G4LX16_SCHMA Loading...

Serine/threonine-protein kinase 19, putative AlphaSync

AlphaFold DB , UniProt , Accession G4LX16, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 251 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	53.6	Low	65.7	Low	203 Å²	203	132.3 Å²	132.3	100%	1	66%	0.657	S	S	*	*				0	-35.5	0	-153.9	166.2	55.6	0	0	113.5
2	F	53.2	Low	65	Low	187 Å²	187	129.8 Å²	129.8	82%	0.82	65%	0.647	S	S	*	*	H	α-helix	trans	-70.5	-27.7	176.9	-94.1	-92.4	0	0	0	115.3	V6	F2-V6 WeakPolarHBondContact O-CG2 3.39Å
3	T	63.5	Low	64.4	Low	107 Å²	107	129.2 Å²	129.2	66%	0.656	64%	0.644	S	S	*	*	H	α-helix	trans	-72.2	-34	-177.3	20.9	0	0	0	0	114.1	L7	T3-L7 PolarHBondContact O-N 3.2Å
4	E	68	Low	63.5	Low	152 Å²	152	129.1 Å²	129.1	71%	0.71	64%	0.637	S	S	*	*	H	α-helix	trans	-72.1	-36.7	-180	-68.9	-167.6	159.2	0	0	112.4	V6 L7 L8	E4-V6 PolarHBondContact O-N 3.39Å; E4-L7 PolarHBondContact O-N 3.24Å; E4-L8 WeakPolarHBondContact O-CB 3.19Å; E4-L8 PolarHBondContact O-N 2.88Å
5	L	66.7	Low	62.2	Low	121 Å²	121	131.7 Å²	131.7	63%	0.634	64%	0.637	S	S	*	*	H	α-helix	trans	-65.6	-38.7	179.4	-151.8	84.4	0	0	0	111.7	L8 V9	L5-L8 PolarHBondContact O-N 3.18Å; L5-V9 VanDerWaalsContact O-CG2 3.3Å; L5-V9 WeakPolarHBondContact O-CG2 3.39Å; L5-V9 PolarHBondContact O-N 2.86Å
6	V	73	Confident	60.9	Low	101 Å²	101	134.8 Å²	134.8	61%	0.612	65%	0.646	S	S	*	*	H	α-helix	trans	-68	-41.2	178.2	176.7	0	0	0	0	111.3	F2 E4 V9 W10	F2-V6 WeakPolarHBondContact O-CG2 3.39Å; E4-V6 PolarHBondContact O-N 3.39Å; V6-V9 PolarHBondContact O-N 3.13Å; V6-W10 WeakPolarHBondContact O-CB 3.48Å; V6-W10 PolarHBondContact O-N 3.24Å
7	L	66.1	Low	59.7	Low	109 Å²	109	134.9 Å²	134.9	57%	0.571	65%	0.65	S	S	*	*	H	α-helix	trans	-65.4	-39.6	175.5	-78.7	166.2	0	0	0	111.8	T3 E4 W10 F11	T3-L7 PolarHBondContact O-N 3.2Å; E4-L7 PolarHBondContact O-N 3.24Å; L7-W10 PolarHBondContact O-N 3.49Å; L7-F11 VanDerWaalsContact O-CB 3.28Å; L7-F11 WeakPolarHBondContact O-CB 3.42Å; L7-F11 PolarHBondContact O-N 3.05Å
8	L	71.1	Confident	58.6	Low	110 Å²	110	131.6 Å²	131.6	58%	0.576	64%	0.643	S	S	*	*	H	α-helix	trans	-66.3	-42	178.3	-147.8	98.4	0	0	0	111.7	E4 L5 F11 L12	E4-L8 WeakPolarHBondContact O-CB 3.19Å; E4-L8 PolarHBondContact O-N 2.88Å; L5-L8 PolarHBondContact O-N 3.18Å; L8-F11 PolarHBondContact O-N 2.97Å; L8-L12 HydrophobicContact CD2-CD1 3.9Å; L8-L12 HydrophobicContact CG-CD1 4.25Å; L8-L12 VanDerWaalsContact O-CB 3.28Å; L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 WeakPolarHBondContact O-CG 3.29Å; L8-L12 PolarHBondContact O-N 3.15Å
9	V	72.5	Confident	57.3	Low	82 Å²	82	131.6 Å²	131.6	50%	0.497	65%	0.647	S	S	.	*	H	α-helix	trans	-65.3	-42.2	176.1	172.2	0	0	0	0	111	L5 V6 L12 M13	L5-V9 VanDerWaalsContact O-CG2 3.3Å; L5-V9 WeakPolarHBondContact O-CG2 3.39Å; L5-V9 PolarHBondContact O-N 2.86Å; V6-V9 PolarHBondContact O-N 3.13Å; V9-L12 PolarHBondContact O-N 3.49Å; V9-M13 WeakPolarHBondContact O-CB 3.43Å; V9-M13 PolarHBondContact O-N 3.33Å
10	W	68.6	Low	56.2	Low	153 Å²	153	135.3 Å²	135.3	58%	0.58	65%	0.653	S	S	*	*	H	α-helix	trans	-65.1	-40	176.3	-171.1	63.2	0	0	0	112.3	V6 L7 M13 K14	V6-W10 WeakPolarHBondContact O-CB 3.48Å; V6-W10 PolarHBondContact O-N 3.24Å; L7-W10 PolarHBondContact O-N 3.49Å; W10-M13 PolarHBondContact O-N 2.8Å; W10-K14 PolarHBondContact O-N 3.17Å
11	F	66.1	Low	55.2	Low	130 Å²	130	135.2 Å²	135.2	57%	0.57	66%	0.661	S	S	*	*	H	α-helix	trans	-69.7	-41.9	177.5	-161.8	-94.8	0	0	0	112.2	L7 L8 K14 R15	L7-F11 VanDerWaalsContact O-CB 3.28Å; L7-F11 WeakPolarHBondContact O-CB 3.42Å; L7-F11 PolarHBondContact O-N 3.05Å; L8-F11 PolarHBondContact O-N 2.97Å; F11-K14 PolarHBondContact O-N 3.26Å; F11-R15 PolarHBondContact O-N 3Å
12	L	57.9	Low	54.3	Low	102 Å²	102	131 Å²	131	53%	0.534	65%	0.646	S	S	.	*	H	α-helix	trans	-64.9	-38.8	174.3	-81.6	161.5	0	0	0	112	L8 V9 R15 K16	L8-L12 HydrophobicContact CD2-CD1 3.9Å; L8-L12 HydrophobicContact CG-CD1 4.25Å; L8-L12 VanDerWaalsContact O-CB 3.28Å; L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 WeakPolarHBondContact O-CG 3.29Å; L8-L12 PolarHBondContact O-N 3.15Å; V9-L12 PolarHBondContact O-N 3.49Å; L12-R15 PolarHBondContact O-N 3Å; L12-K16 PolarHBondContact O-N 2.85Å
