Q284 HydrophobicContact CE-CG 4.08Å; M280-Q284 WeakPolarHBondContact O-CG 3.5Å; M280-Q284 PolarHBondContact O-N 3.45Å; M280-L375 WeakPolarHBondContact CB-O 3.33Å; M280-L375 HydrophobicContact SD-CB 4.06Å; M280-W376 HydrophobicContact CB-CD2 3.93Å; M280-W376 HydrophobicContact CB-CE3 4Å; M280-W376 HydrophobicContact CB-CG 4.33Å; M280-W376 HydrophobicContact CB-CZ3 4.4Å; M280-W376 HydrophobicContact CG-CD2 3.5Å; M280-W376 VanDerWaalsContact CG-CD2 3.5Å; M280-W376 HydrophobicContact CG-CE3 4.02Å; M280-W376 HydrophobicContact CG-CG 3.83Å; M280-W376 HydrophobicContact CG-CH2 4.31Å; M280-W376 HydrophobicContact CG-CZ2 3.82Å; M280-W376 HydrophobicContact CG-CZ3 4.4Å
281	A	98	Very high	96.5	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-41	174.8	0	0	0	0	0	111.3	F241 Y276 N278 T285 W376	F241-A281 HydrophobicContact CD1-CB 3.89Å; F241-A281 HydrophobicContact CE1-CB 4.12Å; Y276-A281 HydrophobicContact CD1-CB 4.18Å; N278-A281 HydrophobicContact CB-CB 4.11Å; N278-A281 WeakPolarHBondContact O-CB 3.47Å; N278-A281 PolarHBondContact O-N 3.49Å; A281-T285 WeakPolarHBondContact O-CB 3.37Å; A281-T285 PolarHBondContact O-N 2.86Å; A281-T285 PolarHBondContact O-OG1 3.29Å; A281-W376 HydrophobicContact CB-CH2 4.35Å; A281-W376 HydrophobicContact CB-CZ3 3.96Å
282	I	98.3	Very high	96.5	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-43.9	174.5	-56.2	172.2	0	0	0	109.9	L32 N35 L36 Y276 N278 P279 Q284 T285 L286	L32-I282 HydrophobicContact CB-CG2 4.07Å; L32-I282 HydrophobicContact CD2-CD1 4.48Å; L32-I282 HydrophobicContact CD2-CG1 4.37Å; L32-I282 HydrophobicContact CD2-CG2 4.19Å; N35-I282 HydrophobicContact CB-CD1 3.91Å; L36-I282 HydrophobicContact CD1-CG2 3.94Å; L36-I282 HydrophobicContact CD2-CB 3.66Å; L36-I282 HydrophobicContact CD2-CD1 4.4Å; L36-I282 HydrophobicContact CD2-CG2 3.75Å; L36-I282 HydrophobicContact CG-CB 4.13Å; L36-I282 HydrophobicContact CG-CG2 3.6Å; Y276-I282 VanDerWaalsContact O-CD1 3.26Å; Y276-I282 WeakPolarHBondContact O-CD1 3.44Å; Y276-I282 WeakPolarHBondContact O-CG1 3.34Å; N278-I282 PolarHBondContact O-N 2.93Å; N278-I282 VanDerWaalsContact O-N 3.11Å; P279-I282 PolarHBondContact O-N 2.89Å; I282-Q284 PolarHBondContact O-N 2.99Å; I282-T285 PolarHBondContact O-N 3.24Å; I282-T285 VanDerWaalsContact O-N 3.11Å; I282-L286 HydrophobicContact CG2-CB 4.27Å; I282-L286 VanDerWaalsContact O-CB 3.23Å; I282-L286 WeakPolarHBondContact O-CB 3.33Å; I282-L286 PolarHBondContact O-N 2.82Å
283	S	98.4	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.6	-28	-176.5	74.3	0	0	0	0	113.7	S50 A54 P279 M280 P287	S50-S283 WeakPolarHBondContact O-CB 3.36Å; S50-S283 PolarHBondContact OG-OG 2.97Å; A54-S283 WeakPolarHBondContact CB-O 3.43Å; P279-S283 WeakPolarHBondContact O-CB 3.35Å; P279-S283 PolarHBondContact O-N 3.42Å; M280-S283 WeakPolarHBondContact CA-OG 3.47Å; M280-S283 PolarHBondContact O-N 3.34Å; M280-S283 PolarHBondContact O-OG 3.26Å; S283-P287 WeakPolarHBondContact O-CD 3.38Å; S283-P287 WeakPolarHBondContact O-CG 3.38Å
284	Q	98.4	Very high	96.8	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.019	12%	0.124	C	C	.	.	H	α-helix	trans	-87.2	-22.6	176	-66.2	-169.7	-10.5	0	0	113.7	Y149 G244 L245 Q248 M280 I282	Y149-Q284 PolarHBondContact OH-NE2 3.03Å; Y149-Q284 VanDerWaalsContact OH-NE2 3.1Å; G244-Q284 CarbonylContact C-O 3.27Å; L245-Q284 HydrophobicContact CD2-CB 4.17Å; L245-Q284 HydrophobicContact CD2-CG 4.26Å; L245-Q284 HydrophobicContact CG-CB 4.19Å; L245-Q284 HydrophobicContact CG-CG 4.47Å; Q248-Q284 PolarHBondContact NE2-O 2.99Å; M280-Q284 HydrophobicContact CE-CG 4.08Å; M280-Q284 WeakPolarHBondContact O-CG 3.5Å; M280-Q284 PolarHBondContact O-N 3.45Å; I282-Q284 PolarHBondContact O-N 2.99Å
285	T	98.2	Very high	96.9	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.012	11%	0.105	C	C	.	.	H	α-helix	trans	-91.1	-40.5	-178.7	-62.4	0	0	0	0	112.7	M267 Y276 A281 I282 A288 L289	M267-T285 HydrophobicContact CB-CG2 4.29Å; M267-T285 HydrophobicContact CG-CG2 4.33Å; M267-T285 HydrophobicContact SD-CG2 3.81Å; Y276-T285 HydrophobicContact CD2-CG2 4.07Å; Y276-T285 HydrophobicContact CE2-CG2 3.71Å; A281-T285 WeakPolarHBondContact O-CB 3.37Å; A281-T285 PolarHBondContact O-N 2.86Å; A281-T285 PolarHBondContact O-OG1 3.29Å; I282-T285 PolarHBondContact O-N 3.24Å; I282-T285 VanDerWaalsContact O-N 3.11Å; T285-A288 WeakPolarHBondContact O-CB 3.22Å; T285-A288 PolarHBondContact O-N 2.62Å; T285-L289 HydrophobicContact CG2-CD1 3.84Å; T285-L289 HydrophobicContact CG2-CG 4.16Å; T285-L289 PolarHBondContact O-N 2.93Å
286	L	97.9	Very high	96.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.3	-45.5	-172.1	178.9	63.8	0	0	0	113.5	L29 L32 L36 I282 A288 L289 Q290	L29-L286 HydrophobicContact CD2-CD1 3.92Å; L32-L286 HydrophobicContact CB-CD1 4.14Å; L32-L286 HydrophobicContact CD1-CD1 4.39Å; L36-L286 HydrophobicContact CD1-CD2 3.68Å; I282-L286 HydrophobicContact CG2-CB 4.27Å; I282-L286 VanDerWaalsContact O-CB 3.23Å; I282-L286 WeakPolarHBondContact O-CB 3.33Å; I282-L286 PolarHBondContact O-N 2.82Å; L286-A288 VanDerWaalsContact C-N 3.26Å; L286-A288 PolarHBondContact O-N 3.27Å; L286-L289 PolarHBondContact O-N 3.12Å; L286-L289 VanDerWaalsContact O-N 3.15Å; L286-Q290 HydrophobicContact CD1-CG 4.26Å; L286-Q290 PolarHBondContact O-N 3.24Å; L286-Q290 VanDerWaalsContact O-N 3.09Å
287	P	97.9	Very high	97	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-57	-42.2	177.9	-25.2	34.6	0	0	0	112	A54 L57 S283 L289 Q290 R291 K292 Y294	A54-P287 HydrophobicContact CB-CG 4.28Å; L57-P287 HydrophobicContact CD1-CB 4.36Å; L57-P287 HydrophobicContact CD1-CG 4.31Å; S283-P287 WeakPolarHBondContact O-CD 3.38Å; S283-P287 WeakPolarHBondContact O-CG 3.38Å; P287-L289 PolarHBondContact O-N 2.76Å; P287-Q290 CarbonylContact O-C 3.51Å; P287-Q290 PolarHBondContact O-N 3.4Å; P287-Q290 VanDerWaalsContact O-N 3.16Å; P287-R291 PolarHBondContact O-N 2.81Å; P287-R291 VanDerWaalsContact O-N 3.08Å; P287-K292 CarbonylContact C-O 3.59Å; P287-K292 VanDerWaalsContact C-O 3.27Å; P287-K292 HydrophobicContact CB-CB 4.22Å; P287-K292 WeakPolarHBondContact O-CA 3.48Å; P287-K292 PolarHBondContact O-N 3.47Å; P287-K292 VanDerWaalsContact O-O 3.1Å; P287-Y294 HydrophobicContact CG-CE1 4.43Å
288	A	97.8	Very high	97	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61	-47.4	178.1	0	0	0	0	0	111.7	G244 V247 Q248 M264 M267 T285 L286 Q290 R291	G244-A288 WeakPolarHBondContact O-CB 3.46Å; V247-A288 HydrophobicContact CB-CB 4.04Å; V247-A288 HydrophobicContact CG1-CB 3.96Å; Q248-A288 HydrophobicContact CG-CB 3.88Å; M264-A288 WeakPolarHBondContact CE-O 2.98Å; M267-A288 HydrophobicContact CE-CB 4.01Å; M267-A288 HydrophobicContact SD-CB 4.45Å; T285-A288 WeakPolarHBondContact O-CB 3.22Å; T285-A288 PolarHBondContact O-N 2.62Å; L286-A288 VanDerWaalsContact C-N 3.26Å; L286-A288 PolarHBondContact O-N 3.27Å; A288-Q290 PolarHBondContact O-N 3.16Å; A288-R291 WeakPolarHBondContact O-CA 3.5Å; A288-R291 PolarHBondContact O-N 2.7Å
289	L	97	Very high	96.8	Very high	9 Å²	9	27.8 Å²	27.8	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-60.7	-28	178.2	-71.4	174.6	0	0	0	112.8	L29 L32 M267 R268 T285 L286 P287	L29-L289 HydrophobicContact CD2-CB 3.7Å; L29-L289 HydrophobicContact CD2-CD1 4.4Å; L32-L289 HydrophobicContact CD1-CD1 3.75Å; M267-L289 HydrophobicContact CB-CD2 3.9Å; M267-L289 HydrophobicContact CB-CG 4.47Å; M267-L289 HydrophobicContact CE-CD2 4.07Å; M267-L289 HydrophobicContact CE-CG 4.41Å; R268-L289 HydrophobicContact CG-CD2 3.74Å; T285-L289 HydrophobicContact CG2-CD1 3.84Å; T285-L289 HydrophobicContact CG2-CG 4.16Å; T285-L289 PolarHBondContact O-N 2.93Å; L286-L289 PolarHBondContact O-N 3.12Å; L286-L289 VanDerWaalsContact O-N 3.15Å; P287-L289 PolarHBondContact O-N 2.76Å
290	Q	94.8	Very high	96.5	Very high	14 Å²	14	27.8 Å²	27.8	7%	0.065	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	10.1	174	-67.1	177.6	-53.7	0	0	113.6	L29 S58 L286 P287 A288 K292	L29-Q290 HydrophobicContact CD1-CG 4.26Å; L29-Q290 HydrophobicContact CD2-CG 3.94Å; S58-Q290 PolarHBondContact OG-NE2 3.35Å; S58-Q290 PolarHBondContact OG-OE1 3.27Å; L286-Q290 HydrophobicContact CD1-CG 4.26Å; L286-Q290 PolarHBondContact O-N 3.24Å; L286-Q290 VanDerWaalsContact O-N 3.09Å; P287-Q290 CarbonylContact O-C 3.51Å; P287-Q290 PolarHBondContact O-N 3.4Å; P287-Q290 VanDerWaalsContact O-N 3.16Å; A288-Q290 PolarHBondContact O-N 3.16Å; Q290-K292 HydrophobicContact CB-CG 4.38Å; Q290-K292 PolarHBondContact O-N 2.94Å
291	R	95.7	Very high	95.8	Very high	161 Å²	161	31.6 Å²	31.6	61%	0.608	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	30.2	179.3	-51	169.7	-174.8	-176.5	2.1	113.1	V257 M264 P287 A288	V257-R291 HydrophobicContact CG1-CG 4.37Å; V257-R291 HydrophobicContact CG2-CG 4.43Å; M264-R291 HydrophobicContact CE-CG 3.85Å; P287-R291 PolarHBondContact O-N 2.81Å; P287-R291 VanDerWaalsContact O-N 3.08Å; A288-R291 WeakPolarHBondContact O-CA 3.5Å; A288-R291 PolarHBondContact O-N 2.7Å
292	K	96	Very high	95.3	Very high	65 Å²	65	32.9 Å²	32.9	28%	0.283	16%	0.164	S	C	.	.			trans	-108.5	159.3	175.5	-60.4	-67.8	-173.1	171.4	0	110.1	H59 P287 Q290	H59-K292 WeakPolarHBondContact NE2-CE 3.33Å; P287-K292 CarbonylContact C-O 3.59Å; P287-K292 VanDerWaalsContact C-O 3.27Å; P287-K292 HydrophobicContact CB-CB 4.22Å; P287-K292 WeakPolarHBondContact O-CA 3.48Å; P287-K292 PolarHBondContact O-N 3.47Å; P287-K292 VanDerWaalsContact O-O 3.1Å; Q290-K292 HydrophobicContact CB-CG 4.38Å; Q290-K292 PolarHBondContact O-N 2.94Å
293	T	97.9	Very high	94.5	Very high	10 Å²	10	39.9 Å²	39.9	6%	0.061	20%	0.201	C	C	.	.			trans	-137	165.2	177.6	74.7	0	0	0	0	109.3	Q248 L251 A252 L295 S296	Q248-T293 HydrophobicContact CB-CG2 4.17Å; Q248-T293 WeakPolarHBondContact O-CG2 3.34Å; L251-T293 HydrophobicContact CB-CG2 3.91Å; A252-T293 HydrophobicContact CB-CG2 4.3Å; T293-L295 PolarHBondContact O-N 2.91Å; T293-L295 VanDerWaalsContact O-N 3.15Å; T293-L295 PolarHBondContact OG1-N 3.25Å; T293-L295 VanDerWaalsContact OG1-N 3.17Å; T293-S296 PolarHBondContact N-OG 3.25Å; T293-S296 WeakPolarHBondContact O-CB 3.34Å; T293-S296 PolarHBondContact O-N 3Å; T293-S296 PolarHBondContact O-OG 3.14Å
294	Y	98.6	Very high	93.4	Very high	1 Å²	1	46.2 Å²	46.2	0%	0.004	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-61.1	-19.9	171.4	-64.8	-16	0	0	0	113.8	L53 L57 L156 M195 M198 L245 P287 S296 V297	L53-Y294 HydrophobicContact CD2-CD1 3.7Å; L53-Y294 HydrophobicContact CD2-CE1 3.58Å; L53-Y294 HydrophobicContact CD2-CG 4.26Å; L53-Y294 HydrophobicContact CG-CD1 4.3Å; L53-Y294 HydrophobicContact CG-CE1 4.17Å; L57-Y294 HydrophobicContact CD1-CD1 3.91Å; L57-Y294 HydrophobicContact CD1-CE1 4.39Å; L156-Y294 HydrophobicContact CD2-CD2 4.16Å; M195-Y294 HydrophobicContact CE-CD2 4.05Å; M195-Y294 HydrophobicContact CE-CE2 3.83Å; M195-Y294 HydrophobicContact SD-CD2 4.39Å; M198-Y294 HydrophobicContact CE-CD2 4.12Å; L245-Y294 HydrophobicContact CD2-CE2 3.96Å; P287-Y294 HydrophobicContact CG-CE1 4.43Å; Y294-S296 VanDerWaalsContact C-N 3.26Å; Y294-S296 PolarHBondContact O-N 3.46Å; Y294-V297 WeakPolarHBondContact O-CB 3.41Å; Y294-V297 VanDerWaalsContact O-CG2 3.31Å; Y294-V297 WeakPolarHBondContact O-CG2 3.17Å; Y294-V297 PolarHBondContact O-N 3.2Å