13	M	56.9	Low	53.1	Low	123 Å²	123	126.6 Å²	126.6	61%	0.606	64%	0.639	S	S	*	*	H	α-helix	trans	-60.9	-46.6	172	-98.3	-178.8	135.5	0	0	111.2	V9 W10 R15 K16 L17	V9-M13 WeakPolarHBondContact O-CB 3.43Å; V9-M13 PolarHBondContact O-N 3.33Å; W10-M13 PolarHBondContact O-N 2.8Å; M13-R15 VanDerWaalsContact C-N 3.33Å; M13-R15 PolarHBondContact O-N 3.07Å; M13-K16 PolarHBondContact O-N 3.39Å; M13-L17 WeakPolarHBondContact O-CB 3.33Å; M13-L17 VanDerWaalsContact O-CD1 3.31Å; M13-L17 WeakPolarHBondContact O-CD1 3.25Å; M13-L17 PolarHBondContact O-N 2.84Å
14	K	52.5	Low	51.7	Low	127 Å²	127	126.6 Å²	126.6	55%	0.552	64%	0.641	S	S	*	*	H	α-helix	trans	-62	-39	177.1	-104.1	-170.6	174.9	-178.5	0	112.9	W10 F11 L17 S18	W10-K14 PolarHBondContact O-N 3.17Å; F11-K14 PolarHBondContact O-N 3.26Å; K14-L17 PolarHBondContact O-N 3.49Å; K14-S18 PolarHBondContact O-N 3.01Å
15	R	43.2	Very low	50.2	Low	169 Å²	169	124.8 Å²	124.8	64%	0.638	64%	0.642	S	S	*	*	H	α-helix	trans	-71.8	-38	-179.8	-146.3	174.7	173.8	172	-2	112.2	F11 L12 M13 L17 S18	F11-R15 PolarHBondContact O-N 3Å; L12-R15 PolarHBondContact O-N 3Å; M13-R15 VanDerWaalsContact C-N 3.33Å; M13-R15 PolarHBondContact O-N 3.07Å; R15-L17 PolarHBondContact O-N 2.89Å; R15-S18 PolarHBondContact O-N 2.97Å; R15-S18 PolarHBondContact O-OG 3.29Å
16	K	42	Very low	48.8	Very low	181 Å²	181	128.7 Å²	128.7	79%	0.787	65%	0.654	S	S	*	*	H	α-helix	trans	-68.4	-21.7	170.9	-99.8	-176.2	175.1	179.1	0	113.7	L12 M13	L12-K16 PolarHBondContact O-N 2.85Å; M13-K16 PolarHBondContact O-N 3.39Å
17	L	39.6	Very low	47.4	Very low	136 Å²	136	127.9 Å²	127.9	71%	0.712	65%	0.649	S	S	*	*	H	α-helix	trans	-82.9	-18.8	173.8	-95.4	129	0	0	0	113.4	M13 K14 R15	M13-L17 WeakPolarHBondContact O-CB 3.33Å; M13-L17 VanDerWaalsContact O-CD1 3.31Å; M13-L17 WeakPolarHBondContact O-CD1 3.25Å; M13-L17 PolarHBondContact O-N 2.84Å; K14-L17 PolarHBondContact O-N 3.49Å; R15-L17 PolarHBondContact O-N 2.89Å
18	S	40.3	Very low	46.6	Very low	75 Å²	75	130 Å²	130	52%	0.524	66%	0.658	S	S	.	*	H	α-helix	trans	-81.5	-21.7	177.6	74.6	0	0	0	0	114.4	K14 R15	K14-S18 PolarHBondContact O-N 3.01Å; R15-S18 PolarHBondContact O-N 2.97Å; R15-S18 PolarHBondContact O-OG 3.29Å
19	D	34.3	Very low	45.9	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	67%	0.672	S	S	*	*	S	Bend	trans	-92.3	5.4	-175.1	-68.7	-9	0	0	0	114	V21	D19-V21 VanDerWaalsContact C-N 3.27Å; D19-V21 PolarHBondContact O-N 3.02Å
20	R	34.2	Very low	45.9	Very low	205 Å²	205	131.9 Å²	131.9	77%	0.774	66%	0.657	S	S	*	*			trans	-89.1	76.1	160.2	-69.7	-170.1	-178.2	-172	0.6	108.8	T22	R20-T22 PolarHBondContact O-N 2.96Å
21	V	35.3	Very low	46.4	Very low	134 Å²	134	128.6 Å²	128.6	81%	0.812	66%	0.658	S	S	*	*			trans	-59.9	79.3	152.2	-178.9	0	0	0	0	106.4	D19 S23	D19-V21 VanDerWaalsContact C-N 3.27Å; D19-V21 PolarHBondContact O-N 3.02Å; V21-S23 PolarHBondContact O-N 3.29Å
22	T	35.1	Very low	47.5	Very low	114 Å²	114	125.7 Å²	125.7	70%	0.699	65%	0.654	S	S	*	*			trans	-68.3	110.6	157.5	45.1	0	0	0	0	103.8	R20	R20-T22 PolarHBondContact O-N 2.96Å
23	S	28.8	Very low	49.2	Very low	95 Å²	95	122.2 Å²	122.2	66%	0.664	64%	0.635	S	S	*	*			trans	-44.9	129.5	163.7	41.4	0	0	0	0	107.2	V21 P25	V21-S23 PolarHBondContact O-N 3.29Å; S23-P25 VanDerWaalsContact O-N 3.16Å
24	P	34.2	Very low	50.9	Low	108 Å²	108	117.9 Å²	117.9	70%	0.701	62%	0.617	S	S	*	*			trans	-54.2	130.8	177.9	20.9	-30.1	0	0	0	106.8	K26	P24-K26 PolarHBondContact O-N 3.07Å; P24-K26 VanDerWaalsContact O-N 3.13Å
25	P	36.4	Very low	52.8	Low	113 Å²	113	116.2 Å²	116.2	73%	0.734	62%	0.617	S	S	*	*			trans	-51.2	129.3	-176.3	19.8	-30.6	0	0	0	107.3	S23 V27	S23-P25 VanDerWaalsContact O-N 3.16Å; P25-V27 PolarHBondContact O-N 2.93Å
26	K	36.4	Very low	55.3	Low	203 Å²	203	110.2 Å²	110.2	88%	0.883	60%	0.596	S	S	*	*			trans	-35.7	104.8	177.9	-90.9	178.5	174.4	176	0	107.4	P24 M28	P24-K26 PolarHBondContact O-N 3.07Å; P24-K26 VanDerWaalsContact O-N 3.13Å; K26-M28 VanDerWaalsContact C-N 3.31Å; K26-M28 PolarHBondContact O-N 3.05Å
27	V	43.6	Very low	57.6	Low	84 Å²	84	109.5 Å²	109.5	51%	0.509	60%	0.596	S	S	.	*			trans	-62.9	104.5	178.8	177.4	0	0	0	0	104	P25 K29	P25-V27 PolarHBondContact O-N 2.93Å; V27-K29 PolarHBondContact O-N 2.77Å
28	M	49.2	Very low	60.2	Low	154 Å²	154	105 Å²	105	76%	0.759	57%	0.574	S	S	*	*			trans	-56	118.6	171.6	-70.7	179.2	71.1	0	0	105.2	K26 V30	K26-M28 VanDerWaalsContact C-N 3.31Å; K26-M28 PolarHBondContact O-N 3.05Å; M28-V30 HydrophobicContact CB-CG2 4.07Å; M28-V30 PolarHBondContact O-N 2.8Å
29	K	57.1	Low	62.8	Low	199 Å²	199	101.4 Å²	101.4	87%	0.865	55%	0.549	S	S	*	.			trans	-68.2	78.7	170.2	-80	-176.3	176.2	-180	0	107	V27 S31	V27-K29 PolarHBondContact O-N 2.77Å; K29-S31 PolarHBondContact O-N 2.91Å
30	V	72.4	Confident	65.7	Low	32 Å²	32	98.1 Å²	98.1	19%	0.194	54%	0.535	C	S	.	.			trans	-72.4	100	170.5	-174.4	0	0	0	0	105.9	M28 L209 F213 M226	M28-V30 HydrophobicContact CB-CG2 4.07Å; M28-V30 PolarHBondContact O-N 2.8Å; V30-L209 HydrophobicContact CG1-CD2 4.15Å; V30-F213 HydrophobicContact CB-CD2 4.27Å; V30-F213 HydrophobicContact CB-CE2 3.55Å; V30-F213 HydrophobicContact CB-CZ 3.68Å; V30-F213 HydrophobicContact CG1-CE2 3.81Å; V30-F213 HydrophobicContact CG1-CZ 3.77Å; V30-F213 HydrophobicContact CG2-CE1 4.19Å; V30-F213 HydrophobicContact CG2-CE2 4.09Å; V30-F213 HydrophobicContact CG2-CZ 3.76Å; V30-M226 HydrophobicContact CG1-SD 4.1Å
31	S	78.9	Confident	68.7	Low	85 Å²	85	92.3 Å²	92.3	59%	0.594	52%	0.52	S	S	*	.			trans	-101.1	-12.5	-176.9	55.1	0	0	0	0	113.1	K29	K29-S31 PolarHBondContact O-N 2.91Å
32	S	90	Very high	71.6	Confident	69 Å²	69	85.9 Å²	85.9	48%	0.483	48%	0.481	S	S	.	.	S	Bend	trans	-145.5	158.1	-175.7	54.1	0	0	0	0	111.7
33	I	92.9	Very high	74.5	Confident	28 Å²	28	80.9 Å²	80.9	14%	0.144	45%	0.45	C	S	.	.			trans	-83.2	129	166.8	-63.4	158.1	0	0	0	107	T70 L71 L230 L233 L247	I33-T70 HydrophobicContact CG2-CG2 3.75Å; I33-L71 HydrophobicContact CG2-CD2 4.4Å; I33-L230 HydrophobicContact CG2-CD2 3.79Å; I33-L233 HydrophobicContact CD1-CD1 3.36Å; I33-L233 HydrophobicContact CG1-CD1 4.09Å; I33-L247 HydrophobicContact CD1-CD2 3.58Å; I33-L247 HydrophobicContact CG1-CD2 3.67Å
34	P	92.3	Very high	77.7	Confident	33 Å²	33	81.4 Å²	81.4	21%	0.214	44%	0.442	C	S	.	.			trans	-67	146.9	176.7	23.7	-26.6	0	0	0	111	M36 Y45 L71 M226	P34-M36 HydrophobicContact CB-CE 4.05Å; P34-Y45 HydrophobicContact CG-CD1 4.46Å; P34-Y45 HydrophobicContact CG-CE1 3.69Å; P34-Y45 HydrophobicContact CG-CE2 4.35Å; P34-L71 HydrophobicContact CB-CD2 4.45Å; P34-L71 HydrophobicContact CG-CD2 3.77Å; P34-L71 WeakPolarHBondContact O-CD2 3.41Å; P34-M226 HydrophobicContact CG-CE 4.44Å
35	V	93.2	Very high	80.7	Confident	92 Å²	92	78.9 Å²	78.9	56%	0.558	42%	0.419	S	S	*	.			trans	-119.6	134.1	171.9	-179	0	0	0	0	107.2	L71	V35-L71 WeakPolarHBondContact CA-O 3.32Å
36	M	94.1	Very high	83.5	Confident	42 Å²	42	73.5 Å²	73.5	21%	0.207	38%	0.384	C	S	.	.			trans	-117.2	141.2	-176.4	-56.7	-60	-171.7	0	0	110.2	P34 D41 A42 Y45 L71	P34-M36 HydrophobicContact CB-CE 4.05Å; M36-D41 HydrophobicContact CB-CB 4.46Å; M36-A42 HydrophobicContact CB-CB 3.95Å; M36-A42 HydrophobicContact CG-CB 4Å; M36-Y45 HydrophobicContact CE-CD1 3.98Å; M36-Y45 HydrophobicContact CE-CD2 3.98Å; M36-Y45 HydrophobicContact CE-CG 3.55Å; M36-L71 HydrophobicContact CG-CB 4.3Å; M36-L71 PolarHBondContact N-O 2.83Å
37	E	91.2	Very high	86.3	Confident	167 Å²	167	64.8 Å²	64.8	78%	0.78	35%	0.346	S	S	*	.	S	Bend	trans	-75.6	-32.6	179	-64.3	-175.1	177.1	0	0	112.2	K77	E37-K77 PolarHBondContact O-NZ 3.46Å
38	T	93.9	Very high	88.6	Confident	41 Å²	41	65 Å²	65	25%	0.252	35%	0.351	S	S	.	.	S	Bend	trans	-122.1	151.3	-176.7	83.8	0	0	0	0	112.2	C40 D41 A42	T38-C40 PolarHBondContact O-N 2.89Å; T38-C40 PolarHBondContact OG1-N 2.99Å; T38-D41 PolarHBondContact O-N 2.97Å; T38-D41 PolarHBondContact OG1-N 2.76Å; T38-D41 PolarHBondContact OG1-OD2 3.32Å; T38-A42 PolarHBondContact O-N 2.96Å; T38-A42 VanDerWaalsContact O-N 3.15Å
39	V	95.6	Very high	90.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.8	-30	173.4	175	0	0	0	0	111	A42 L43 L68 V72 V78 Q81 L82 M85	V39-A42 PolarHBondContact O-N 2.95Å; V39-L43 HydrophobicContact CG1-CD1 4.04Å; V39-L43 HydrophobicContact CG1-CG 4.26Å; V39-L43 WeakPolarHBondContact O-CB 3.29Å; V39-L43 VanDerWaalsContact O-CG 3.32Å; V39-L43 WeakPolarHBondContact O-CG 3.45Å; V39-L43 PolarHBondContact O-N 3.03Å; V39-L68 HydrophobicContact CG1-CD1 4.29Å; V39-L68 HydrophobicContact CG1-CD2 4.4Å; V39-V72 HydrophobicContact CG2-CG1 4.47Å; V39-V72 HydrophobicContact CG2-CG2 4.35Å; V39-V78 HydrophobicContact CG2-CB 4.41Å; V39-V78 HydrophobicContact CG2-CG2 4.02Å; V39-Q81 HydrophobicContact CB-CB 4.13Å; V39-Q81 HydrophobicContact CG1-CB 4.45Å; V39-Q81 HydrophobicContact CG2-CB 4.07Å; V39-Q81 HydrophobicContact CG2-CG 4.49Å; V39-L82 HydrophobicContact CG1-CD2 4.13Å; V39-M85 HydrophobicContact CB-CE 4.48Å; V39-M85 HydrophobicContact CG1-CE 4.24Å