295	L	97.1	Very high	92.3	Very high	23 Å²	23	49 Å²	49	12%	0.12	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-70.5	-24.8	172.7	-79.5	70	0	0	0	112.1	L156 M198 Q201 C202 A252 T293 V297 K298	L156-L295 HydrophobicContact CD1-CD1 3.79Å; L156-L295 HydrophobicContact CD1-CG 4.29Å; M198-L295 HydrophobicContact CB-CD1 3.53Å; M198-L295 HydrophobicContact CG-CD1 3.82Å; M198-L295 WeakPolarHBondContact O-CD1 3.49Å; M198-L295 HydrophobicContact SD-CD1 4.29Å; Q201-L295 HydrophobicContact CB-CD2 4.27Å; Q201-L295 HydrophobicContact CG-CD2 4.06Å; C202-L295 HydrophobicContact CB-CD2 4.24Å; C202-L295 HydrophobicContact CB-CG 4.24Å; A252-L295 HydrophobicContact CB-CD1 3.91Å; A252-L295 HydrophobicContact CB-CD2 3.97Å; A252-L295 HydrophobicContact CB-CG 4.45Å; T293-L295 PolarHBondContact O-N 2.91Å; T293-L295 VanDerWaalsContact O-N 3.15Å; T293-L295 PolarHBondContact OG1-N 3.25Å; T293-L295 VanDerWaalsContact OG1-N 3.17Å; L295-V297 PolarHBondContact O-N 2.7Å; L295-V297 VanDerWaalsContact O-N 3.15Å; L295-K298 WeakPolarHBondContact O-CB 3.39Å; L295-K298 PolarHBondContact O-N 3.49Å
296	S	95.9	Very high	91.2	Very high	31 Å²	31	52.7 Å²	52.7	22%	0.217	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-61.6	-21.6	178	-56	0	0	0	0	112.4	T293 Y294 K298 T299 L300	T293-S296 PolarHBondContact N-OG 3.25Å; T293-S296 WeakPolarHBondContact O-CB 3.34Å; T293-S296 PolarHBondContact O-N 3Å; T293-S296 PolarHBondContact O-OG 3.14Å; Y294-S296 VanDerWaalsContact C-N 3.26Å; Y294-S296 PolarHBondContact O-N 3.46Å; S296-K298 PolarHBondContact O-N 2.8Å; S296-T299 PolarHBondContact O-N 3.34Å; S296-T299 PolarHBondContact O-OG1 2.81Å; S296-L300 PolarHBondContact O-N 3.09Å
297	V	96.8	Very high	90.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-58	-31.2	173.5	177.9	0	0	0	0	112.3	L53 L57 K103 V160 Y294 L295 T299 L300	L53-V297 HydrophobicContact CD1-CG2 3.52Å; L57-V297 HydrophobicContact CD1-CG2 4.36Å; L57-V297 HydrophobicContact CD2-CG2 3.98Å; L57-V297 HydrophobicContact CG-CG2 4.43Å; K103-V297 HydrophobicContact CB-CG1 3.9Å; K103-V297 HydrophobicContact CG-CG1 3.56Å; V160-V297 HydrophobicContact CG2-CG1 4.48Å; Y294-V297 WeakPolarHBondContact O-CB 3.41Å; Y294-V297 VanDerWaalsContact O-CG2 3.31Å; Y294-V297 WeakPolarHBondContact O-CG2 3.17Å; Y294-V297 PolarHBondContact O-N 3.2Å; L295-V297 PolarHBondContact O-N 2.7Å; L295-V297 VanDerWaalsContact O-N 3.15Å; V297-T299 PolarHBondContact O-N 3.45Å; V297-L300 PolarHBondContact O-N 3.34Å
298	K	94.4	Very high	89.4	Confident	89 Å²	89	60.2 Å²	60.2	39%	0.387	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-60.7	-34.3	-178	-176.4	176.6	177.9	-178.6	0	112.6	V160 L295 S296	V160-K298 HydrophobicContact CB-CB 4.21Å; L295-K298 WeakPolarHBondContact O-CB 3.39Å; L295-K298 PolarHBondContact O-N 3.49Å; S296-K298 PolarHBondContact O-N 2.8Å
299	T	90.3	Very high	88.7	Confident	117 Å²	117	63.5 Å²	63.5	72%	0.718	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-113.9	15.7	-174.6	60.5	0	0	0	0	112.3	S296 V297	S296-T299 PolarHBondContact O-N 3.34Å; S296-T299 PolarHBondContact O-OG1 2.81Å; V297-T299 PolarHBondContact O-N 3.45Å
300	L	89.6	Confident	88.2	Confident	46 Å²	46	63.2 Å²	63.2	24%	0.241	34%	0.337	C	S	.	.			trans	-68.2	133.8	179	-157.6	83.8	0	0	0	109.8	L57 S104 S296 V297	L57-L300 HydrophobicContact CD2-CD1 4.44Å; S104-L300 WeakPolarHBondContact O-CD2 3.17Å; S296-L300 PolarHBondContact O-N 3.09Å; V297-L300 PolarHBondContact O-N 3.34Å
301	D	83.7	Confident	87.7	Confident	85 Å²	85	67.4 Å²	67.4	46%	0.455	36%	0.363	S	S	.	.			trans	-115.7	129	174.6	178.6	20.8	0	0	0	109.1	L303 N304	D301-L303 WeakPolarHBondContact OD1-CB 3.36Å; D301-L303 WeakPolarHBondContact OD1-CG 3.47Å; D301-L303 PolarHBondContact OD1-N 3.03Å; D301-N304 PolarHBondContact OD2-ND2 3.34Å
302	C	85.8	Confident	87.1	Confident	28 Å²	28	61.6 Å²	61.6	19%	0.189	34%	0.344	C	S	.	.	S	Bend	trans	-106.1	7.2	-179.8	-51.4	0	0	0	0	112.4	C106 E305	C106-C302 HydrophobicContact CB-CB 3.61Å; C106-C302 WeakPolarHBondContact CB-SG 3.46Å; C106-C302 PolarHBondContact N-SG 3.34Å; C106-C302 VanDerWaalsContact N-SG 3.42Å; C106-C302 WeakPolarHBondContact SG-CB 3.44Å; C106-C302 PolarHBondContact SG-N 2.8Å; C106-C302 VanDerWaalsContact SG-N 3.35Å; C106-C302 CovalentContact SG-SG 2.03Å; C106-C302 PolarHBondContact SG-SG 3.26Å; C302-E305 HydrophobicContact CB-CG 4.36Å; C302-E305 VanDerWaalsContact CB-OE1 3.25Å; C302-E305 WeakPolarHBondContact CB-OE1 3.46Å; C302-E305 WeakPolarHBondContact O-CG 3.12Å
303	L	81.9	Confident	86.2	Confident	153 Å²	153	64.7 Å²	64.7	80%	0.801	36%	0.36	S	S	*	.	S	Bend	trans	-82	-32.8	176.7	-64.1	175.5	0	0	0	112.4	D301	D301-L303 WeakPolarHBondContact OD1-CB 3.36Å; D301-L303 WeakPolarHBondContact OD1-CG 3.47Å; D301-L303 PolarHBondContact OD1-N 3.03Å
304	N	76.6	Confident	84.9	Confident	133 Å²	133	75.8 Å²	75.8	71%	0.711	40%	0.4	S	S	*	.	S	Bend	trans	-117.9	55.1	-178.5	-57.5	-70.2	0	0	0	110.1	D301	D301-N304 PolarHBondContact OD2-ND2 3.34Å
305	E	73.5	Confident	83.4	Confident	61 Å²	61	79.9 Å²	79.9	29%	0.285	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-65.8	144.4	-179.9	-62.3	-164.5	-179.9	0	0	111.4	R56 C302	R56-E305 IonicContact CZ-OE1 3.36Å; R56-E305 IonicContact CZ-OE2 3.83Å; R56-E305 IonicContact NH1-OE1 3.25Å; R56-E305 IonicContact NH1-OE2 3.19Å; R56-E305 PolarHBondContact NH1-OE2 2.99Å; R56-E305 IonicContact NH2-OE1 3.96Å; R56-E305 PolarHBondContact NH2-OE1 3.41Å; R56-E305 IonicContact NH2-OE2 2.62Å; R56-E305 PolarHBondContact NH2-OE2 2.92Å; C302-E305 HydrophobicContact CB-CG 4.36Å; C302-E305 VanDerWaalsContact CB-OE1 3.25Å; C302-E305 WeakPolarHBondContact CB-OE1 3.46Å; C302-E305 WeakPolarHBondContact O-CG 3.12Å
306	D	75.9	Confident	81.6	Confident	81 Å²	81	85.2 Å²	85.2	43%	0.433	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-57.2	144.4	170.4	-69.9	-38	0	0	0	109	H59	H59-D306 IonicContact ND1-OD2 3.72Å
307	A	75.5	Confident	79.9	Confident	74 Å²	74	89.4 Å²	89.4	61%	0.612	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-58.2	154.3	177.9	0	0	0	0	0	111	T309	A307-T309 WeakPolarHBondContact O-CG2 2.73Å; A307-T309 PolarHBondContact O-N 3.17Å
308	D	82.3	Confident	78	Confident	83 Å²	83	95 Å²	95	44%	0.444	52%	0.515	S	S	.	.	B	Isolated β-bridge	trans	-59.4	102.2	172.8	-91.4	-11.2	0	0	0	110.2	Q63	Q63-D308 WeakPolarHBondContact CB-OD1 3.24Å; Q63-D308 VanDerWaalsContact CG-OD1 3.23Å; Q63-D308 WeakPolarHBondContact CG-OD1 3.38Å; Q63-D308 PolarHBondContact N-OD1 3.2Å
309	T	83.5	Confident	76.5	Confident	69 Å²	69	96.3 Å²	96.3	42%	0.423	53%	0.53	S	S	.	.			trans	-105	-13.4	180	51.8	0	0	0	0	112.3	H60 H61 A307 V311	H60-T309 WeakPolarHBondContact CA-OG1 3.43Å; H60-T309 PolarHBondContact ND1-OG1 3.06Å; H61-T309 PolarHBondContact O-N 2.89Å; A307-T309 WeakPolarHBondContact O-CG2 2.73Å; A307-T309 PolarHBondContact O-N 3.17Å; T309-V311 PolarHBondContact O-N 3.08Å
310	L	86.4	Confident	75.2	Confident	3 Å²	3	97 Å²	97	2%	0.016	53%	0.534	C	S	.	.			trans	-91.6	86.4	178.1	-67	172.3	0	0	0	111.9	L30 N33 R34 V37 H60 H61 N62	L30-L310 HydrophobicContact CD1-CD2 3.56Å; N33-L310 HydrophobicContact CB-CD1 3.84Å; N33-L310 HydrophobicContact CB-CD2 3.7Å; N33-L310 HydrophobicContact CB-CG 4.42Å; R34-L310 HydrophobicContact CG-CD2 4.16Å; V37-L310 HydrophobicContact CG2-CD1 3.77Å; H60-L310 VanDerWaalsContact C-CD1 3.42Å; H60-L310 HydrophobicContact CB-CD1 3.78Å; H60-L310 HydrophobicContact CB-CD2 3.75Å; H60-L310 HydrophobicContact CB-CG 3.62Å; H60-L310 WeakPolarHBondContact O-CD1 3.37Å; H61-L310 VanDerWaalsContact O-CB 3.29Å; H61-L310 WeakPolarHBondContact O-CB 3.45Å; H61-L310 PolarHBondContact O-N 2.93Å; N62-L310 HydrophobicContact CB-CB 4.07Å; N62-L310 PolarHBondContact ND2-O 2.84Å
311	V	83.3	Confident	74.4	Confident	102 Å²	102	101.5 Å²	101.5	62%	0.618	56%	0.557	S	S	*	*			trans	-79.9	119.9	163.9	-174.4	0	0	0	0	109	T309	T309-V311 PolarHBondContact O-N 3.08Å
312	L	83.4	Confident	74.1	Confident	40 Å²	40	102.1 Å²	102.1	21%	0.209	57%	0.566	C	S	.	*			trans	-82.9	111.1	167.9	-68	-175.6	0	0	0	108.9	R34 V37 R38	R34-L312 HydrophobicContact CB-CD2 4.25Å; R34-L312 HydrophobicContact CG-CD2 4.24Å; V37-L312 HydrophobicContact CB-CD1 4.41Å; V37-L312 HydrophobicContact CB-CD2 4.29Å; V37-L312 HydrophobicContact CG1-CD1 3.7Å; V37-L312 HydrophobicContact CG1-CD2 4.35Å; V37-L312 HydrophobicContact CG1-CG 4.2Å; R38-L312 HydrophobicContact CG-CD1 4.46Å; R38-L312 HydrophobicContact CG-CD2 4.06Å
313	E	77.5	Confident	73.9	Confident	130 Å²	130	102.9 Å²	102.9	61%	0.607	57%	0.572	S	S	*	*			trans	-64.3	139.6	165.9	-69	168.8	-161.2	0	0	109.1	V315	E313-V315 PolarHBondContact O-N 3.5Å
314	R	71.3	Confident	74.1	Confident	242 Å²	242	104.9 Å²	104.9	91%	0.913	58%	0.577	S	S	*	*			trans	-60.1	115.6	169.4	-83.5	-171.7	-174.5	158	2.7	107.7
315	V	65.6	Low	74.9	Confident	87 Å²	87	102.6 Å²	102.6	53%	0.527	57%	0.568	S	S	.	*			trans	-92.7	113.9	167.6	-175.9	0	0	0	0	105.5	E313	E313-V315 PolarHBondContact O-N 3.5Å
316	D	59.9	Low	76	Confident	135 Å²	135	106.3 Å²	106.3	72%	0.722	58%	0.583	S	S	*	*			trans	-59.2	136.3	168.6	-71.6	-39.4	0	0	0	108.1	T318	D316-T318 PolarHBondContact O-N 2.93Å
317	P	59.8	Low	77	Confident	120 Å²	120	103.2 Å²	103.2	78%	0.779	57%	0.567	S	S	*	*			trans	-60	102.7	-177.5	21.7	-30.3	0	0	0	109.4	V319	P317-V319 PolarHBondContact O-N 2.65Å; P317-V319 VanDerWaalsContact O-N 3.11Å
318	T	58.5	Low	78	Confident	117 Å²	117	104.4 Å²	104.4	72%	0.718	56%	0.558	S	S	*	*			trans	-69.8	110	173.6	-18.1	0	0	0	0	106.9	D316 V320	D316-T318 PolarHBondContact O-N 2.93Å; T318-V320 VanDerWaalsContact C-N 3.32Å; T318-V320 PolarHBondContact O-N 3.06Å
319	V	61.1	Low	78.8	Confident	117 Å²	117	100.4 Å²	100.4	71%	0.709	54%	0.537	S	S	*	.			trans	-67	98.2	170.4	-179	0	0	0	0	106.8	P317 L321	P317-V319 PolarHBondContact O-N 2.65Å; P317-V319 VanDerWaalsContact O-N 3.11Å; V319-L321 VanDerWaalsContact C-N 3.32Å; V319-L321 HydrophobicContact CG1-CD2 4.09Å; V319-L321 HydrophobicContact CG1-CG 4.36Å; V319-L321 PolarHBondContact O-N 2.73Å
320	V	65.1	Low	79.5	Confident	131 Å²	131	101.5 Å²	101.5	79%	0.794	54%	0.538	S	S	*	.			trans	-69.9	97.1	170.4	-176.8	0	0	0	0	106.3	T318	T318-V320 VanDerWaalsContact C-N 3.32Å; T318-V320 PolarHBondContact O-N 3.06Å
321	L	72.7	Confident	80	Confident	141 Å²	141	101.4 Å²	101.4	74%	0.738	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-64.7	131	174.8	-71.7	168.7	0	0	0	108.4	V319 S323	V319-L321 VanDerWaalsContact C-N 3.32Å; V319-L321 HydrophobicContact CG1-CD2 4.09Å; V319-L321 HydrophobicContact CG1-CG 4.36Å; V319-L321 PolarHBondContact O-N 2.73Å; L321-S323 PolarHBondContact O-N 3.11Å
322	P	76.3	Confident	80.8	Confident	97 Å²	97	98.8 Å²	98.8	63%	0.63	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-54	139.1	172.6	-23.7	32.6	0	0	0	109.9	E324 P348	P322-E324 PolarHBondContact O-N 2.96Å; P322-P348 HydrophobicContact CB-CB 4.31Å; P322-P348 HydrophobicContact CB-CG 4.32Å
323	S	81.1	Confident	81.5	Confident	45 Å²	45	97 Å²	97	32%	0.315	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-56.8	130.5	173.8	-178.2	0	0	0	0	110.2	L321 T325 P348 K349	L321-S323 PolarHBondContact O-N 3.11Å; S323-T325 PolarHBondContact O-N 3.33Å; S323-T325 PolarHBondContact OG-N 3.48Å; S323-T325 PolarHBondContact OG-O 2.86Å; S323-P348 WeakPolarHBondContact O-CB 3.15Å; S323-K349 VanDerWaalsContact CB-O 3.26Å; S323-K349 WeakPolarHBondContact CB-O 3.42Å
324	E	87.6	Confident	82.5	Confident	194 Å²	194	91.7 Å²	91.7	91%	0.907	49%	0.486	S	S	*	.	S	Bend	trans	-65.9	-25.9	173	-62.7	-172.2	163.6	0	0	111.6	P322 K326	P322-E324 PolarHBondContact O-N 2.96Å; E324-K326 PolarHBondContact O-N 2.95Å
325	T	93.4	Very high	83.7	Confident	85 Å²	85	81.7 Å²	81.7	52%	0.521	45%	0.452	S	S	.	.			trans	-72.8	120.1	175.9	-54	0	0	0	0	109.9	S323 K349	S323-T325 PolarHBondContact O-N 3.33Å; S323-T325 PolarHBondContact OG-N 3.48Å; S323-T325 PolarHBondContact OG-O 2.86Å; T325-K349 WeakPolarHBondContact O-CB 3.47Å; T325-K349 PolarHBondContact O-N 3.21Å
326	K	95.8	Very high	85	Confident	140 Å²	140	80.2 Å²	80.2	61%	0.609	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	147	172.2	-65.1	-179.3	-178	172.7	0	111.8	E324 D346 V347	E324-K326 PolarHBondContact O-N 2.95Å; K326-D346 HydrophobicContact CB-CB 4.26Å; K326-D346 HydrophobicContact CD-CB 4.28Å; K326-V347 CarbonylContact C-O 3.46Å; K326-V347 VanDerWaalsContact CA-O 3.24Å; K326-V347 WeakPolarHBondContact CA-O 3.41Å
327	V	96.8	Very high	86.7	Confident	15 Å²	15	78.9 Å²	78.9	9%	0.091	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.1	175.3	-65.5	0	0	0	0	109.7	D346 V347 K349 I414	V327-D346 WeakPolarHBondContact O-CA 3.44Å; V327-V347 HydrophobicContact CG2-CG2 3.91Å; V327-V347 PolarHBondContact N-O 2.93Å; V327-V347 PolarHBondContact O-N 2.83Å; V327-K349 HydrophobicContact CG1-CB 4.19Å; V327-K349 HydrophobicContact CG1-CG 4.43Å; V327-I414 HydrophobicContact CG2-CG2 3.72Å
328	K	97.3	Very high	88.3	Confident	99 Å²	99	75.7 Å²	75.7	43%	0.43	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	128.1	-178.5	-175.5	178.3	179.7	-178.6	0	110.1	S344 D346 T417 Q418	K328-S344 WeakPolarHBondContact CE-OG 3.27Å; K328-D346 WeakPolarHBondContact CA-OD1 3.42Å; K328-D346 WeakPolarHBondContact CB-OD1 3.49Å; K328-T417 HydrophobicContact CB-CG2 4.34Å; K328-T417 VanDerWaalsContact O-CA 3.25Å; K328-T417 WeakPolarHBondContact O-CA 3.38Å; K328-T417 WeakPolarHBondContact O-CG2 3.44Å; K328-Q418 PolarHBondContact O-N 2.97Å
329	V	97.9	Very high	90.1	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.9	176.2	-173.5	0	0	0	0	108.2	V331 S344 V345 V347 I414 I420	V329-V331 HydrophobicContact CG1-CG2 4.02Å; V329-S344 VanDerWaalsContact O-CA 3.25Å; V329-S344 WeakPolarHBondContact O-CA 3.39Å; V329-S344 PolarHBondContact O-OG 2.91Å; V329-V345 HydrophobicContact CB-CG1 4.35Å; V329-V345 PolarHBondContact N-O 2.81Å; V329-V345 PolarHBondContact O-N 2.92Å; V329-V345 VanDerWaalsContact O-N 3.08Å; V329-V347 HydrophobicContact CG2-CG2 3.71Å; V329-I414 HydrophobicContact CG1-CD1 4.12Å; V329-I414 HydrophobicContact CG2-CD1 3.66Å; V329-I414 HydrophobicContact CG2-CG2 3.5Å; V329-I414 VanDerWaalsContact CG2-CG2 3.5Å; V329-I420 HydrophobicContact CG1-CG1 3.98Å
330	M	98.1	Very high	91.8	Very high	91 Å²	91	70.4 Å²	70.4	45%	0.448	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.4	166.9	-63.7	-158.2	-59.5	0	0	108.7	Y343 Q418 K419 I420	M330-Y343 CarbonylContact C-O 3.54Å; M330-Y343 WeakPolarHBondContact CA-O 3.47Å; M330-Q418 PolarHBondContact N-O 3.43Å; M330-Q418 VanDerWaalsContact N-O 3.12Å; M330-K419 CarbonylContact O-C 3.56Å; M330-K419 WeakPolarHBondContact O-CA 3.38Å; M330-I420 PolarHBondContact O-N 3.31Å
331	V	98.4	Very high	93.3	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.006	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	116.2	176.6	178.2	0	0	0	0	108.5	V329 V333 A342 Y343 L357 L360 F367 I420 I422	V329-V331 HydrophobicContact CG1-CG2 4.02Å; V331-V333 HydrophobicContact CG1-CG2 4.26Å; V331-A342 CarbonylContact O-C 3.44Å; V331-A342 WeakPolarHBondContact O-CA 3.49Å; V331-Y343 PolarHBondContact N-O 3.21Å; V331-Y343 PolarHBondContact O-N 2.88Å; V331-L357 HydrophobicContact CG1-CD2 4.38Å; V331-L357 HydrophobicContact CG2-CD2 4.27Å; V331-L360 HydrophobicContact CB-CD1 3.72Å; V331-L360 HydrophobicContact CG1-CD1 4.32Å; V331-L360 HydrophobicContact CG2-CD1 3.42Å; V331-L360 VanDerWaalsContact CG2-CD1 3.42Å; V331-F367 HydrophobicContact CG1-CE2 4.31Å; V331-I420 CarbonylContact C-O 3.53Å; V331-I420 WeakPolarHBondContact CA-O 3.47Å; V331-I420 HydrophobicContact CG2-CB 4.25Å; V331-I422 HydrophobicContact CG1-CD1 3.65Å; V331-I422 HydrophobicContact CG1-CG1 4.09Å
332	E	98.4	Very high	94.5	Very high	48 Å²	48	63 Å²	63	22%	0.224	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	115.5	172.6	-179.2	-176.2	-106.7	0	0	109.2	V334 A340 A341 K419 I420 T421 I422	E332-V334 HydrophobicContact CG-CG2 3.97Å; E332-A340 HydrophobicContact CG-CB 4.4Å; E332-A341 CarbonylContact C-O 3.56Å; E332-A341 WeakPolarHBondContact CA-O 3.24Å; E332-K419 WeakPolarHBondContact OE1-CE 3.43Å; E332-K419 IonicContact OE1-NZ 2.8Å; E332-K419 PolarHBondContact OE1-NZ 3.38Å; E332-K419 WeakPolarHBondContact OE2-CE 3.45Å; E332-K419 IonicContact OE2-NZ 2.8Å; E332-K419 PolarHBondContact OE2-NZ 3.07Å; E332-I420 PolarHBondContact N-O 3.21Å; E332-T421 CarbonylContact O-C 3.54Å; E332-T421 WeakPolarHBondContact O-CA 3.09Å; E332-T421 PolarHBondContact OE2-OG1 2.92Å; E332-T421 VanDerWaalsContact OE2-OG1 3.06Å; E332-I422 PolarHBondContact O-N 2.87Å
333	V	98.3	Very high	95.5	Very high	1 Å²	1	60 Å²	60	1%	0.006	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	120.4	174	-177.2	0	0	0	0	108.3	V331 A340 A341 Y343 F367 V383 W396 I422	V331-V333 HydrophobicContact CG1-CG2 4.26Å; V333-A340 CarbonylContact O-C 3.57Å; V333-A340 VanDerWaalsContact O-CA 3.25Å; V333-A340 WeakPolarHBondContact O-CA 2.98Å; V333-A341 PolarHBondContact N-O 3.29Å; V333-A341 PolarHBondContact O-N 2.8Å; V333-Y343 HydrophobicContact CG2-CD2 4.32Å; V333-Y343 HydrophobicContact CG2-CE2 4.04Å; V333-F367 HydrophobicContact CG2-CD2 4.37Å; V333-F367 HydrophobicContact CG2-CE2 3.9Å; V333-V383 HydrophobicContact CB-CG1 4.34Å; V333-V383 HydrophobicContact CG1-CB 4.25Å; V333-V383 HydrophobicContact CG1-CG1 3.63Å; V333-V383 HydrophobicContact CG2-CG1 3.7Å; V333-W396 HydrophobicContact CG1-CH2 4.17Å; V333-W396 HydrophobicContact CG1-CZ3 3.98Å; V333-I422 CarbonylContact C-O 3.5Å; V333-I422 WeakPolarHBondContact CA-O 3.35Å
334	V	98.1	Very high	96.3	Very high	20 Å²	20	59.8 Å²	59.8	12%	0.121	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	113.6	177.7	-175.9	0	0	0	0	108.8	E332 A340 T421 I422 K423 N424	E332-V334 HydrophobicContact CG-CG2 3.97Å; V334-A340 HydrophobicContact CG2-CB 4.21Å; V334-T421 HydrophobicContact CG2-CG2 4.05Å; V334-I422 PolarHBondContact N-O 2.87Å; V334-K423 HydrophobicContact CB-CB 4.12Å; V334-K423 HydrophobicContact CB-CG 3.98Å; V334-K423 HydrophobicContact CG1-CD 4.46Å; V334-K423 HydrophobicContact CG1-CG 4.11Å; V334-K423 CarbonylContact O-C 3.5Å; V334-K423 WeakPolarHBondContact O-CA 3.08Å; V334-N424 PolarHBondContact O-N 2.8Å
335	T	96.5	Very high	96.7	Very high	31 Å²	31	50.9 Å²	50.9	19%	0.19	33%	0.326	C	S	.	.			trans	-71.2	167.3	178.2	59.7	0	0	0	0	112	S337 G338 A339 E386	T335-S337 PolarHBondContact O-N 2.87Å; T335-S337 PolarHBondContact OG1-OG 3.13Å; T335-S337 VanDerWaalsContact OG1-OG 3.05Å; T335-G338 PolarHBondContact O-N 3.08Å; T335-A339 PolarHBondContact N-O 3.4Å; T335-A339 WeakPolarHBondContact OG1-CA 3.46Å; T335-A339 WeakPolarHBondContact OG1-CB 3.38Å; T335-A339 PolarHBondContact OG1-N 3.46Å; T335-A339 VanDerWaalsContact OG1-N 3.12Å; T335-A339 PolarHBondContact OG1-O 3.26Å; T335-E386 VanDerWaalsContact CA-OE2 3.3Å; T335-E386 WeakPolarHBondContact CA-OE2 3.29Å; T335-E386 WeakPolarHBondContact CB-OE2 3.26Å; T335-E386 WeakPolarHBondContact CG2-OE2 3.46Å
336	A	94.4	Very high	96.9	Very high	56 Å²	56	50.9 Å²	50.9	46%	0.463	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.2	178.9	0	0	0	0	0	113.2	G338 E386 N424	A336-G338 PolarHBondContact O-N 3.26Å; A336-E386 WeakPolarHBondContact CB-OE1 3.48Å; A336-E386 PolarHBondContact N-OE1 2.83Å; A336-E386 PolarHBondContact N-OE2 3.44Å; A336-N424 HydrophobicContact CB-CB 4.32Å
337	S	94.5	Very high	97	Very high	108 Å²	108	44.3 Å²	44.3	76%	0.755	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-7.1	174.6	66.7	0	0	0	0	113.6	T335 A339	T335-S337 PolarHBondContact O-N 2.87Å; T335-S337 PolarHBondContact OG1-OG 3.13Å; T335-S337 VanDerWaalsContact OG1-OG 3.05Å; S337-A339 VanDerWaalsContact C-N 3.34Å
338	G	94.2	Very high	96.9	Very high	52 Å²	52	45.3 Å²	45.3	54%	0.536	30%	0.301	S	S	.	.	S	Bend	trans	86.6	-1.6	-174.4	0	0	0	0	0	114.4	T335 A336	T335-G338 PolarHBondContact O-N 3.08Å; A336-G338 PolarHBondContact O-N 3.26Å
339	A	95.8	Very high	96.9	Very high	56 Å²	56	45.5 Å²	45.5	46%	0.463	30%	0.302	S	S	.	.			trans	-66.2	135.4	172.1	0	0	0	0	0	110.1	T335 S337	T335-A339 PolarHBondContact N-O 3.4Å; T335-A339 WeakPolarHBondContact OG1-CA 3.46Å; T335-A339 WeakPolarHBondContact OG1-CB 3.38Å; T335-A339 PolarHBondContact OG1-N 3.46Å; T335-A339 VanDerWaalsContact OG1-N 3.12Å; T335-A339 PolarHBondContact OG1-O 3.26Å; S337-A339 VanDerWaalsContact C-N 3.34Å
340	A	96.6	Very high	96.7	Very high	67 Å²	67	47 Å²	47	55%	0.554	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.2	-175.6	0	0	0	0	0	111.7	E332 V333 V334	E332-A340 HydrophobicContact CG-CB 4.4Å; V333-A340 CarbonylContact O-C 3.57Å; V333-A340 VanDerWaalsContact O-CA 3.25Å; V333-A340 WeakPolarHBondContact O-CA 2.98Å; V334-A340 HydrophobicContact CG2-CB 4.21Å
341	A	97	Very high	96.6	Very high	35 Å²	35	43.3 Å²	43.3	29%	0.289	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.2	171.1	0	0	0	0	0	109.3	E332 V333 Y343	E332-A341 CarbonylContact C-O 3.56Å; E332-A341 WeakPolarHBondContact CA-O 3.24Å; V333-A341 PolarHBondContact N-O 3.29Å; V333-A341 PolarHBondContact O-N 2.8Å; A341-Y343 HydrophobicContact CB-CE2 3.76Å
342	A	97.3	Very high	96.6	Very high	81 Å²	81	43.6 Å²	43.6	67%	0.669	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.5	-178.3	0	0	0	0	0	110.9	V331	V331-A342 CarbonylContact O-C 3.44Å; V331-A342 WeakPolarHBondContact O-CA 3.49Å
343	Y	97.9	Very high	96.5	Very high	34 Å²	34	41.3 Å²	41.3	13%	0.133	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	156.6	179.4	-51.4	-91.1	0	0	0	109.4	M330 V331 V333 A341 N364 G366 F367 N384	M330-Y343 CarbonylContact C-O 3.54Å; M330-Y343 WeakPolarHBondContact CA-O 3.47Å; V331-Y343 PolarHBondContact N-O 3.21Å; V331-Y343 PolarHBondContact O-N 2.88Å; V333-Y343 HydrophobicContact CG2-CD2 4.32Å; V333-Y343 HydrophobicContact CG2-CE2 4.04Å; A341-Y343 HydrophobicContact CB-CE2 3.76Å; Y343-N364 HydrophobicContact CD1-CB 4.02Å; Y343-G366 PolarHBondContact OH-O 2.88Å; Y343-F367 HydrophobicContact CD1-CB 3.77Å; Y343-F367 HydrophobicContact CD1-CD2 4.34Å; Y343-F367 HydrophobicContact CD1-CG 4.48Å; Y343-F367 AromaticContact CD2-CD2 3.59Å; Y343-F367 HydrophobicContact CD2-CD2 3.59Å; Y343-F367 HydrophobicContact CD2-CE2 4.33Å; Y343-F367 HydrophobicContact CD2-CG 4.46Å; Y343-F367 HydrophobicContact CE1-CB 3.67Å; Y343-F367 HydrophobicContact CE1-CD2 4.39Å; Y343-F367 HydrophobicContact CE2-CB 4.48Å; Y343-F367 AromaticContact CE2-CD2 3.69Å; Y343-F367 HydrophobicContact CE2-CD2 3.69Å; Y343-F367 HydrophobicContact CG-CB 4.17Å; Y343-F367 AromaticContact CG-CD2 3.93Å; Y343-F367 HydrophobicContact CG-CD2 3.93Å; Y343-F367 HydrophobicContact CG-CG 4.41Å; Y343-N384 PolarHBondContact OH-ND2 3.18Å