40	C	95.5	Very high	91.8	Very high	62 Å²	62	51.3 Å²	51.3	42%	0.419	29%	0.29	S	S	.	.	H	α-helix	trans	-60	-51.4	174.6	-62.1	0	0	0	0	111.4	T38 A42 L43 E44 M85	T38-C40 PolarHBondContact O-N 2.89Å; T38-C40 PolarHBondContact OG1-N 2.99Å; C40-A42 VanDerWaalsContact C-N 3.31Å; C40-A42 PolarHBondContact O-N 3.19Å; C40-L43 PolarHBondContact O-N 3.32Å; C40-E44 PolarHBondContact O-N 2.9Å; C40-M85 HydrophobicContact CB-CE 4.44Å; C40-M85 WeakPolarHBondContact SG-CE 3.47Å
41	D	96	Very high	92.1	Very high	83 Å²	83	51 Å²	51	44%	0.444	29%	0.288	S	S	.	.	H	α-helix	trans	-65.5	-38.5	-179.2	-56.4	-39.1	0	0	0	111.1	M36 T38 E44 Y45	M36-D41 HydrophobicContact CB-CB 4.46Å; T38-D41 PolarHBondContact O-N 2.97Å; T38-D41 PolarHBondContact OG1-N 2.76Å; T38-D41 PolarHBondContact OG1-OD2 3.32Å; D41-E44 PolarHBondContact O-N 2.98Å; D41-Y45 WeakPolarHBondContact O-CB 3.22Å; D41-Y45 PolarHBondContact O-N 3.22Å
42	A	97	Very high	91.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.2	-45.1	173.6	0	0	0	0	0	112.1	M36 T38 V39 C40 Y45 L46 L68 L71 V72	M36-A42 HydrophobicContact CB-CB 3.95Å; M36-A42 HydrophobicContact CG-CB 4Å; T38-A42 PolarHBondContact O-N 2.96Å; T38-A42 VanDerWaalsContact O-N 3.15Å; V39-A42 PolarHBondContact O-N 2.95Å; C40-A42 VanDerWaalsContact C-N 3.31Å; C40-A42 PolarHBondContact O-N 3.19Å; A42-Y45 PolarHBondContact O-N 3Å; A42-L46 WeakPolarHBondContact O-CB 3.24Å; A42-L46 WeakPolarHBondContact O-CD1 3.25Å; A42-L46 WeakPolarHBondContact O-CG 3.33Å; A42-L46 PolarHBondContact O-N 3.3Å; A42-L68 HydrophobicContact CB-CD2 3.61Å; A42-L71 HydrophobicContact CB-CB 4.12Å; A42-L71 HydrophobicContact CB-CD1 4.12Å; A42-V72 HydrophobicContact CB-CG2 3.8Å
43	L	96.7	Very high	90	Very high	9 Å²	9	54.4 Å²	54.4	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-47.9	176.6	-78.8	172.2	0	0	0	111.7	V39 C40 Y45 L46 F47 V63 L68 L82 M85 I106	V39-L43 HydrophobicContact CG1-CD1 4.04Å; V39-L43 HydrophobicContact CG1-CG 4.26Å; V39-L43 WeakPolarHBondContact O-CB 3.29Å; V39-L43 VanDerWaalsContact O-CG 3.32Å; V39-L43 WeakPolarHBondContact O-CG 3.45Å; V39-L43 PolarHBondContact O-N 3.03Å; C40-L43 PolarHBondContact O-N 3.32Å; L43-Y45 VanDerWaalsContact C-N 3.31Å; L43-Y45 PolarHBondContact O-N 3.43Å; L43-L46 PolarHBondContact O-N 2.88Å; L43-L46 VanDerWaalsContact O-N 3.15Å; L43-F47 HydrophobicContact CB-CD2 4.21Å; L43-F47 HydrophobicContact CB-CE2 4.05Å; L43-F47 HydrophobicContact CD2-CE2 4Å; L43-F47 HydrophobicContact CD2-CZ 4.43Å; L43-F47 WeakPolarHBondContact O-CB 3.35Å; L43-F47 WeakPolarHBondContact O-CD2 3.47Å; L43-F47 WeakPolarHBondContact O-CG 3.07Å; L43-F47 PolarHBondContact O-N 3.26Å; L43-V63 HydrophobicContact CD2-CG1 4.18Å; L43-L68 HydrophobicContact CD2-CD1 4.06Å; L43-L68 HydrophobicContact CD2-CD2 4.08Å; L43-L68 HydrophobicContact CG-CD1 4.49Å; L43-L68 HydrophobicContact CG-CD2 4.08Å; L43-L82 HydrophobicContact CD1-CD2 4.38Å; L43-M85 HydrophobicContact CD1-CE 4.23Å; L43-M85 HydrophobicContact CD1-SD 3.58Å; L43-M85 VanDerWaalsContact CD1-SD 3.58Å; L43-I106 HydrophobicContact CD2-CD1 4.26Å; L43-I106 HydrophobicContact CD2-CG2 4.1Å
44	E	95.6	Very high	88.7	Confident	106 Å²	106	55.4 Å²	55.4	50%	0.495	31%	0.313	S	S	.	.	H	α-helix	trans	-60.8	-41.8	178.8	-72.1	-58.2	157.8	0	0	111.8	C40 D41 S48 K108	C40-E44 PolarHBondContact O-N 2.9Å; D41-E44 PolarHBondContact O-N 2.98Å; E44-S48 WeakPolarHBondContact O-CB 3.45Å; E44-S48 PolarHBondContact O-N 2.92Å; E44-K108 VanDerWaalsContact CD-NZ 3.33Å; E44-K108 IonicContact OE1-NZ 3.24Å; E44-K108 PolarHBondContact OE1-NZ 2.86Å; E44-K108 IonicContact OE2-NZ 2.9Å; E44-K108 PolarHBondContact OE2-NZ 3.45Å