344	S	97.4	Very high	96.5	Very high	41 Å²	41	42.1 Å²	42.1	29%	0.287	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	148.3	176.5	-164.9	0	0	0	0	112.2	K328 V329 N364	K328-S344 WeakPolarHBondContact CE-OG 3.27Å; V329-S344 VanDerWaalsContact O-CA 3.25Å; V329-S344 WeakPolarHBondContact O-CA 3.39Å; V329-S344 PolarHBondContact O-OG 2.91Å; S344-N364 PolarHBondContact O-ND2 3.27Å
345	V	97.6	Very high	96.5	Very high	8 Å²	8	45.4 Å²	45.4	5%	0.048	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	148.8	178.4	65.8	0	0	0	0	110.2	V329 V347 L359 L360 K363	V329-V345 HydrophobicContact CB-CG1 4.35Å; V329-V345 PolarHBondContact N-O 2.81Å; V329-V345 PolarHBondContact O-N 2.92Å; V329-V345 VanDerWaalsContact O-N 3.08Å; V345-V347 HydrophobicContact CG1-CG1 4.01Å; V345-V347 HydrophobicContact CG2-CG1 4.42Å; V345-L359 HydrophobicContact CG2-CB 4.09Å; V345-L359 HydrophobicContact CG2-CD2 3.41Å; V345-L359 VanDerWaalsContact CG2-CD2 3.41Å; V345-L359 HydrophobicContact CG2-CG 3.55Å; V345-L360 HydrophobicContact CB-CD2 3.68Å; V345-L360 HydrophobicContact CB-CG 4.08Å; V345-L360 HydrophobicContact CG1-CD1 4.4Å; V345-L360 HydrophobicContact CG1-CD2 3.77Å; V345-L360 HydrophobicContact CG1-CG 3.73Å; V345-K363 HydrophobicContact CG2-CD 4.46Å
346	D	97.6	Very high	96.6	Very high	85 Å²	85	44 Å²	44	46%	0.455	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.4	167	-60.7	-57.8	0	0	0	109.7	K326 V327 K328 L359	K326-D346 HydrophobicContact CB-CB 4.26Å; K326-D346 HydrophobicContact CD-CB 4.28Å; V327-D346 WeakPolarHBondContact O-CA 3.44Å; K328-D346 WeakPolarHBondContact CA-OD1 3.42Å; K328-D346 WeakPolarHBondContact CB-OD1 3.49Å; D346-L359 WeakPolarHBondContact O-CD2 3.44Å
347	V	96.4	Very high	96.8	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	150.2	179.1	-65.6	0	0	0	0	110.7	K326 V327 V329 V345 K349 A356 L359 I414	K326-V347 CarbonylContact C-O 3.46Å; K326-V347 VanDerWaalsContact CA-O 3.24Å; K326-V347 WeakPolarHBondContact CA-O 3.41Å; V327-V347 HydrophobicContact CG2-CG2 3.91Å; V327-V347 PolarHBondContact N-O 2.93Å; V327-V347 PolarHBondContact O-N 2.83Å; V329-V347 HydrophobicContact CG2-CG2 3.71Å; V345-V347 HydrophobicContact CG1-CG1 4.01Å; V345-V347 HydrophobicContact CG2-CG1 4.42Å; V347-K349 PolarHBondContact O-N 3.26Å; V347-A356 HydrophobicContact CG1-CB 3.83Å; V347-L359 HydrophobicContact CG1-CD2 3.96Å; V347-I414 HydrophobicContact CG2-CB 4.46Å; V347-I414 HydrophobicContact CG2-CD1 4.39Å; V347-I414 HydrophobicContact CG2-CG2 4.16Å
348	P	96.4	Very high	96.9	Very high	37 Å²	37	39.1 Å²	39.1	24%	0.24	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	136.4	167.3	-26.6	36.2	0	0	0	111.6	P322 S323 G350 S351	P322-P348 HydrophobicContact CB-CB 4.31Å; P322-P348 HydrophobicContact CB-CG 4.32Å; S323-P348 WeakPolarHBondContact O-CB 3.15Å; P348-G350 PolarHBondContact O-N 3.14Å; P348-S351 WeakPolarHBondContact CD-OG 3.44Å; P348-S351 WeakPolarHBondContact O-CB 3.25Å; P348-S351 PolarHBondContact O-N 2.84Å; P348-S351 VanDerWaalsContact O-N 3.07Å; P348-S351 PolarHBondContact O-OG 3.04Å
349	K	95.9	Very high	97.1	Very high	102 Å²	102	37.9 Å²	37.9	44%	0.443	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	130.8	173.9	-176.7	-179	177.5	178.9	0	109.9	S323 T325 V327 V347 N415	S323-K349 VanDerWaalsContact CB-O 3.26Å; S323-K349 WeakPolarHBondContact CB-O 3.42Å; T325-K349 WeakPolarHBondContact O-CB 3.47Å; T325-K349 PolarHBondContact O-N 3.21Å; V327-K349 HydrophobicContact CG1-CB 4.19Å; V327-K349 HydrophobicContact CG1-CG 4.43Å; V347-K349 PolarHBondContact O-N 3.26Å; K349-N415 VanDerWaalsContact CE-O 3.29Å; K349-N415 WeakPolarHBondContact CE-O 3.26Å
350	G	94.4	Very high	97.2	Very high	32 Å²	32	35.2 Å²	35.2	33%	0.33	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	1	-176.5	0	0	0	0	0	114.4	P348 K413 I414	P348-G350 PolarHBondContact O-N 3.14Å; G350-K413 WeakPolarHBondContact O-CD 3.19Å; G350-I414 PolarHBondContact N-O 3.4Å
351	S	96.3	Very high	97.2	Very high	13 Å²	13	36.2 Å²	36.2	9%	0.091	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	144.8	170	-54.8	0	0	0	0	110.5	P348 E355 I414	P348-S351 WeakPolarHBondContact CD-OG 3.44Å; P348-S351 WeakPolarHBondContact O-CB 3.25Å; P348-S351 PolarHBondContact O-N 2.84Å; P348-S351 VanDerWaalsContact O-N 3.07Å; P348-S351 PolarHBondContact O-OG 3.04Å; S351-E355 WeakPolarHBondContact CA-OE2 3.43Å; S351-I414 PolarHBondContact O-N 3.08Å
352	S	96.9	Very high	97.2	Very high	7 Å²	7	42.9 Å²	42.9	5%	0.049	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	158.9	167.1	61.8	0	0	0	0	111.8	L354 E355 A356 G410 F412	S352-L354 PolarHBondContact O-N 3.38Å; S352-E355 WeakPolarHBondContact CB-OE2 3.49Å; S352-E355 PolarHBondContact N-OE2 2.99Å; S352-E355 PolarHBondContact O-N 3.02Å; S352-E355 VanDerWaalsContact OG-CG 3.26Å; S352-E355 WeakPolarHBondContact OG-CG 3.4Å; S352-E355 PolarHBondContact OG-N 3.15Å; S352-E355 VanDerWaalsContact OG-N 3.14Å; S352-E355 PolarHBondContact OG-OE2 3.49Å; S352-A356 PolarHBondContact O-N 3.26Å; S352-G410 WeakPolarHBondContact CB-O 3.23Å; S352-F412 CarbonylContact C-O 3.51Å; S352-F412 VanDerWaalsContact CA-O 3.27Å; S352-F412 WeakPolarHBondContact CA-O 3.44Å
353	L	98.1	Very high	97.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-37.9	170.1	176.5	55.5	0	0	0	111.4	E355 A356 L357 L398 L405 V409 F412 I414 I420	L353-E355 PolarHBondContact O-N 2.84Å; L353-A356 WeakPolarHBondContact O-CA 3.25Å; L353-A356 WeakPolarHBondContact O-CB 3.29Å; L353-A356 PolarHBondContact O-N 2.95Å; L353-A356 VanDerWaalsContact O-N 3.12Å; L353-L357 HydrophobicContact CD1-CD2 3.93Å; L353-L357 HydrophobicContact CD1-CG 4.29Å; L353-L357 HydrophobicContact CG-CG 4.43Å; L353-L357 WeakPolarHBondContact O-CG 3.41Å; L353-L357 PolarHBondContact O-N 2.83Å; L353-L398 HydrophobicContact CD2-CD1 4.41Å; L353-L405 HydrophobicContact CD2-CD1 4Å; L353-V409 CarbonylContact C-O 3.57Å; L353-V409 HydrophobicContact CB-CB 4.43Å; L353-V409 HydrophobicContact CD2-CB 4.45Å; L353-V409 HydrophobicContact CD2-CG1 3.94Å; L353-V409 HydrophobicContact CG-CB 4.31Å; L353-V409 HydrophobicContact CG-CG1 4.18Å; L353-V409 PolarHBondContact N-O 3.21Å; L353-F412 HydrophobicContact CB-CD1 4.23Å; L353-F412 PolarHBondContact N-O 2.82Å; L353-I414 HydrophobicContact CD1-CD1 4.45Å; L353-I420 HydrophobicContact CD1-CB 4.44Å; L353-I420 HydrophobicContact CD1-CG1 4.05Å; L353-I420 HydrophobicContact CD1-CG2 3.98Å; L353-I420 HydrophobicContact CD2-CG2 4.04Å
354	L	97.8	Very high	97.1	Very high	18 Å²	18	45.9 Å²	45.9	9%	0.094	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-48.6	177.1	178.2	61.7	0	0	0	111.8	S352 A356 L357 E358 F369 K371 P378 V409	S352-L354 PolarHBondContact O-N 3.38Å; L354-A356 PolarHBondContact O-N 2.68Å; L354-L357 PolarHBondContact O-N 3.3Å; L354-E358 HydrophobicContact CD1-CG 4.28Å; L354-E358 HydrophobicContact CG-CG 4.43Å; L354-E358 WeakPolarHBondContact O-CG 3.02Å; L354-E358 PolarHBondContact O-N 3.38Å; L354-F369 HydrophobicContact CD1-CE2 3.69Å; L354-F369 HydrophobicContact CD1-CZ 3.98Å; L354-K371 HydrophobicContact CD1-CD 4.48Å; L354-P378 HydrophobicContact CD2-CB 4.34Å; L354-P378 HydrophobicContact CD2-CG 3.81Å; L354-V409 HydrophobicContact CB-CB 4.27Å; L354-V409 HydrophobicContact CB-CG2 4.24Å; L354-V409 WeakPolarHBondContact CB-O 3.43Å; L354-V409 HydrophobicContact CD1-CG2 4.35Å; L354-V409 PolarHBondContact N-O 3.33Å
355	E	97.7	Very high	96.8	Very high	90 Å²	90	51.2 Å²	51.2	42%	0.421	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-34.5	176.7	-73.8	162.2	127	0	0	111.7	S351 S352 L353 L359	S351-E355 WeakPolarHBondContact CA-OE2 3.43Å; S352-E355 WeakPolarHBondContact CB-OE2 3.49Å; S352-E355 PolarHBondContact N-OE2 2.99Å; S352-E355 PolarHBondContact O-N 3.02Å; S352-E355 VanDerWaalsContact OG-CG 3.26Å; S352-E355 WeakPolarHBondContact OG-CG 3.4Å; S352-E355 PolarHBondContact OG-N 3.15Å; S352-E355 VanDerWaalsContact OG-N 3.14Å; S352-E355 PolarHBondContact OG-OE2 3.49Å; L353-E355 PolarHBondContact O-N 2.84Å; E355-L359 WeakPolarHBondContact O-CB 3.29Å; E355-L359 PolarHBondContact O-N 3.16Å
356	A	97.9	Very high	96.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.7	-42.4	173.1	0	0	0	0	0	112.2	V347 S352 L353 L354 L359 L360 I414	V347-A356 HydrophobicContact CG1-CB 3.83Å; S352-A356 PolarHBondContact O-N 3.26Å; L353-A356 WeakPolarHBondContact O-CA 3.25Å; L353-A356 WeakPolarHBondContact O-CB 3.29Å; L353-A356 PolarHBondContact O-N 2.95Å; L353-A356 VanDerWaalsContact O-N 3.12Å; L354-A356 PolarHBondContact O-N 2.68Å; A356-L359 PolarHBondContact O-N 3.07Å; A356-L360 WeakPolarHBondContact O-CB 3.28Å; A356-L360 WeakPolarHBondContact O-CG 3.46Å; A356-L360 PolarHBondContact O-N 3.27Å; A356-I414 HydrophobicContact CB-CD1 3.71Å
357	L	98.4	Very high	96.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.1	-41.6	175.9	-56.5	-167.8	0	0	0	111.6	V331 L353 L354 L359 L360 E361 F367 F369 L380 V409 I422	V331-L357 HydrophobicContact CG1-CD2 4.38Å; V331-L357 HydrophobicContact CG2-CD2 4.27Å; L353-L357 HydrophobicContact CD1-CD2 3.93Å; L353-L357 HydrophobicContact CD1-CG 4.29Å; L353-L357 HydrophobicContact CG-CG 4.43Å; L353-L357 WeakPolarHBondContact O-CG 3.41Å; L353-L357 PolarHBondContact O-N 2.83Å; L354-L357 PolarHBondContact O-N 3.3Å; L357-L359 VanDerWaalsContact C-N 3.29Å; L357-L359 PolarHBondContact O-N 3.48Å; L357-L360 HydrophobicContact CD2-CD1 4.18Å; L357-L360 WeakPolarHBondContact O-CB 3.16Å; L357-L360 PolarHBondContact O-N 2.9Å; L357-E361 PolarHBondContact O-N 3.48Å; L357-F367 HydrophobicContact CB-CE1 4.11Å; L357-F367 HydrophobicContact CB-CZ 4.26Å; L357-F367 HydrophobicContact CD2-CE1 4.47Å; L357-F367 HydrophobicContact CD2-CZ 3.86Å; L357-F367 HydrophobicContact CG-CZ 4.44Å; L357-F367 WeakPolarHBondContact O-CE1 3.33Å; L357-F369 HydrophobicContact CB-CD1 4.09Å; L357-F369 HydrophobicContact CB-CD2 4.49Å; L357-F369 HydrophobicContact CB-CE1 3.82Å; L357-F369 HydrophobicContact CB-CE2 4.23Å; L357-F369 HydrophobicContact CB-CG 4.42Å; L357-F369 HydrophobicContact CB-CZ 3.89Å; L357-F369 HydrophobicContact CD1-CD2 4.35Å; L357-F369 WeakPolarHBondContact O-CE1 3.37Å; L357-L380 HydrophobicContact CD1-CD1 4.2Å; L357-L380 HydrophobicContact CD1-CD2 4.49Å; L357-V409 HydrophobicContact CD1-CG1 4.33Å; L357-I422 HydrophobicContact CD1-CD1 4.18Å; L357-I422 HydrophobicContact CD2-CD1 3.9Å
358	E	98.2	Very high	96.6	Very high	63 Å²	63	52.3 Å²	52.3	29%	0.294	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-35.2	175.4	-70.3	175.1	172.9	0	0	112	L354 R362 F369	L354-E358 HydrophobicContact CD1-CG 4.28Å; L354-E358 HydrophobicContact CG-CG 4.43Å; L354-E358 WeakPolarHBondContact O-CG 3.02Å; L354-E358 PolarHBondContact O-N 3.38Å; E358-R362 WeakPolarHBondContact O-CG 3.39Å; E358-R362 PolarHBondContact O-N 2.79Å; E358-R362 PolarHBondContact O-NE 2.97Å; E358-F369 HydrophobicContact CG-CE1 4.33Å; E358-F369 HydrophobicContact CG-CZ 3.74Å
359	L	97.6	Very high	96.7	Very high	26 Å²	26	51.4 Å²	51.4	14%	0.136	27%	0.27	C	S	.	.	H	α-helix	trans	-74.6	-35.2	175	-168.5	59.9	0	0	0	111.9	V345 D346 V347 E355 A356 L357 R362 K363	V345-L359 HydrophobicContact CG2-CB 4.09Å; V345-L359 HydrophobicContact CG2-CD2 3.41Å; V345-L359 VanDerWaalsContact CG2-CD2 3.41Å; V345-L359 HydrophobicContact CG2-CG 3.55Å; D346-L359 WeakPolarHBondContact O-CD2 3.44Å; V347-L359 HydrophobicContact CG1-CD2 3.96Å; E355-L359 WeakPolarHBondContact O-CB 3.29Å; E355-L359 PolarHBondContact O-N 3.16Å; A356-L359 PolarHBondContact O-N 3.07Å; L357-L359 VanDerWaalsContact C-N 3.29Å; L357-L359 PolarHBondContact O-N 3.48Å; L359-R362 PolarHBondContact O-N 3.31Å; L359-K363 HydrophobicContact CD1-CD 3.97Å; L359-K363 HydrophobicContact CD1-CG 4.3Å; L359-K363 HydrophobicContact CG-CD 4.08Å; L359-K363 WeakPolarHBondContact O-CB 3.13Å; L359-K363 WeakPolarHBondContact O-CG 3.29Å; L359-K363 PolarHBondContact O-N 2.82Å; L359-K363 VanDerWaalsContact O-N 3.13Å
360	L	97.6	Very high	96.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-48.8	172.9	-79.1	172.1	0	0	0	111.3	V331 V345 A356 L357 R362 K363 N364 F367	V331-L360 HydrophobicContact CB-CD1 3.72Å; V331-L360 HydrophobicContact CG1-CD1 4.32Å; V331-L360 HydrophobicContact CG2-CD1 3.42Å; V331-L360 VanDerWaalsContact CG2-CD1 3.42Å; V345-L360 HydrophobicContact CB-CD2 3.68Å; V345-L360 HydrophobicContact CB-CG 4.08Å; V345-L360 HydrophobicContact CG1-CD1 4.4Å; V345-L360 HydrophobicContact CG1-CD2 3.77Å; V345-L360 HydrophobicContact CG1-CG 3.73Å; A356-L360 WeakPolarHBondContact O-CB 3.28Å; A356-L360 WeakPolarHBondContact O-CG 3.46Å; A356-L360 PolarHBondContact O-N 3.27Å; L357-L360 HydrophobicContact CD2-CD1 4.18Å; L357-L360 WeakPolarHBondContact O-CB 3.16Å; L357-L360 PolarHBondContact O-N 2.9Å; L360-R362 PolarHBondContact O-N 3.13Å; L360-K363 PolarHBondContact O-N 2.9Å; L360-K363 VanDerWaalsContact O-N 3.08Å; L360-N364 VanDerWaalsContact CD2-ND2 3.25Å; L360-N364 WeakPolarHBondContact CD2-ND2 3.44Å; L360-N364 WeakPolarHBondContact O-CB 3.35Å; L360-N364 PolarHBondContact O-N 3.46Å; L360-F367 HydrophobicContact CB-CD1 3.48Å; L360-F367 VanDerWaalsContact CB-CD1 3.48Å; L360-F367 HydrophobicContact CB-CE1 3.76Å; L360-F367 HydrophobicContact CB-CG 3.95Å; L360-F367 HydrophobicContact CB-CZ 4.46Å; L360-F367 HydrophobicContact CD1-CE1 4.34Å; L360-F367 HydrophobicContact CD1-CE2 4.35Å; L360-F367 HydrophobicContact CD1-CZ 4.25Å
361	E	97.8	Very high	96.8	Very high	87 Å²	87	56 Å²	56	41%	0.407	28%	0.283	S	S	.	.	H	α-helix	trans	-58.6	-35.9	-179.9	-176.8	172.7	-112.6	0	0	112	L357 F367 F369	L357-E361 PolarHBondContact O-N 3.48Å; E361-F367 HydrophobicContact CB-CD1 4.12Å; E361-F369 HydrophobicContact CB-CD1 4.25Å; E361-F369 HydrophobicContact CB-CE1 4.09Å; E361-F369 PolarHBondContact OE1-N 2.9Å
362	R	97.1	Very high	96.6	Very high	176 Å²	176	60 Å²	60	66%	0.664	30%	0.3	S	S	*	.	H	α-helix	trans	-74.6	-30.9	176.6	-74.2	178	-78.3	163.5	-10.8	114.2	E358 L359 L360	E358-R362 WeakPolarHBondContact O-CG 3.39Å; E358-R362 PolarHBondContact O-N 2.79Å; E358-R362 PolarHBondContact O-NE 2.97Å; L359-R362 PolarHBondContact O-N 3.31Å; L360-R362 PolarHBondContact O-N 3.13Å
363	K	96.3	Very high	96.3	Very high	131 Å²	131	64.8 Å²	64.8	57%	0.57	33%	0.334	S	S	*	.	H	α-helix	trans	-108.3	-24.9	-168.4	-71.9	-172.1	173.4	177.8	0	114.9	V345 L359 L360	V345-K363 HydrophobicContact CG2-CD 4.46Å; L359-K363 HydrophobicContact CD1-CD 3.97Å; L359-K363 HydrophobicContact CD1-CG 4.3Å; L359-K363 HydrophobicContact CG-CD 4.08Å; L359-K363 WeakPolarHBondContact O-CB 3.13Å; L359-K363 WeakPolarHBondContact O-CG 3.29Å; L359-K363 PolarHBondContact O-N 2.82Å; L359-K363 VanDerWaalsContact O-N 3.13Å; L360-K363 PolarHBondContact O-N 2.9Å; L360-K363 VanDerWaalsContact O-N 3.08Å
364	N	95.1	Very high	96	Very high	46 Å²	46	67.4 Å²	67.4	25%	0.246	35%	0.352	C	S	.	.	S	Bend	trans	-114.2	113.1	-173.6	-70.8	-86.6	0	0	0	109.9	Y343 S344 L360 G366 F367	Y343-N364 HydrophobicContact CD1-CB 4.02Å; S344-N364 PolarHBondContact O-ND2 3.27Å; L360-N364 VanDerWaalsContact CD2-ND2 3.25Å; L360-N364 WeakPolarHBondContact CD2-ND2 3.44Å; L360-N364 WeakPolarHBondContact O-CB 3.35Å; L360-N364 PolarHBondContact O-N 3.46Å; N364-G366 PolarHBondContact O-N 2.82Å; N364-F367 HydrophobicContact CB-CB 4.31Å; N364-F367 PolarHBondContact O-N 2.91Å
365	V	91.8	Very high	95.7	Very high	153 Å²	153	68.4 Å²	68.4	93%	0.927	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	126.9	174.4	-179.4	0	0	0	0	108.9
366	G	91.8	Very high	95.6	Very high	50 Å²	50	69 Å²	69	52%	0.515	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	2.8	177.6	0	0	0	0	0	115.4	Y343 N364 N384	Y343-G366 PolarHBondContact OH-O 2.88Å; N364-G366 PolarHBondContact O-N 2.82Å; G366-N384 PolarHBondContact O-OD1 3.12Å
367	F	97.9	Very high	95.4	Very high	3 Å²	3	70.2 Å²	70.2	1%	0.013	37%	0.369	C	S	.	.			trans	-92.1	121.9	160.9	-174.8	-94.8	0	0	0	109.3	V331 V333 Y343 L357 L360 E361 N364 F369 V383 N384	V331-F367 HydrophobicContact CG1-CE2 4.31Å; V333-F367 HydrophobicContact CG2-CD2 4.37Å; V333-F367 HydrophobicContact CG2-CE2 3.9Å; Y343-F367 HydrophobicContact CD1-CB 3.77Å; Y343-F367 HydrophobicContact CD1-CD2 4.34Å; Y343-F367 HydrophobicContact CD1-CG 4.48Å; Y343-F367 AromaticContact CD2-CD2 3.59Å; Y343-F367 HydrophobicContact CD2-CD2 3.59Å; Y343-F367 HydrophobicContact CD2-CE2 4.33Å; Y343-F367 HydrophobicContact CD2-CG 4.46Å; Y343-F367 HydrophobicContact CE1-CB 3.67Å; Y343-F367 HydrophobicContact CE1-CD2 4.39Å; Y343-F367 HydrophobicContact CE2-CB 4.48Å; Y343-F367 AromaticContact CE2-CD2 3.69Å; Y343-F367 HydrophobicContact CE2-CD2 3.69Å; Y343-F367 HydrophobicContact CG-CB 4.17Å; Y343-F367 AromaticContact CG-CD2 3.93Å; Y343-F367 HydrophobicContact CG-CD2 3.93Å; Y343-F367 HydrophobicContact CG-CG 4.41Å; L357-F367 HydrophobicContact CB-CE1 4.11Å; L357-F367 HydrophobicContact CB-CZ 4.26Å; L357-F367 HydrophobicContact CD2-CE1 4.47Å; L357-F367 HydrophobicContact CD2-CZ 3.86Å; L357-F367 HydrophobicContact CG-CZ 4.44Å; L357-F367 WeakPolarHBondContact O-CE1 3.33Å; L360-F367 HydrophobicContact CB-CD1 3.48Å; L360-F367 VanDerWaalsContact CB-CD1 3.48Å; L360-F367 HydrophobicContact CB-CE1 3.76Å; L360-F367 HydrophobicContact CB-CG 3.95Å; L360-F367 HydrophobicContact CB-CZ 4.46Å; L360-F367 HydrophobicContact CD1-CE1 4.34Å; L360-F367 HydrophobicContact CD1-CE2 4.35Å; L360-F367 HydrophobicContact CD1-CZ 4.25Å; E361-F367 HydrophobicContact CB-CD1 4.12Å; N364-F367 HydrophobicContact CB-CB 4.31Å; N364-F367 PolarHBondContact O-N 2.91Å; F367-F369 HydrophobicContact CD1-CD1 4.5Å; F367-F369 HydrophobicContact CE1-CB 4.44Å; F367-F369 AromaticContact CE1-CD1 3.7Å; F367-F369 HydrophobicContact CE1-CD1 3.7Å; F367-F369 HydrophobicContact CE1-CE1 4.42Å; F367-F369 HydrophobicContact CE1-CG 4.37Å; F367-F369 HydrophobicContact CZ-CB 4.5Å; F367-F369 HydrophobicContact CZ-CD1 4.42Å; F367-V383 HydrophobicContact CE2-CG1 4.17Å; F367-N384 WeakPolarHBondContact CA-OD1 3.45Å
368	T	97.8	Very high	95.2	Very high	64 Å²	64	72 Å²	72	39%	0.393	38%	0.38	S	S	.	.			trans	-137.7	150.4	173.5	60.1	0	0	0	0	109.8	V383 N384	T368-V383 CarbonylContact O-C 3.44Å; T368-V383 WeakPolarHBondContact O-CA 3.02Å; T368-N384 PolarHBondContact N-OD1 3.3Å; T368-N384 PolarHBondContact O-N 3.24Å
369	F	98	Very high	95	Very high	19 Å²	19	73.7 Å²	73.7	8%	0.083	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	160.1	172.6	75.9	-72.8	0	0	0	112	L354 L357 E358 E361 F367 L380 V382 V383	L354-F369 HydrophobicContact CD1-CE2 3.69Å; L354-F369 HydrophobicContact CD1-CZ 3.98Å; L357-F369 HydrophobicContact CB-CD1 4.09Å; L357-F369 HydrophobicContact CB-CD2 4.49Å; L357-F369 HydrophobicContact CB-CE1 3.82Å; L357-F369 HydrophobicContact CB-CE2 4.23Å; L357-F369 HydrophobicContact CB-CG 4.42Å; L357-F369 HydrophobicContact CB-CZ 3.89Å; L357-F369 HydrophobicContact CD1-CD2 4.35Å; L357-F369 WeakPolarHBondContact O-CE1 3.37Å; E358-F369 HydrophobicContact CG-CE1 4.33Å; E358-F369 HydrophobicContact CG-CZ 3.74Å; E361-F369 HydrophobicContact CB-CD1 4.25Å; E361-F369 HydrophobicContact CB-CE1 4.09Å; E361-F369 PolarHBondContact OE1-N 2.9Å; F367-F369 HydrophobicContact CD1-CD1 4.5Å; F367-F369 HydrophobicContact CE1-CB 4.44Å; F367-F369 AromaticContact CE1-CD1 3.7Å; F367-F369 HydrophobicContact CE1-CD1 3.7Å; F367-F369 HydrophobicContact CE1-CE1 4.42Å; F367-F369 HydrophobicContact CE1-CG 4.37Å; F367-F369 HydrophobicContact CZ-CB 4.5Å; F367-F369 HydrophobicContact CZ-CD1 4.42Å; F369-L380 HydrophobicContact CB-CD1 4.1Å; F369-L380 HydrophobicContact CD2-CD1 3.7Å; F369-L380 HydrophobicContact CG-CD1 4.33Å; F369-V382 CarbonylContact C-O 3.44Å; F369-V382 WeakPolarHBondContact CA-O 3.44Å; F369-V382 WeakPolarHBondContact CB-O 3.24Å; F369-V383 HydrophobicContact CB-CG2 4.47Å
370	Q	97.7	Very high	94.9	Very high	121 Å²	121	72.9 Å²	72.9	57%	0.565	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.4	170.9	-54.4	178.7	9.8	0	0	109.6	S381 V382	Q370-S381 PolarHBondContact O-N 3.41Å; Q370-S381 PolarHBondContact O-OG 3.26Å; Q370-V382 HydrophobicContact CB-CB 3.82Å; Q370-V382 HydrophobicContact CB-CG2 4.05Å; Q370-V382 HydrophobicContact CG-CB 4Å; Q370-V382 HydrophobicContact CG-CG2 4.32Å; Q370-V382 PolarHBondContact N-O 3.29Å; Q370-V382 PolarHBondContact O-N 3.18Å
371	K	94.8	Very high	94.8	Very high	108 Å²	108	73 Å²	73	47%	0.47	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151	178.9	52.1	170.7	178.3	171.2	0	110.7	L354 P378 F379	L354-K371 HydrophobicContact CD1-CD 4.48Å; K371-P378 HydrophobicContact CB-CB 4.3Å; K371-P378 HydrophobicContact CD-CB 3.68Å; K371-F379 CarbonylContact C-O 3.24Å; K371-F379 VanDerWaalsContact CA-O 3.22Å; K371-F379 WeakPolarHBondContact CA-O 3.25Å
372	E	92.2	Very high	94.8	Very high	97 Å²	97	69.3 Å²	69.3	45%	0.453	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	144.4	168.1	-69.2	174.9	-165.4	0	0	109	F379 S381	E372-F379 PolarHBondContact N-O 2.76Å; E372-F379 PolarHBondContact O-N 3.43Å; E372-S381 WeakPolarHBondContact OE1-CB 3.46Å
373	S	90.2	Very high	94.8	Very high	108 Å²	108	61 Å²	61	76%	0.755	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	138.4	173.4	-62.3	0	0	0	0	110.2
374	S	91.8	Very high	94.9	Very high	55 Å²	55	57.1 Å²	57.1	39%	0.385	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	167.9	172.9	84.4	0	0	0	0	110.8	W376 G377	S374-W376 PolarHBondContact O-N 3.08Å; S374-W376 PolarHBondContact OG-N 2.82Å; S374-W376 VanDerWaalsContact OG-N 3.16Å; S374-G377 WeakPolarHBondContact CB-O 3.25Å; S374-G377 PolarHBondContact N-O 3.48Å; S374-G377 PolarHBondContact O-N 2.71Å; S374-G377 PolarHBondContact OG-N 2.72Å; S374-G377 PolarHBondContact OG-O 2.84Å