45	Y	96	Very high	87.5	Confident	55 Å²	55	57.2 Å²	57.2	22%	0.216	33%	0.325	C	S	.	.	H	α-helix	trans	-60.6	-47.9	172.4	170.6	-101.4	0	0	0	112	P34 M36 D41 A42 L43 F47 S48 L49 L71 M226 L230	P34-Y45 HydrophobicContact CG-CD1 4.46Å; P34-Y45 HydrophobicContact CG-CE1 3.69Å; P34-Y45 HydrophobicContact CG-CE2 4.35Å; M36-Y45 HydrophobicContact CE-CD1 3.98Å; M36-Y45 HydrophobicContact CE-CD2 3.98Å; M36-Y45 HydrophobicContact CE-CG 3.55Å; D41-Y45 WeakPolarHBondContact O-CB 3.22Å; D41-Y45 PolarHBondContact O-N 3.22Å; A42-Y45 PolarHBondContact O-N 3Å; L43-Y45 VanDerWaalsContact C-N 3.31Å; L43-Y45 PolarHBondContact O-N 3.43Å; Y45-F47 PolarHBondContact O-N 3.37Å; Y45-S48 WeakPolarHBondContact O-CB 3.25Å; Y45-S48 PolarHBondContact O-N 2.9Å; Y45-S48 VanDerWaalsContact O-N 3.12Å; Y45-S48 PolarHBondContact O-OG 2.76Å; Y45-L49 HydrophobicContact CD1-CD1 4.44Å; Y45-L49 HydrophobicContact CE1-CD1 3.75Å; Y45-L49 HydrophobicContact CE1-CG 4.22Å; Y45-L49 HydrophobicContact CE2-CD2 4.19Å; Y45-L49 PolarHBondContact O-N 2.92Å; Y45-L71 HydrophobicContact CD1-CD1 3.61Å; Y45-L71 HydrophobicContact CE1-CD1 4.04Å; Y45-L71 HydrophobicContact CE1-CD2 4.39Å; Y45-M226 WeakPolarHBondContact OH-CE 2.94Å; Y45-L230 HydrophobicContact CE1-CD1 4.02Å
46	L	95.9	Very high	86.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.1	-40	-178.9	-71.3	168.5	0	0	0	112.4	A42 L43 S48 L49 V63 Q67 L68 L71 L230	A42-L46 WeakPolarHBondContact O-CB 3.24Å; A42-L46 WeakPolarHBondContact O-CD1 3.25Å; A42-L46 WeakPolarHBondContact O-CG 3.33Å; A42-L46 PolarHBondContact O-N 3.3Å; L43-L46 PolarHBondContact O-N 2.88Å; L43-L46 VanDerWaalsContact O-N 3.15Å; L46-S48 VanDerWaalsContact C-N 3.26Å; L46-S48 PolarHBondContact O-N 3.45Å; L46-L49 HydrophobicContact CD2-CD1 4.17Å; L46-L49 WeakPolarHBondContact O-CB 3.38Å; L46-L49 PolarHBondContact O-N 3.38Å; L46-L49 VanDerWaalsContact O-N 3.14Å; L46-V63 HydrophobicContact CB-CB 4.33Å; L46-V63 HydrophobicContact CB-CG1 3.68Å; L46-V63 HydrophobicContact CB-CG2 3.63Å; L46-V63 HydrophobicContact CD1-CG1 3.47Å; L46-V63 VanDerWaalsContact CD1-CG1 3.47Å; L46-V63 HydrophobicContact CG-CG1 4.14Å; L46-Q67 HydrophobicContact CD1-CB 3.81Å; L46-Q67 HydrophobicContact CD2-CB 3.74Å; L46-Q67 HydrophobicContact CD2-CG 4.37Å; L46-Q67 HydrophobicContact CG-CB 4.45Å; L46-L68 HydrophobicContact CD1-CD2 3.55Å; L46-L68 HydrophobicContact CD1-CG 4Å; L46-L71 HydrophobicContact CD1-CD1 3.82Å; L46-L71 HydrophobicContact CD2-CD1 3.76Å; L46-L71 HydrophobicContact CG-CD1 3.62Å; L46-L230 HydrophobicContact CD2-CD1 3.69Å
47	F	94.7	Very high	85.6	Confident	19 Å²	19	64.2 Å²	64.2	8%	0.083	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-33.6	173.6	-73.5	-56.5	0	0	0	111.7	L43 Y45 L49 H50 P61 V63 I106 K108	L43-F47 HydrophobicContact CB-CD2 4.21Å; L43-F47 HydrophobicContact CB-CE2 4.05Å; L43-F47 HydrophobicContact CD2-CE2 4Å; L43-F47 HydrophobicContact CD2-CZ 4.43Å; L43-F47 WeakPolarHBondContact O-CB 3.35Å; L43-F47 WeakPolarHBondContact O-CD2 3.47Å; L43-F47 WeakPolarHBondContact O-CG 3.07Å; L43-F47 PolarHBondContact O-N 3.26Å; Y45-F47 PolarHBondContact O-N 3.37Å; F47-L49 VanDerWaalsContact C-N 3.25Å; F47-L49 PolarHBondContact O-N 3.45Å; F47-H50 WeakPolarHBondContact O-CB 3.16Å; F47-H50 PolarHBondContact O-N 2.72Å; F47-P61 HydrophobicContact CD1-CB 3.64Å; F47-P61 HydrophobicContact CE1-CB 4.22Å; F47-V63 HydrophobicContact CD1-CG2 3.45Å; F47-V63 VanDerWaalsContact CD1-CG2 3.45Å; F47-V63 HydrophobicContact CD2-CG2 4.46Å; F47-V63 HydrophobicContact CE1-CB 4.15Å; F47-V63 HydrophobicContact CE1-CG2 3.52Å; F47-V63 HydrophobicContact CG-CG2 3.95Å; F47-V63 HydrophobicContact CZ-CB 4.42Å; F47-V63 HydrophobicContact CZ-CG2 4.07Å; F47-I106 HydrophobicContact CZ-CG2 4.5Å; F47-K108 HydrophobicContact CD2-CD 4.38Å; F47-K108 HydrophobicContact CD2-CG 4.23Å; F47-K108 HydrophobicContact CE1-CG 4.34Å; F47-K108 HydrophobicContact CE2-CD 4.35Å; F47-K108 HydrophobicContact CE2-CG 3.72Å; F47-K108 HydrophobicContact CZ-CG 3.79Å
48	S	92.1	Very high	85.2	Confident	88 Å²	88	56.3 Å²	56.3	62%	0.615	31%	0.312	S	S	*	.	H	α-helix	trans	-67.6	-23.2	174.6	84.8	0	0	0	0	113.8	E44 Y45 L46 H50	E44-S48 WeakPolarHBondContact O-CB 3.45Å; E44-S48 PolarHBondContact O-N 2.92Å; Y45-S48 WeakPolarHBondContact O-CB 3.25Å; Y45-S48 PolarHBondContact O-N 2.9Å; Y45-S48 VanDerWaalsContact O-N 3.12Å; Y45-S48 PolarHBondContact O-OG 2.76Å; L46-S48 VanDerWaalsContact C-N 3.26Å; L46-S48 PolarHBondContact O-N 3.45Å; S48-H50 VanDerWaalsContact C-N 3.29Å