375	L	92.9	Very high	94.9	Very high	39 Å²	39	57.9 Å²	57.9	20%	0.204	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.4	174.2	-62.4	-176.9	0	0	0	113.3	N48 P49 L97 M280	N48-L375 HydrophobicContact CB-CD2 4.36Å; N48-L375 PolarHBondContact ND2-O 2.96Å; P49-L375 HydrophobicContact CG-CD1 4.25Å; L97-L375 HydrophobicContact CD1-CD1 3.49Å; L97-L375 VanDerWaalsContact CD1-CD1 3.49Å; M280-L375 WeakPolarHBondContact CB-O 3.33Å; M280-L375 HydrophobicContact SD-CB 4.06Å
376	W	94.1	Very high	95.1	Very high	102 Å²	102	52.6 Å²	52.6	39%	0.386	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	1.9	174.2	-75.9	89.9	0	0	0	112.9	N278 M280 A281 S374	N278-W376 PolarHBondContact ND2-O 3.15Å; M280-W376 HydrophobicContact CB-CD2 3.93Å; M280-W376 HydrophobicContact CB-CE3 4Å; M280-W376 HydrophobicContact CB-CG 4.33Å; M280-W376 HydrophobicContact CB-CZ3 4.4Å; M280-W376 HydrophobicContact CG-CD2 3.5Å; M280-W376 VanDerWaalsContact CG-CD2 3.5Å; M280-W376 HydrophobicContact CG-CE3 4.02Å; M280-W376 HydrophobicContact CG-CG 3.83Å; M280-W376 HydrophobicContact CG-CH2 4.31Å; M280-W376 HydrophobicContact CG-CZ2 3.82Å; M280-W376 HydrophobicContact CG-CZ3 4.4Å; A281-W376 HydrophobicContact CB-CH2 4.35Å; A281-W376 HydrophobicContact CB-CZ3 3.96Å; S374-W376 PolarHBondContact O-N 3.08Å; S374-W376 PolarHBondContact OG-N 2.82Å; S374-W376 VanDerWaalsContact OG-N 3.16Å
377	G	93.7	Very high	95.3	Very high	27 Å²	27	52.8 Å²	52.8	28%	0.278	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100.9	-157.5	-174.3	0	0	0	0	0	112.8	S374 F379	S374-G377 WeakPolarHBondContact CB-O 3.25Å; S374-G377 PolarHBondContact N-O 3.48Å; S374-G377 PolarHBondContact O-N 2.71Å; S374-G377 PolarHBondContact OG-N 2.72Å; S374-G377 PolarHBondContact OG-O 2.84Å; G377-F379 PolarHBondContact O-N 2.83Å
378	P	94.4	Very high	95	Very high	37 Å²	37	52.7 Å²	52.7	24%	0.24	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	117.2	-172.5	27	-32.5	0	0	0	111.6	L354 K371 V409	L354-P378 HydrophobicContact CD2-CB 4.34Å; L354-P378 HydrophobicContact CD2-CG 3.81Å; K371-P378 HydrophobicContact CB-CB 4.3Å; K371-P378 HydrophobicContact CD-CB 3.68Å; P378-V409 HydrophobicContact CB-CG2 4.48Å; P378-V409 HydrophobicContact CG-CG2 4.24Å; P378-V409 WeakPolarHBondContact O-CG2 3.36Å
379	F	94.2	Very high	94.4	Very high	98 Å²	98	55.7 Å²	55.7	43%	0.43	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.2	176.5	-179.5	-103.6	0	0	0	110.4	K371 E372 G377 S381	K371-F379 CarbonylContact C-O 3.24Å; K371-F379 VanDerWaalsContact CA-O 3.22Å; K371-F379 WeakPolarHBondContact CA-O 3.25Å; E372-F379 PolarHBondContact N-O 2.76Å; E372-F379 PolarHBondContact O-N 3.43Å; G377-F379 PolarHBondContact O-N 2.83Å; F379-S381 PolarHBondContact O-N 3.19Å
380	L	96.4	Very high	93.6	Very high	10 Å²	10	58 Å²	58	5%	0.052	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	119.3	-178.4	-168.4	65.5	0	0	0	110.5	L357 F369 V383 W396 L398 V409 I422	L357-L380 HydrophobicContact CD1-CD1 4.2Å; L357-L380 HydrophobicContact CD1-CD2 4.49Å; F369-L380 HydrophobicContact CB-CD1 4.1Å; F369-L380 HydrophobicContact CD2-CD1 3.7Å; F369-L380 HydrophobicContact CG-CD1 4.33Å; L380-V383 HydrophobicContact CD1-CG2 4Å; L380-V383 HydrophobicContact CD2-CG2 3.67Å; L380-V383 HydrophobicContact CG-CG2 3.8Å; L380-W396 HydrophobicContact CD2-CB 3.96Å; L380-W396 HydrophobicContact CD2-CG 4.2Å; L380-W396 HydrophobicContact CG-CB 4.35Å; L380-W396 HydrophobicContact CG-CG 4.32Å; L380-L398 HydrophobicContact CD2-CD2 4.09Å; L380-V409 HydrophobicContact CD2-CG1 4.5Å; L380-I422 HydrophobicContact CD2-CD1 4.33Å; L380-I422 HydrophobicContact CD2-CG2 3.73Å
381	S	95.4	Very high	92.7	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-38.6	-173.4	62.9	0	0	0	0	113.5	Q370 E372 F379 A388 W396	Q370-S381 PolarHBondContact O-N 3.41Å; Q370-S381 PolarHBondContact O-OG 3.26Å; E372-S381 WeakPolarHBondContact OE1-CB 3.46Å; F379-S381 PolarHBondContact O-N 3.19Å; S381-A388 PolarHBondContact O-N 3.26Å; S381-W396 PolarHBondContact O-NE1 2.9Å; S381-W396 VanDerWaalsContact O-NE1 3.14Å
382	V	97.4	Very high	92.2	Very high	9 Å²	9	54.6 Å²	54.6	6%	0.055	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136.6	179.5	-175.9	0	0	0	0	109.3	F369 Q370 E386 Q387	F369-V382 CarbonylContact C-O 3.44Å; F369-V382 WeakPolarHBondContact CA-O 3.44Å; F369-V382 WeakPolarHBondContact CB-O 3.24Å; Q370-V382 HydrophobicContact CB-CB 3.82Å; Q370-V382 HydrophobicContact CB-CG2 4.05Å; Q370-V382 HydrophobicContact CG-CB 4Å; Q370-V382 HydrophobicContact CG-CG2 4.32Å; Q370-V382 PolarHBondContact N-O 3.29Å; Q370-V382 PolarHBondContact O-N 3.18Å; V382-E386 CarbonylContact C-O 3.54Å; V382-E386 VanDerWaalsContact CA-O 3.26Å; V382-E386 WeakPolarHBondContact CA-O 3.38Å; V382-E386 WeakPolarHBondContact CG1-O 3.37Å; V382-Q387 HydrophobicContact CG2-CB 4.03Å; V382-Q387 HydrophobicContact CG2-CG 3.73Å
383	V	97.9	Very high	92	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	130.4	169.4	-170.4	0	0	0	0	108.4	V333 F367 T368 F369 L380 G385 E386 W396 I422	V333-V383 HydrophobicContact CB-CG1 4.34Å; V333-V383 HydrophobicContact CG1-CB 4.25Å; V333-V383 HydrophobicContact CG1-CG1 3.63Å; V333-V383 HydrophobicContact CG2-CG1 3.7Å; F367-V383 HydrophobicContact CE2-CG1 4.17Å; T368-V383 CarbonylContact O-C 3.44Å; T368-V383 WeakPolarHBondContact O-CA 3.02Å; F369-V383 HydrophobicContact CB-CG2 4.47Å; L380-V383 HydrophobicContact CD1-CG2 4Å; L380-V383 HydrophobicContact CD2-CG2 3.67Å; L380-V383 HydrophobicContact CG-CG2 3.8Å; V383-G385 PolarHBondContact O-N 3.24Å; V383-E386 PolarHBondContact N-O 3.21Å; V383-E386 PolarHBondContact O-N 3Å; V383-W396 HydrophobicContact CB-CD2 4.31Å; V383-W396 HydrophobicContact CB-CE3 4.5Å; V383-W396 HydrophobicContact CB-CH2 3.78Å; V383-W396 HydrophobicContact CB-CZ2 3.59Å; V383-W396 HydrophobicContact CB-CZ3 4.23Å; V383-W396 HydrophobicContact CG2-CD2 3.79Å; V383-W396 HydrophobicContact CG2-CE3 4.25Å; V383-W396 HydrophobicContact CG2-CG 4.16Å; V383-W396 HydrophobicContact CG2-CH2 4.34Å; V383-W396 HydrophobicContact CG2-CZ2 3.93Å; V383-W396 HydrophobicContact CG2-CZ3 4.47Å; V383-I422 HydrophobicContact CG2-CG2 4.08Å
384	N	96.9	Very high	92.1	Very high	49 Å²	49	53 Å²	53	26%	0.262	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	38.4	-177.7	-65.7	-9.8	0	0	0	113.5	Y343 G366 F367 T368 E386	Y343-N384 PolarHBondContact OH-ND2 3.18Å; G366-N384 PolarHBondContact O-OD1 3.12Å; F367-N384 WeakPolarHBondContact CA-OD1 3.45Å; T368-N384 PolarHBondContact N-OD1 3.3Å; T368-N384 PolarHBondContact O-N 3.24Å; N384-E386 PolarHBondContact O-N 3.17Å
385	G	95.4	Very high	92.3	Very high	63 Å²	63	52.6 Å²	52.6	65%	0.649	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	-9	-179.2	0	0	0	0	0	115.4	V383	V383-G385 PolarHBondContact O-N 3.24Å
386	E	96.4	Very high	92.5	Very high	42 Å²	42	51.3 Å²	51.3	20%	0.196	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	134	172	-172.8	174.5	178.6	0	0	110.1	T335 A336 V382 V383 N384 R394 W396 N424	T335-E386 VanDerWaalsContact CA-OE2 3.3Å; T335-E386 WeakPolarHBondContact CA-OE2 3.29Å; T335-E386 WeakPolarHBondContact CB-OE2 3.26Å; T335-E386 WeakPolarHBondContact CG2-OE2 3.46Å; A336-E386 WeakPolarHBondContact CB-OE1 3.48Å; A336-E386 PolarHBondContact N-OE1 2.83Å; A336-E386 PolarHBondContact N-OE2 3.44Å; V382-E386 CarbonylContact C-O 3.54Å; V382-E386 VanDerWaalsContact CA-O 3.26Å; V382-E386 WeakPolarHBondContact CA-O 3.38Å; V382-E386 WeakPolarHBondContact CG1-O 3.37Å; V383-E386 PolarHBondContact N-O 3.21Å; V383-E386 PolarHBondContact O-N 3Å; N384-E386 PolarHBondContact O-N 3.17Å; E386-R394 IonicContact OE1-NH1 3.97Å; E386-R394 PolarHBondContact OE1-NH1 3.11Å; E386-W396 HydrophobicContact CB-CH2 4.31Å; E386-W396 HydrophobicContact CB-CZ2 4.1Å; E386-W396 HydrophobicContact CG-CZ2 4.41Å; E386-W396 WeakPolarHBondContact O-CZ2 3.37Å; E386-N424 VanDerWaalsContact CD-ND2 3.32Å; E386-N424 PolarHBondContact OE1-ND2 2.98Å
387	Q	95.6	Very high	92.5	Very high	53 Å²	53	49.2 Å²	49.2	25%	0.248	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.1	178.1	-165.3	163.9	15.8	0	0	112	V382 R389 R394	V382-Q387 HydrophobicContact CG2-CB 4.03Å; V382-Q387 HydrophobicContact CG2-CG 3.73Å; Q387-R389 VanDerWaalsContact CD-NH2 3.3Å; Q387-R389 HydrophobicContact CG-CG 3.76Å; Q387-R394 PolarHBondContact O-NH2 2.9Å
388	A	92.3	Very high	92.7	Very high	2 Å²	2	49.1 Å²	49.1	2%	0.017	25%	0.248	C	C	.	.			trans	-115.2	121	170.5	0	0	0	0	0	108.7	S381 R394 W396	S381-A388 PolarHBondContact O-N 3.26Å; A388-R394 CarbonylContact C-O 3.54Å; A388-R394 HydrophobicContact CB-CB 4.2Å; A388-W396 HydrophobicContact CB-CD2 4.45Å; A388-W396 HydrophobicContact CB-CG 4.18Å
389	R	84	Confident	92.9	Very high	126 Å²	126	47.9 Å²	47.9	48%	0.475	24%	0.24	S	C	.	.			trans	-129.2	147	-178.9	-56.1	-173.6	-179.8	173.4	2.8	110.6	Q387 S391 D392 R393 R394	Q387-R389 VanDerWaalsContact CD-NH2 3.3Å; Q387-R389 HydrophobicContact CG-CG 3.76Å; R389-S391 PolarHBondContact O-N 2.83Å; R389-D392 PolarHBondContact O-N 2.83Å; R389-R393 PolarHBondContact O-N 3.07Å; R389-R394 CarbonylContact C-O 3.57Å; R389-R394 PolarHBondContact N-O 3.25Å; R389-R394 PolarHBondContact O-N 3.41Å; R389-R394 VanDerWaalsContact O-N 3.11Å; R389-R394 VanDerWaalsContact O-O 3.05Å
390	Q	81.1	Confident	93.1	Very high	68 Å²	68	44 Å²	44	32%	0.318	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-57.9	-34.2	174.6	179.5	171	9.4	0	0	113	T146 D392 R393	T146-Q390 PolarHBondContact O-NE2 2.83Å; Q390-D392 PolarHBondContact O-N 2.84Å; Q390-R393 PolarHBondContact O-N 3.49Å
391	S	80	Confident	93.1	Very high	75 Å²	75	48.3 Å²	48.3	52%	0.524	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-54.7	-39.7	175.8	55	0	0	0	0	112.2	R389 R393	R389-S391 PolarHBondContact O-N 2.83Å; S391-R393 VanDerWaalsContact C-N 3.29Å; S391-R393 PolarHBondContact O-N 2.79Å
392	D	84.6	Confident	93.1	Very high	82 Å²	82	51.5 Å²	51.5	44%	0.439	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-90.1	3	-175.7	-56.7	3.6	0	0	0	111.9	R389 Q390 R394	R389-D392 PolarHBondContact O-N 2.83Å; Q390-D392 PolarHBondContact O-N 2.84Å; D392-R394 HydrophobicContact CB-CB 4.45Å; D392-R394 HydrophobicContact CB-CG 4.42Å; D392-R394 PolarHBondContact O-N 3Å; D392-R394 IonicContact OD2-CZ 3.88Å; D392-R394 IonicContact OD2-NE 3.21Å; D392-R394 IonicContact OD2-NH2 3.15Å; D392-R394 PolarHBondContact OD2-NH2 3.32Å
393	R	87.5	Confident	93	Very high	103 Å²	103	56 Å²	56	39%	0.389	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	37.1	-169.8	-56.4	177.2	67.7	-178.8	-1.2	112.2	R143 R389 Q390 S391 S426 Y427	R143-R393 VanDerWaalsContact NH1-CG 3.26Å; R389-R393 PolarHBondContact O-N 3.07Å; Q390-R393 PolarHBondContact O-N 3.49Å; S391-R393 VanDerWaalsContact C-N 3.29Å; S391-R393 PolarHBondContact O-N 2.79Å; R393-S426 WeakPolarHBondContact O-CA 3.07Å; R393-S426 VanDerWaalsContact O-CB 3.26Å; R393-S426 WeakPolarHBondContact O-CB 3.27Å; R393-Y427 PolarHBondContact NE-O 2.8Å; R393-Y427 PolarHBondContact NH2-O 3.12Å; R393-Y427 PolarHBondContact NH2-OXT 3.05Å; R393-Y427 WeakPolarHBondContact O-CD1 3.05Å; R393-Y427 PolarHBondContact O-N 2.96Å
394	R	92.5	Very high	92.8	Very high	68 Å²	68	58.5 Å²	58.5	26%	0.257	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.3	178.2	-71.8	-173.1	-63.9	154.3	2.3	111.1	E386 Q387 A388 R389 D392 T425	E386-R394 IonicContact OE1-NH1 3.97Å; E386-R394 PolarHBondContact OE1-NH1 3.11Å; Q387-R394 PolarHBondContact O-NH2 2.9Å; A388-R394 CarbonylContact C-O 3.54Å; A388-R394 HydrophobicContact CB-CB 4.2Å; R389-R394 CarbonylContact C-O 3.57Å; R389-R394 PolarHBondContact N-O 3.25Å; R389-R394 PolarHBondContact O-N 3.41Å; R389-R394 VanDerWaalsContact O-N 3.11Å; R389-R394 VanDerWaalsContact O-O 3.05Å; D392-R394 HydrophobicContact CB-CB 4.45Å; D392-R394 HydrophobicContact CB-CG 4.42Å; D392-R394 PolarHBondContact O-N 3Å; D392-R394 IonicContact OD2-CZ 3.88Å; D392-R394 IonicContact OD2-NE 3.21Å; D392-R394 IonicContact OD2-NH2 3.15Å; D392-R394 PolarHBondContact OD2-NH2 3.32Å; R394-T425 VanDerWaalsContact CA-O 3.29Å; R394-T425 WeakPolarHBondContact CA-O 3.33Å
395	Y	94.6	Very high	92.8	Very high	48 Å²	48	57.7 Å²	57.7	19%	0.188	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	163.4	173.4	72.8	-73.6	0	0	0	110.5	H184 H397 N424 T425 Y427	H184-Y395 AromaticContact CD2-CZ 3.98Å; H184-Y395 AromaticContact CE1-CD1 3.95Å; H184-Y395 AromaticContact CE1-CE1 3.68Å; H184-Y395 AromaticContact NE2-CD1 3.7Å; H184-Y395 AromaticContact NE2-CE1 3.02Å; H184-Y395 WeakPolarHBondContact NE2-CE1 3.42Å; H184-Y395 AromaticContact NE2-CE2 3.81Å; H184-Y395 AromaticContact NE2-CZ 3.1Å; H184-Y395 PolarHBondContact NE2-OH 3.36Å; Y395-H397 HydrophobicContact CD2-CB 4.35Å; Y395-H397 HydrophobicContact CE2-CB 3.62Å; Y395-H397 AromaticContact CE2-ND1 3.91Å; Y395-H397 PolarHBondContact O-N 3.41Å; Y395-H397 PolarHBondContact OH-ND1 3.43Å; Y395-N424 WeakPolarHBondContact O-CA 3.49Å; Y395-T425 HydrophobicContact CD1-CG2 3.87Å; Y395-T425 HydrophobicContact CE1-CG2 3.23Å; Y395-T425 HydrophobicContact CE2-CG2 4.08Å; Y395-T425 PolarHBondContact N-O 3.29Å; Y395-T425 PolarHBondContact O-N 3.44Å; Y395-Y427 AromaticContact CD1-CD1 3.39Å; Y395-Y427 HydrophobicContact CD1-CD1 3.39Å; Y395-Y427 AromaticContact CD1-CE1 3.69Å; Y395-Y427 HydrophobicContact CD1-CE1 3.69Å; Y395-Y427 HydrophobicContact CD1-CG 4.47Å; Y395-Y427 AromaticContact CE1-CD1 3.62Å; Y395-Y427 HydrophobicContact CE1-CD1 3.62Å; Y395-Y427 HydrophobicContact CE1-CE1 4.33Å; Y395-Y427 HydrophobicContact CE1-CG 4.34Å; Y395-Y427 HydrophobicContact CG-CE1 4.49Å
396	W	96.9	Very high	92.8	Very high	12 Å²	12	58.4 Å²	58.4	5%	0.045	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	101.3	171.5	-68	107.8	0	0	0	109.9	V333 L380 S381 V383 E386 A388 I422 N424	V333-W396 HydrophobicContact CG1-CH2 4.17Å; V333-W396 HydrophobicContact CG1-CZ3 3.98Å; L380-W396 HydrophobicContact CD2-CB 3.96Å; L380-W396 HydrophobicContact CD2-CG 4.2Å; L380-W396 HydrophobicContact CG-CB 4.35Å; L380-W396 HydrophobicContact CG-CG 4.32Å; S381-W396 PolarHBondContact O-NE1 2.9Å; S381-W396 VanDerWaalsContact O-NE1 3.14Å; V383-W396 HydrophobicContact CB-CD2 4.31Å; V383-W396 HydrophobicContact CB-CE3 4.5Å; V383-W396 HydrophobicContact CB-CH2 3.78Å; V383-W396 HydrophobicContact CB-CZ2 3.59Å; V383-W396 HydrophobicContact CB-CZ3 4.23Å; V383-W396 HydrophobicContact CG2-CD2 3.79Å; V383-W396 HydrophobicContact CG2-CE3 4.25Å; V383-W396 HydrophobicContact CG2-CG 4.16Å; V383-W396 HydrophobicContact CG2-CH2 4.34Å; V383-W396 HydrophobicContact CG2-CZ2 3.93Å; V383-W396 HydrophobicContact CG2-CZ3 4.47Å; E386-W396 HydrophobicContact CB-CH2 4.31Å; E386-W396 HydrophobicContact CB-CZ2 4.1Å; E386-W396 HydrophobicContact CG-CZ2 4.41Å; E386-W396 WeakPolarHBondContact O-CZ2 3.37Å; A388-W396 HydrophobicContact CB-CD2 4.45Å; A388-W396 HydrophobicContact CB-CG 4.18Å; W396-I422 HydrophobicContact CB-CG2 4.11Å; W396-I422 HydrophobicContact CD2-CG2 4.06Å; W396-I422 HydrophobicContact CE3-CG2 3.55Å; W396-I422 HydrophobicContact CG-CG2 4.32Å; W396-I422 HydrophobicContact CZ3-CG2 4.23Å; W396-N424 HydrophobicContact CD2-CB 4.35Å; W396-N424 HydrophobicContact CE3-CB 3.81Å; W396-N424 VanDerWaalsContact CE3-N 3.29Å; W396-N424 HydrophobicContact CH2-CB 3.75Å; W396-N424 HydrophobicContact CZ2-CB 4.23Å; W396-N424 HydrophobicContact CZ3-CB 3.53Å
397	H	96.1	Very high	92.8	Very high	58 Å²	58	58.7 Å²	58.7	27%	0.269	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	131.3	171.9	-177.2	84.3	0	0	0	110.1	Y395 I422 K423 T425	Y395-H397 HydrophobicContact CD2-CB 4.35Å; Y395-H397 HydrophobicContact CE2-CB 3.62Å; Y395-H397 AromaticContact CE2-ND1 3.91Å; Y395-H397 PolarHBondContact O-N 3.41Å; Y395-H397 PolarHBondContact OH-ND1 3.43Å; H397-I422 WeakPolarHBondContact O-CA 3.38Å; H397-K423 PolarHBondContact N-O 3.12Å; H397-K423 PolarHBondContact O-N 2.96Å; H397-T425 HydrophobicContact CB-CG2 3.71Å
398	L	97.8	Very high	92.8	Very high	24 Å²	24	57.8 Å²	57.8	13%	0.126	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.8	-177.5	-52	175.4	0	0	0	109.8	L353 L380 L405 V409 T421 I422	L353-L398 HydrophobicContact CD2-CD1 4.41Å; L380-L398 HydrophobicContact CD2-CD2 4.09Å; L398-L405 HydrophobicContact CB-CB 4.24Å; L398-L405 HydrophobicContact CB-CD1 3.71Å; L398-L405 HydrophobicContact CB-CG 3.99Å; L398-L405 HydrophobicContact CD1-CD1 4.45Å; L398-L405 PolarHBondContact O-N 2.99Å; L398-V409 HydrophobicContact CD1-CG1 3.6Å; L398-T421 WeakPolarHBondContact CA-O 3.47Å; L398-I422 HydrophobicContact CD2-CB 4.26Å; L398-I422 HydrophobicContact CD2-CD1 4.46Å; L398-I422 HydrophobicContact CD2-CG1 3.85Å; L398-I422 HydrophobicContact CD2-CG2 3.94Å
399	S	97.7	Very high	93.1	Very high	12 Å²	12	57.9 Å²	57.9	8%	0.084	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152	172.2	61.2	0	0	0	0	111.7	T403 I420 T421	S399-T403 CarbonylContact C-O 3.56Å; S399-T403 WeakPolarHBondContact CA-O 3.34Å; S399-T403 WeakPolarHBondContact CB-O 3.16Å; S399-I420 CarbonylContact O-C 3.56Å; S399-I420 VanDerWaalsContact O-CA 3.29Å; S399-I420 WeakPolarHBondContact O-CA 3.38Å; S399-T421 PolarHBondContact N-O 3.06Å; S399-T421 PolarHBondContact O-N 3.43Å
400	S	97.9	Very high	93.6	Very high	15 Å²	15	52.9 Å²	52.9	11%	0.105	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124	170.1	-171.6	0	0	0	0	109	G402 T403 K419	S400-G402 PolarHBondContact O-N 2.77Å; S400-G402 VanDerWaalsContact O-N 3.12Å; S400-T403 PolarHBondContact N-O 2.81Å; S400-T403 PolarHBondContact O-N 2.81Å; S400-K419 CarbonylContact C-O 3.54Å; S400-K419 WeakPolarHBondContact CA-O 3.39Å
401	D	96.8	Very high	94.3	Very high	102 Å²	102	51 Å²	51	55%	0.545	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	40.1	-178.9	-57.8	-45.9	0	0	0	112.9	T403 Q418 K419	D401-T403 VanDerWaalsContact C-N 3.31Å; D401-T403 PolarHBondContact O-N 3.06Å; D401-Q418 WeakPolarHBondContact OD2-CB 3.25Å; D401-K419 PolarHBondContact N-O 3.44Å; D401-K419 PolarHBondContact OD1-N 3.24Å
402	G	94.9	Very high	95.1	Very high	69 Å²	69	48.9 Å²	48.9	71%	0.711	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-5.9	-179.8	0	0	0	0	0	115.4	S400	S400-G402 PolarHBondContact O-N 2.77Å; S400-G402 VanDerWaalsContact O-N 3.12Å
403	T	95.7	Very high	95.7	Very high	104 Å²	104	49.1 Å²	49.1	64%	0.638	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.9	177.1	-55.7	0	0	0	0	110.4	S399 S400 D401 L405	S399-T403 CarbonylContact C-O 3.56Å; S399-T403 WeakPolarHBondContact CA-O 3.34Å; S399-T403 WeakPolarHBondContact CB-O 3.16Å; S400-T403 PolarHBondContact N-O 2.81Å; S400-T403 PolarHBondContact O-N 2.81Å; D401-T403 VanDerWaalsContact C-N 3.31Å; D401-T403 PolarHBondContact O-N 3.06Å; T403-L405 PolarHBondContact O-N 2.87Å
404	A	95.1	Very high	96.1	Very high	53 Å²	53	44.2 Å²	44.2	44%	0.438	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	136.1	177.9	0	0	0	0	0	111.2
405	L	96.4	Very high	96.2	Very high	32 Å²	32	45.3 Å²	45.3	17%	0.168	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-72.5	143	175.5	-59.8	-170.2	0	0	0	110.4	L353 L398 T403 F412	L353-L405 HydrophobicContact CD2-CD1 4Å; L398-L405 HydrophobicContact CB-CB 4.24Å; L398-L405 HydrophobicContact CB-CD1 3.71Å; L398-L405 HydrophobicContact CB-CG 3.99Å; L398-L405 HydrophobicContact CD1-CD1 4.45Å; L398-L405 PolarHBondContact O-N 2.99Å; T403-L405 PolarHBondContact O-N 2.87Å; L405-F412 HydrophobicContact CD1-CB 4.32Å; L405-F412 HydrophobicContact CD1-CD1 3.91Å; L405-F412 HydrophobicContact CD1-CD2 4.27Å; L405-F412 HydrophobicContact CD1-CE1 4.25Å; L405-F412 HydrophobicContact CD1-CG 3.9Å; L405-F412 HydrophobicContact CD2-CD1 4.36Å; L405-F412 HydrophobicContact CD2-CD2 3.88Å; L405-F412 HydrophobicContact CD2-CE1 4.03Å; L405-F412 HydrophobicContact CD2-CE2 3.53Å; L405-F412 HydrophobicContact CD2-CG 4.28Å; L405-F412 HydrophobicContact CD2-CZ 3.6Å
406	T	94.8	Very high	96.3	Very high	79 Å²	79	45.6 Å²	45.6	49%	0.485	29%	0.287	S	S	.	.	S	Bend	trans	-95.2	-4.1	171.8	51.7	0	0	0	0	112.6	F241	F241-T406 WeakPolarHBondContact CD2-O 3.37Å; F241-T406 WeakPolarHBondContact CE2-O 3.05Å
407	E	96.6	Very high	96.3	Very high	47 Å²	47	49.8 Å²	49.8	22%	0.22	31%	0.314	C	S	.	.	S	Bend	trans	-128.4	155.4	-176.2	-65.6	179.8	126.6	0	0	111.4	F241 H277 D411 F412	F241-E407 HydrophobicContact CE2-CG 3.82Å; F241-E407 HydrophobicContact CZ-CG 3.64Å; H277-E407 IonicContact CD2-OE1 3.83Å; H277-E407 IonicContact CE1-OE1 3.48Å; H277-E407 IonicContact NE2-OE1 3.8Å; H277-E407 PolarHBondContact NE2-OE1 3.31Å; H277-E407 VanDerWaalsContact NE2-OE1 3.15Å; E407-D411 HydrophobicContact CB-CB 4.11Å; E407-F412 HydrophobicContact CB-CB 4.1Å
408	G	96.3	Very high	96.3	Very high	34 Å²	34	48.3 Å²	48.3	35%	0.351	31%	0.307	S	S	.	.			trans	-77.5	173.6	177.2	0	0	0	0	0	113.3	G410 D411 F412	G408-G410 VanDerWaalsContact C-N 3.27Å; G408-G410 PolarHBondContact O-N 2.85Å; G408-D411 PolarHBondContact O-N 3.38Å; G408-D411 VanDerWaalsContact O-N 3.09Å; G408-F412 PolarHBondContact O-N 2.81Å
409	V	97.1	Very high	96.4	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.024	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.4	-177.1	-62	0	0	0	0	113.3	L353 L354 L357 P378 L380 L398 D411	L353-V409 CarbonylContact C-O 3.57Å; L353-V409 HydrophobicContact CB-CB 4.43Å; L353-V409 HydrophobicContact CD2-CB 4.45Å; L353-V409 HydrophobicContact CD2-CG1 3.94Å; L353-V409 HydrophobicContact CG-CB 4.31Å; L353-V409 HydrophobicContact CG-CG1 4.18Å; L353-V409 PolarHBondContact N-O 3.21Å; L354-V409 HydrophobicContact CB-CB 4.27Å; L354-V409 HydrophobicContact CB-CG2 4.24Å; L354-V409 WeakPolarHBondContact CB-O 3.43Å; L354-V409 HydrophobicContact CD1-CG2 4.35Å; L354-V409 PolarHBondContact N-O 3.33Å; L357-V409 HydrophobicContact CD1-CG1 4.33Å; P378-V409 HydrophobicContact CB-CG2 4.48Å; P378-V409 HydrophobicContact CG-CG2 4.24Å; P378-V409 WeakPolarHBondContact O-CG2 3.36Å; L380-V409 HydrophobicContact CD2-CG1 4.5Å; L398-V409 HydrophobicContact CD1-CG1 3.6Å; V409-D411 VanDerWaalsContact C-N 3.3Å; V409-D411 PolarHBondContact O-N 2.73Å
410	G	95.6	Very high	96.4	Very high	22 Å²	22	50 Å²	50	23%	0.227	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-22.5	179.1	0	0	0	0	0	113.8	S352 G408	S352-G410 WeakPolarHBondContact CB-O 3.23Å; G408-G410 VanDerWaalsContact C-N 3.27Å; G408-G410 PolarHBondContact O-N 2.85Å