49	L	90.1	Very high	84.8	Confident	46 Å²	46	54.6 Å²	54.6	24%	0.241	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-18	174.7	-63.9	-177.8	0	0	0	112.9	Y45 L46 F47 M226 L230	Y45-L49 HydrophobicContact CD1-CD1 4.44Å; Y45-L49 HydrophobicContact CE1-CD1 3.75Å; Y45-L49 HydrophobicContact CE1-CG 4.22Å; Y45-L49 HydrophobicContact CE2-CD2 4.19Å; Y45-L49 PolarHBondContact O-N 2.92Å; L46-L49 HydrophobicContact CD2-CD1 4.17Å; L46-L49 WeakPolarHBondContact O-CB 3.38Å; L46-L49 PolarHBondContact O-N 3.38Å; L46-L49 VanDerWaalsContact O-N 3.14Å; F47-L49 VanDerWaalsContact C-N 3.25Å; F47-L49 PolarHBondContact O-N 3.45Å; L49-M226 HydrophobicContact CD1-CB 4.07Å; L49-M226 HydrophobicContact CD2-CB 4.48Å; L49-L230 HydrophobicContact CD1-CD1 3.94Å
50	H	84.4	Confident	84.6	Confident	21 Å²	21	57.3 Å²	57.3	10%	0.097	31%	0.314	C	S	.	.	S	Bend	trans	-63.4	130.8	-177.6	-167.1	-84.6	0	0	0	110.1	F47 S48 S52 P61	F47-H50 WeakPolarHBondContact O-CB 3.16Å; F47-H50 PolarHBondContact O-N 2.72Å; S48-H50 VanDerWaalsContact C-N 3.29Å; H50-S52 PolarHBondContact O-N 2.96Å; H50-S52 VanDerWaalsContact O-N 3.15Å; H50-P61 HydrophobicContact CB-CB 3.84Å; H50-P61 HydrophobicContact CB-CG 4.07Å
51	P	78.3	Confident	84.5	Confident	24 Å²	24	55.8 Å²	55.8	16%	0.156	30%	0.303	C	S	.	.			trans	-60.5	122.3	-177.9	-17.1	25.2	0	0	0	111.4	T53 L58 Y222	P51-T53 PolarHBondContact O-N 3.09Å; P51-L58 HydrophobicContact CG-CD1 4.27Å; P51-Y222 WeakPolarHBondContact CG-O 3.29Å
52	S	64.9	Low	84.4	Confident	110 Å²	110	51.9 Å²	51.9	77%	0.769	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-14.2	171.4	60.7	0	0	0	0	112.9	H50 P55	H50-S52 PolarHBondContact O-N 2.96Å; H50-S52 VanDerWaalsContact O-N 3.15Å; S52-P55 VanDerWaalsContact O-CD 3.25Å; S52-P55 WeakPolarHBondContact O-CD 3.47Å
53	T	58.8	Low	84.3	Confident	116 Å²	116	52 Å²	52	71%	0.712	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-21.3	-169.8	-38.7	0	0	0	0	113.7	P51	P51-T53 PolarHBondContact O-N 3.09Å
54	N	67.3	Low	84.2	Confident	50 Å²	50	51.6 Å²	51.6	27%	0.267	28%	0.28	S	S	.	.			trans	-124.3	41.8	-176.3	-65.1	-54	0	0	0	115.2	K56 I57 L58	N54-K56 PolarHBondContact O-N 2.84Å; N54-I57 HydrophobicContact CB-CB 4.46Å; N54-I57 PolarHBondContact O-N 3.22Å; N54-L58 PolarHBondContact O-N 2.93Å
55	P	65.6	Low	84.2	Confident	71 Å²	71	48.3 Å²	48.3	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-30	-178.4	26.8	-34.3	0	0	0	111.7	S52 I57 G59	S52-P55 VanDerWaalsContact O-CD 3.25Å; S52-P55 WeakPolarHBondContact O-CD 3.47Å; P55-I57 PolarHBondContact O-N 3.33Å; P55-G59 WeakPolarHBondContact O-CA 3.49Å; P55-G59 PolarHBondContact O-N 3.31Å
56	K	71.2	Confident	84	Confident	201 Å²	201	46 Å²	46	87%	0.874	26%	0.257	S	S	*	.	H	α-helix	trans	-63.5	-24.7	175.4	-67.3	-173	178	-174.6	0	113.9	N54	N54-K56 PolarHBondContact O-N 2.84Å
57	I	76.2	Confident	84	Confident	80 Å²	80	46 Å²	46	41%	0.41	26%	0.257	S	S	.	.	H	α-helix	trans	-101.2	-48.9	-175.7	-60.2	174.8	0	0	0	110.6	N54 P55 A183	N54-I57 HydrophobicContact CB-CB 4.46Å; N54-I57 PolarHBondContact O-N 3.22Å; P55-I57 PolarHBondContact O-N 3.33Å; I57-A183 VanDerWaalsContact O-CB 3.22Å; I57-A183 WeakPolarHBondContact O-CB 3.46Å
58	L	83.4	Confident	84.1	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-89.6	-12.9	-175.5	-61.9	178.6	0	0	0	112.9	P51 N54 A187 Y222 L223	P51-L58 HydrophobicContact CG-CD1 4.27Å; N54-L58 PolarHBondContact O-N 2.93Å; L58-A187 HydrophobicContact CD2-CB 3.47Å; L58-A187 VanDerWaalsContact CD2-CB 3.47Å; L58-Y222 HydrophobicContact CD2-CD2 4.49Å; L58-L223 HydrophobicContact CD1-CD2 3.81Å; L58-L223 HydrophobicContact CD1-CG 4.37Å
59	G	86.5	Confident	84.2	Confident	6 Å²	6	43.3 Å²	43.3	6%	0.062	23%	0.233	C	C	.	.			trans	68.2	-133.7	-172	0	0	0	0	0	111.2	P55 Y180	P55-G59 WeakPolarHBondContact O-CA 3.49Å; P55-G59 PolarHBondContact O-N 3.31Å; G59-Y180 VanDerWaalsContact CA-CG 3.42Å
60	R	90.8	Very high	84.4	Confident	57 Å²	57	42.2 Å²	42.2	22%	0.215	23%	0.228	C	C	.	.	S	Bend	trans	-93.4	157.1	-173.7	-65.6	174.8	-178.3	-83	-5.8	111.8	I62 M107 D111 N114 D118	R60-I62 PolarHBondContact O-N 3.44Å; R60-M107 HydrophobicContact CB-CE 3.83Å; R60-D111 HydrophobicContact CB-CB 4.05Å; R60-D111 WeakPolarHBondContact CD-O 3.46Å; R60-D111 IonicContact NH1-OD1 2.87Å; R60-D111 PolarHBondContact NH1-OD1 3.3Å; R60-N114 VanDerWaalsContact NE-C 3.3Å; R60-N114 PolarHBondContact NE-O 3.02Å; R60-D118 IonicContact CZ-OD1 3.15Å; R60-D118 IonicContact CZ-OD2 2.91Å; R60-D118 IonicContact NE-OD2 3.48Å; R60-D118 PolarHBondContact NE-OD2 2.84Å; R60-D118 IonicContact NH2-OD1 2.9Å; R60-D118 PolarHBondContact NH2-OD1 2.84Å; R60-D118 IonicContact NH2-OD2 2.97Å; R60-D118 PolarHBondContact NH2-OD2 3.18Å; R60-D118 VanDerWaalsContact NH2-OD2 3.15Å
61	P	93.1	Very high	85	Confident	30 Å²	30	41.2 Å²	41.2	20%	0.195	22%	0.223	C	C	.	.			trans	-59.4	126.3	-174.4	-26.8	37.4	0	0	0	113.7	F47 H50	F47-P61 HydrophobicContact CD1-CB 3.64Å; F47-P61 HydrophobicContact CE1-CB 4.22Å; H50-P61 HydrophobicContact CB-CB 3.84Å; H50-P61 HydrophobicContact CB-CG 4.07Å
62	I	94.3	Very high	85.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.217	C	C	.	.			trans	-116.7	129.8	169	-63.3	163.5	0	0	0	107.9	R60 L64 I96 M107 T178 L181 F184 Y227	R60-I62 PolarHBondContact O-N 3.44Å; I62-L64 HydrophobicContact CG2-CD2 4.41Å; I62-I96 HydrophobicContact CG2-CD1 4.45Å; I62-M107 HydrophobicContact CB-CG 4.44Å; I62-M107 HydrophobicContact CD1-SD 4.28Å; I62-M107 HydrophobicContact CG1-CE 4.42Å; I62-M107 HydrophobicContact CG1-CG 3.58Å; I62-M107 HydrophobicContact CG1-SD 3.8Å; I62-T178 HydrophobicContact CD1-CG2 4.3Å; I62-L181 HydrophobicContact CD1-CD1 4.06Å; I62-F184 HydrophobicContact CB-CD1 4.35Å; I62-F184 HydrophobicContact CB-CD2 3.93Å; I62-F184 HydrophobicContact CB-CE1 4.16Å; I62-F184 HydrophobicContact CB-CE2 3.71Å; I62-F184 HydrophobicContact CB-CG 4.25Å; I62-F184 HydrophobicContact CB-CZ 3.84Å; I62-F184 HydrophobicContact CD1-CB 3.86Å; I62-F184 HydrophobicContact CD1-CD1 3.8Å; I62-F184 HydrophobicContact CD1-CD2 4.04Å; I62-F184 HydrophobicContact CD1-CE1 4.41Å; I62-F184 HydrophobicContact CD1-CG 3.6Å; I62-F184 HydrophobicContact CG1-CD2 4.48Å; I62-F184 HydrophobicContact CG1-CG 4.48Å; I62-F184 HydrophobicContact CG2-CD1 4.18Å; I62-F184 HydrophobicContact CG2-CE1 3.68Å; I62-F184 HydrophobicContact CG2-CE2 4.04Å; I62-F184 HydrophobicContact CG2-CZ 3.6Å; I62-Y227 WeakPolarHBondContact O-CE2 3.47Å; I62-Y227 PolarHBondContact O-OH 2.9Å
63	V	94.8	Very high	87.1	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	148.3	175.1	168.8	0	0	0	0	108.9	L43 L46 F47 G105 I106	L43-V63 HydrophobicContact CD2-CG1 4.18Å; L46-V63 HydrophobicContact CB-CB 4.33Å; L46-V63 HydrophobicContact CB-CG1 3.68Å; L46-V63 HydrophobicContact CB-CG2 3.63Å; L46-V63 HydrophobicContact CD1-CG1 3.47Å; L46-V63 VanDerWaalsContact CD1-CG1 3.47Å; L46-V63 HydrophobicContact CG-CG1 4.14Å; F47-V63 HydrophobicContact CD1-CG2 3.45Å; F47-V63 VanDerWaalsContact CD1-CG2 3.45Å; F47-V63 HydrophobicContact CD2-CG2 4.46Å; F47-V63 HydrophobicContact CE1-CB 4.15Å; F47-V63 HydrophobicContact CE1-CG2 3.52Å; F47-V63 HydrophobicContact CG-CG2 3.95Å; F47-V63 HydrophobicContact CZ-CB 4.42Å; F47-V63 HydrophobicContact CZ-CG2 4.07Å; V63-G105 CarbonylContact O-C 3.53Å; V63-G105 WeakPolarHBondContact O-CA 3.28Å; V63-I106 HydrophobicContact CB-CB 4.41Å; V63-I106 PolarHBondContact N-O 3.19Å; V63-I106 PolarHBondContact O-N 2.62Å
64	L	94.5	Very high	88.8	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	141	176.6	-58.6	-163.1	0	0	0	111.9	I62 S66 Q67 I96 F184 Y188 A231	I62-L64 HydrophobicContact CG2-CD2 4.41Å; L64-S66 PolarHBondContact O-N 3.45Å; L64-Q67 HydrophobicContact CB-CG 4.11Å; L64-Q67 VanDerWaalsContact O-CB 3.3Å; L64-Q67 WeakPolarHBondContact O-CB 3.42Å; L64-Q67 PolarHBondContact O-N 2.71Å; L64-I96 HydrophobicContact CD2-CG1 3.91Å; L64-F184 HydrophobicContact CD2-CE1 4.08Å; L64-F184 HydrophobicContact CD2-CZ 3.9Å; L64-Y188 HydrophobicContact CD1-CD1 4.22Å; L64-Y188 HydrophobicContact CD1-CD2 3.93Å; L64-Y188 HydrophobicContact CD1-CE1 3.65Å; L64-Y188 HydrophobicContact CD1-CE2 3.32Å; L64-Y188 HydrophobicContact CD1-CG 4.35Å; L64-Y188 WeakPolarHBondContact CD1-OH 3.3Å; L64-Y188 HydrophobicContact CG-CE2 4.49Å; L64-A231 HydrophobicContact CD1-CB 4.32Å