411	D	95.9	Very high	96.4	Very high	27 Å²	27	50.2 Å²	50.2	14%	0.144	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-46.2	-168.9	-72.9	-48.9	0	0	0	112.1	H277 N278 E407 G408 V409 K413	H277-D411 VanDerWaalsContact CE1-CB 3.41Å; H277-D411 WeakPolarHBondContact CE1-CB 3.3Å; H277-D411 IonicContact CE1-OD1 3.31Å; H277-D411 PolarHBondContact CE1-OD1 2.62Å; H277-D411 IonicContact ND1-OD1 3.52Å; H277-D411 PolarHBondContact ND1-OD1 2.74Å; N278-D411 PolarHBondContact ND2-OD2 3.2Å; E407-D411 HydrophobicContact CB-CB 4.11Å; G408-D411 PolarHBondContact O-N 3.38Å; G408-D411 VanDerWaalsContact O-N 3.09Å; V409-D411 VanDerWaalsContact C-N 3.3Å; V409-D411 PolarHBondContact O-N 2.73Å; D411-K413 WeakPolarHBondContact O-CD 3.4Å; D411-K413 PolarHBondContact O-N 3.49Å
412	F	97.1	Very high	96.5	Very high	31 Å²	31	45.3 Å²	45.3	14%	0.136	29%	0.287	C	S	.	.			trans	-60.6	123	-174.8	-178.8	-103.6	0	0	0	112.5	S352 L353 L405 E407 G408 I420	S352-F412 CarbonylContact C-O 3.51Å; S352-F412 VanDerWaalsContact CA-O 3.27Å; S352-F412 WeakPolarHBondContact CA-O 3.44Å; L353-F412 HydrophobicContact CB-CD1 4.23Å; L353-F412 PolarHBondContact N-O 2.82Å; L405-F412 HydrophobicContact CD1-CB 4.32Å; L405-F412 HydrophobicContact CD1-CD1 3.91Å; L405-F412 HydrophobicContact CD1-CD2 4.27Å; L405-F412 HydrophobicContact CD1-CE1 4.25Å; L405-F412 HydrophobicContact CD1-CG 3.9Å; L405-F412 HydrophobicContact CD2-CD1 4.36Å; L405-F412 HydrophobicContact CD2-CD2 3.88Å; L405-F412 HydrophobicContact CD2-CE1 4.03Å; L405-F412 HydrophobicContact CD2-CE2 3.53Å; L405-F412 HydrophobicContact CD2-CG 4.28Å; L405-F412 HydrophobicContact CD2-CZ 3.6Å; E407-F412 HydrophobicContact CB-CB 4.1Å; G408-F412 PolarHBondContact O-N 2.81Å; F412-I420 HydrophobicContact CE1-CD1 3.93Å
413	K	96.2	Very high	96.6	Very high	88 Å²	88	46.6 Å²	46.6	38%	0.383	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.1	-176	-58.4	-51.2	-168.9	178.5	0	113.5	G350 D411	G350-K413 WeakPolarHBondContact O-CD 3.19Å; D411-K413 WeakPolarHBondContact O-CD 3.4Å; D411-K413 PolarHBondContact O-N 3.49Å
414	I	96.4	Very high	96.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	106.8	178.4	-54.3	-172.2	0	0	0	109.6	V327 V329 V347 G350 S351 L353 A356 Q418	V327-I414 HydrophobicContact CG2-CG2 3.72Å; V329-I414 HydrophobicContact CG1-CD1 4.12Å; V329-I414 HydrophobicContact CG2-CD1 3.66Å; V329-I414 HydrophobicContact CG2-CG2 3.5Å; V329-I414 VanDerWaalsContact CG2-CG2 3.5Å; V347-I414 HydrophobicContact CG2-CB 4.46Å; V347-I414 HydrophobicContact CG2-CD1 4.39Å; V347-I414 HydrophobicContact CG2-CG2 4.16Å; G350-I414 PolarHBondContact N-O 3.4Å; S351-I414 PolarHBondContact O-N 3.08Å; L353-I414 HydrophobicContact CD1-CD1 4.45Å; A356-I414 HydrophobicContact CB-CD1 3.71Å; I414-Q418 HydrophobicContact CG2-CG 4.46Å
415	N	94.6	Very high	96.6	Very high	91 Å²	91	41.2 Å²	41.2	49%	0.487	23%	0.234	S	C	.	.			trans	-108.4	-14.5	-174.8	-72.2	-52.5	0	0	0	114.5	K349	K349-N415 VanDerWaalsContact CE-O 3.29Å; K349-N415 WeakPolarHBondContact CE-O 3.26Å
416	A	96.3	Very high	96.3	Very high	53 Å²	53	43.8 Å²	43.8	44%	0.438	26%	0.255	S	S	.	.	S	Bend	trans	-148.9	172.3	-177.1	0	0	0	0	0	110.3	Q418	A416-Q418 PolarHBondContact O-N 3.26Å
417	T	96.9	Very high	95.8	Very high	101 Å²	101	43.2 Å²	43.2	62%	0.62	24%	0.244	S	C	*	.	S	Bend	trans	-64.1	124	170	-62.7	0	0	0	0	109.5	K328	K328-T417 HydrophobicContact CB-CG2 4.34Å; K328-T417 VanDerWaalsContact O-CA 3.25Å; K328-T417 WeakPolarHBondContact O-CA 3.38Å; K328-T417 WeakPolarHBondContact O-CG2 3.44Å
418	Q	97	Very high	95.8	Very high	26 Å²	26	43 Å²	43	12%	0.121	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	157.8	-175.6	63.5	-166.6	23.7	0	0	111.7	K328 M330 D401 I414 A416 I420	K328-Q418 PolarHBondContact O-N 2.97Å; M330-Q418 PolarHBondContact N-O 3.43Å; M330-Q418 VanDerWaalsContact N-O 3.12Å; D401-Q418 WeakPolarHBondContact OD2-CB 3.25Å; I414-Q418 HydrophobicContact CG2-CG 4.46Å; A416-Q418 PolarHBondContact O-N 3.26Å; Q418-I420 HydrophobicContact CG-CD1 4.22Å
419	K	98.1	Very high	95.8	Very high	71 Å²	71	43.5 Å²	43.5	31%	0.309	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.3	171.3	-177.5	-175.8	176.8	-175.6	0	109.5	M330 E332 S400 D401	M330-K419 CarbonylContact O-C 3.56Å; M330-K419 WeakPolarHBondContact O-CA 3.38Å; E332-K419 WeakPolarHBondContact OE1-CE 3.43Å; E332-K419 IonicContact OE1-NZ 2.8Å; E332-K419 PolarHBondContact OE1-NZ 3.38Å; E332-K419 WeakPolarHBondContact OE2-CE 3.45Å; E332-K419 IonicContact OE2-NZ 2.8Å; E332-K419 PolarHBondContact OE2-NZ 3.07Å; S400-K419 CarbonylContact C-O 3.54Å; S400-K419 WeakPolarHBondContact CA-O 3.39Å; D401-K419 PolarHBondContact N-O 3.44Å; D401-K419 PolarHBondContact OD1-N 3.24Å
420	I	98.5	Very high	95.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.7	168.8	-55.9	-60.2	0	0	0	108.8	V329 M330 V331 E332 L353 S399 F412 Q418 I422	V329-I420 HydrophobicContact CG1-CG1 3.98Å; M330-I420 PolarHBondContact O-N 3.31Å; V331-I420 CarbonylContact C-O 3.53Å; V331-I420 WeakPolarHBondContact CA-O 3.47Å; V331-I420 HydrophobicContact CG2-CB 4.25Å; E332-I420 PolarHBondContact N-O 3.21Å; L353-I420 HydrophobicContact CD1-CB 4.44Å; L353-I420 HydrophobicContact CD1-CG1 4.05Å; L353-I420 HydrophobicContact CD1-CG2 3.98Å; L353-I420 HydrophobicContact CD2-CG2 4.04Å; S399-I420 CarbonylContact O-C 3.56Å; S399-I420 VanDerWaalsContact O-CA 3.29Å; S399-I420 WeakPolarHBondContact O-CA 3.38Å; F412-I420 HydrophobicContact CE1-CD1 3.93Å; Q418-I420 HydrophobicContact CG-CD1 4.22Å; I420-I422 HydrophobicContact CG2-CG1 4.09Å
421	T	98.6	Very high	95.7	Very high	20 Å²	20	47.1 Å²	47.1	12%	0.123	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.2	170.3	-64.4	0	0	0	0	109.2	E332 V334 L398 S399 K423	E332-T421 CarbonylContact O-C 3.54Å; E332-T421 WeakPolarHBondContact O-CA 3.09Å; E332-T421 PolarHBondContact OE2-OG1 2.92Å; E332-T421 VanDerWaalsContact OE2-OG1 3.06Å; V334-T421 HydrophobicContact CG2-CG2 4.05Å; L398-T421 WeakPolarHBondContact CA-O 3.47Å; S399-T421 PolarHBondContact N-O 3.06Å; S399-T421 PolarHBondContact O-N 3.43Å; T421-K423 HydrophobicContact CG2-CB 4.28Å
422	I	98.4	Very high	95.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	100.7	176.1	-55	-178.9	0	0	0	107	V331 E332 V333 V334 L357 L380 V383 W396 H397 L398 I420	V331-I422 HydrophobicContact CG1-CD1 3.65Å; V331-I422 HydrophobicContact CG1-CG1 4.09Å; E332-I422 PolarHBondContact O-N 2.87Å; V333-I422 CarbonylContact C-O 3.5Å; V333-I422 WeakPolarHBondContact CA-O 3.35Å; V334-I422 PolarHBondContact N-O 2.87Å; L357-I422 HydrophobicContact CD1-CD1 4.18Å; L357-I422 HydrophobicContact CD2-CD1 3.9Å; L380-I422 HydrophobicContact CD2-CD1 4.33Å; L380-I422 HydrophobicContact CD2-CG2 3.73Å; V383-I422 HydrophobicContact CG2-CG2 4.08Å; W396-I422 HydrophobicContact CB-CG2 4.11Å; W396-I422 HydrophobicContact CD2-CG2 4.06Å; W396-I422 HydrophobicContact CE3-CG2 3.55Å; W396-I422 HydrophobicContact CG-CG2 4.32Å; W396-I422 HydrophobicContact CZ3-CG2 4.23Å; H397-I422 WeakPolarHBondContact O-CA 3.38Å; L398-I422 HydrophobicContact CD2-CB 4.26Å; L398-I422 HydrophobicContact CD2-CD1 4.46Å; L398-I422 HydrophobicContact CD2-CG1 3.85Å; L398-I422 HydrophobicContact CD2-CG2 3.94Å; I420-I422 HydrophobicContact CG2-CG1 4.09Å
423	K	97.7	Very high	95.6	Very high	96 Å²	96	49.5 Å²	49.5	42%	0.417	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.7	-171	-179.5	174.5	-178.6	-176.8	0	111.4	V334 H397 T421 T425	V334-K423 HydrophobicContact CB-CB 4.12Å; V334-K423 HydrophobicContact CB-CG 3.98Å; V334-K423 HydrophobicContact CG1-CD 4.46Å; V334-K423 HydrophobicContact CG1-CG 4.11Å; V334-K423 CarbonylContact O-C 3.5Å; V334-K423 WeakPolarHBondContact O-CA 3.08Å; H397-K423 PolarHBondContact N-O 3.12Å; H397-K423 PolarHBondContact O-N 2.96Å; T421-K423 HydrophobicContact CG2-CB 4.28Å; K423-T425 PolarHBondContact O-N 3.21Å
424	N	96.7	Very high	95.6	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.027	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	111.4	169.7	-163.5	-36.8	0	0	0	108.3	V334 A336 E386 Y395 W396	V334-N424 PolarHBondContact O-N 2.8Å; A336-N424 HydrophobicContact CB-CB 4.32Å; E386-N424 VanDerWaalsContact CD-ND2 3.32Å; E386-N424 PolarHBondContact OE1-ND2 2.98Å; Y395-N424 WeakPolarHBondContact O-CA 3.49Å; W396-N424 HydrophobicContact CD2-CB 4.35Å; W396-N424 HydrophobicContact CE3-CB 3.81Å; W396-N424 VanDerWaalsContact CE3-N 3.29Å; W396-N424 HydrophobicContact CH2-CB 3.75Å; W396-N424 HydrophobicContact CZ2-CB 4.23Å; W396-N424 HydrophobicContact CZ3-CB 3.53Å
425	T	93.4	Very high	95.5	Very high	39 Å²	39	50.3 Å²	50.3	24%	0.239	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	157.6	-177.7	-165.5	0	0	0	0	110.9	R394 Y395 H397 K423	R394-T425 VanDerWaalsContact CA-O 3.29Å; R394-T425 WeakPolarHBondContact CA-O 3.33Å; Y395-T425 HydrophobicContact CD1-CG2 3.87Å; Y395-T425 HydrophobicContact CE1-CG2 3.23Å; Y395-T425 HydrophobicContact CE2-CG2 4.08Å; Y395-T425 PolarHBondContact N-O 3.29Å; Y395-T425 PolarHBondContact O-N 3.44Å; H397-T425 HydrophobicContact CB-CG2 3.71Å; K423-T425 PolarHBondContact O-N 3.21Å
426	S	90.8	Very high	95.6	Very high	86 Å²	86	46.9 Å²	46.9	60%	0.601	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	162.3	172.3	64.2	0	0	0	0	112.5	R393	R393-S426 WeakPolarHBondContact O-CA 3.07Å; R393-S426 VanDerWaalsContact O-CB 3.26Å; R393-S426 WeakPolarHBondContact O-CB 3.27Å
427	Y	84.6	Confident	95.5	Very high	66 Å²	66	46.4 Å²	46.4	26%	0.259	25%	0.247	S	C	.	.			trans	-146.4	0	-179.2	61.5	-87.2	0	0	0	111.2	H184 G185 R393 Y395	H184-Y427 AromaticContact CE1-CD1 3.29Å; H184-Y427 WeakPolarHBondContact CE1-CD1 3.48Å; H184-Y427 AromaticContact CE1-CD2 3.52Å; H184-Y427 AromaticContact CE1-CE1 3.55Å; H184-Y427 AromaticContact CE1-CE2 3.78Å; H184-Y427 AromaticContact CE1-CG 3.23Å; H184-Y427 AromaticContact CE1-CZ 3.77Å; H184-Y427 AromaticContact ND1-CD1 3.95Å; H184-Y427 AromaticContact ND1-CD2 3.28Å; H184-Y427 VanDerWaalsContact ND1-CD2 3.28Å; H184-Y427 WeakPolarHBondContact ND1-CD2 3.33Å; H184-Y427 AromaticContact ND1-CE2 3.64Å; H184-Y427 AromaticContact ND1-CG 3.43Å; H184-Y427 AromaticContact NE2-CD1 3.89Å; H184-Y427 AromaticContact NE2-CG 3.87Å; G185-Y427 PolarHBondContact N-OXT 3.45Å; R393-Y427 PolarHBondContact NE-O 2.8Å; R393-Y427 PolarHBondContact NH2-O 3.12Å; R393-Y427 PolarHBondContact NH2-OXT 3.05Å; R393-Y427 WeakPolarHBondContact O-CD1 3.05Å; R393-Y427 PolarHBondContact O-N 2.96Å; Y395-Y427 AromaticContact CD1-CD1 3.39Å; Y395-Y427 HydrophobicContact CD1-CD1 3.39Å; Y395-Y427 AromaticContact CD1-CE1 3.69Å; Y395-Y427 HydrophobicContact CD1-CE1 3.69Å; Y395-Y427 HydrophobicContact CD1-CG 4.47Å; Y395-Y427 AromaticContact CE1-CD1 3.62Å; Y395-Y427 HydrophobicContact CE1-CD1 3.62Å; Y395-Y427 HydrophobicContact CE1-CE1 4.33Å; Y395-Y427 HydrophobicContact CE1-CG 4.34Å; Y395-Y427 HydrophobicContact CG-CE1 4.49Å

Retrieved 427 of 427 residues in 685.4 ms (Link to these results)

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