65	K	94.4	Very high	90	Very high	38 Å²	38	44.4 Å²	44.4	17%	0.165	22%	0.216	C	C	.	.	H	α-helix	trans	-56.7	-38.2	175.5	-169.5	171	76.5	155.8	0	112.3	Q67 L68 Y69 E79 L82 V104 I106	K65-Q67 VanDerWaalsContact C-N 3.25Å; K65-Q67 PolarHBondContact O-N 3.48Å; K65-L68 WeakPolarHBondContact O-CB 3.32Å; K65-L68 PolarHBondContact O-N 3.05Å; K65-Y69 WeakPolarHBondContact CE-OH 3.18Å; K65-Y69 HydrophobicContact CG-CE1 4.27Å; K65-Y69 HydrophobicContact CG-CE2 4.35Å; K65-Y69 PolarHBondContact NZ-OH 2.87Å; K65-Y69 PolarHBondContact O-N 2.82Å; K65-E79 WeakPolarHBondContact CD-OE1 3.44Å; K65-E79 IonicContact NZ-OE1 3.72Å; K65-E79 PolarHBondContact NZ-OE1 3.34Å; K65-E79 IonicContact NZ-OE2 3.41Å; K65-E79 PolarHBondContact NZ-OE2 3.19Å; K65-L82 HydrophobicContact CD-CD1 3.99Å; K65-L82 HydrophobicContact CG-CD1 3.91Å; K65-V104 HydrophobicContact CB-CB 4.03Å; K65-V104 WeakPolarHBondContact CB-O 3.31Å; K65-V104 HydrophobicContact CD-CB 4.21Å; K65-V104 PolarHBondContact N-O 3.48Å; K65-I106 HydrophobicContact CB-CD1 4.37Å
66	S	93.5	Very high	91.3	Very high	7 Å²	7	47.4 Å²	47.4	5%	0.049	23%	0.228	C	C	.	.	H	α-helix	trans	-57.5	-37	174.6	54.7	0	0	0	0	112.5	L64 L68 Y69 T70 G234	L64-S66 PolarHBondContact O-N 3.45Å; S66-L68 VanDerWaalsContact C-N 3.27Å; S66-L68 PolarHBondContact O-N 3.12Å; S66-Y69 WeakPolarHBondContact O-CB 3.46Å; S66-Y69 PolarHBondContact O-N 3.32Å; S66-Y69 VanDerWaalsContact O-N 3.13Å; S66-T70 PolarHBondContact O-N 3.05Å; S66-G234 VanDerWaalsContact O-CA 3.28Å; S66-G234 WeakPolarHBondContact O-CA 3.37Å
67	Q	95.2	Very high	92.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-35.7	177	-62.3	168.9	-42.1	0	0	112.1	L46 L64 K65 Y69 T70 L71 Y227 L230 A231	L46-Q67 HydrophobicContact CD1-CB 3.81Å; L46-Q67 HydrophobicContact CD2-CB 3.74Å; L46-Q67 HydrophobicContact CD2-CG 4.37Å; L46-Q67 HydrophobicContact CG-CB 4.45Å; L64-Q67 HydrophobicContact CB-CG 4.11Å; L64-Q67 VanDerWaalsContact O-CB 3.3Å; L64-Q67 WeakPolarHBondContact O-CB 3.42Å; L64-Q67 PolarHBondContact O-N 2.71Å; K65-Q67 VanDerWaalsContact C-N 3.25Å; K65-Q67 PolarHBondContact O-N 3.48Å; Q67-Y69 VanDerWaalsContact C-N 3.33Å; Q67-Y69 PolarHBondContact O-N 2.72Å; Q67-T70 WeakPolarHBondContact O-CB 3.38Å; Q67-T70 PolarHBondContact O-N 3.03Å; Q67-L71 WeakPolarHBondContact O-CG 3.38Å; Q67-L71 PolarHBondContact O-N 2.88Å; Q67-Y227 VanDerWaalsContact NE2-CD1 3.26Å; Q67-Y227 VanDerWaalsContact NE2-CE1 3.28Å; Q67-Y227 VanDerWaalsContact NE2-CG 3.29Å; Q67-Y227 PolarHBondContact NE2-O 2.81Å; Q67-L230 HydrophobicContact CB-CB 4.1Å; Q67-L230 HydrophobicContact CG-CB 3.95Å; Q67-A231 HydrophobicContact CG-CB 3.85Å
68	L	95.9	Very high	93.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-36.8	176	-66.1	171	0	0	0	112	V39 A42 L43 L46 K65 S66 T70 L71 V72 V78 L82 I106	V39-L68 HydrophobicContact CG1-CD1 4.29Å; V39-L68 HydrophobicContact CG1-CD2 4.4Å; A42-L68 HydrophobicContact CB-CD2 3.61Å; L43-L68 HydrophobicContact CD2-CD1 4.06Å; L43-L68 HydrophobicContact CD2-CD2 4.08Å; L43-L68 HydrophobicContact CG-CD1 4.49Å; L43-L68 HydrophobicContact CG-CD2 4.08Å; L46-L68 HydrophobicContact CD1-CD2 3.55Å; L46-L68 HydrophobicContact CD1-CG 4Å; K65-L68 WeakPolarHBondContact O-CB 3.32Å; K65-L68 PolarHBondContact O-N 3.05Å; S66-L68 VanDerWaalsContact C-N 3.27Å; S66-L68 PolarHBondContact O-N 3.12Å; L68-T70 PolarHBondContact O-N 2.94Å; L68-L71 PolarHBondContact O-N 3.05Å; L68-L71 VanDerWaalsContact O-N 3.14Å; L68-V72 WeakPolarHBondContact O-CB 3.27Å; L68-V72 PolarHBondContact O-N 3.26Å; L68-V78 HydrophobicContact CB-CG1 3.83Å; L68-V78 HydrophobicContact CB-CG2 4.41Å; L68-V78 HydrophobicContact CD1-CG1 4.08Å; L68-L82 HydrophobicContact CD1-CD1 3.89Å; L68-L82 HydrophobicContact CD1-CD2 3.88Å; L68-L82 HydrophobicContact CD1-CG 4.27Å; L68-I106 HydrophobicContact CD1-CD1 3.46Å; L68-I106 VanDerWaalsContact CD1-CD1 3.46Å
69	Y	94.6	Very high	93.9	Very high	50 Å²	50	41.2 Å²	41.2	20%	0.196	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-21.9	175	-59.5	-29.6	0	0	0	113.5	K65 S66 Q67 R75 V78 E79	K65-Y69 WeakPolarHBondContact CE-OH 3.18Å; K65-Y69 HydrophobicContact CG-CE1 4.27Å; K65-Y69 HydrophobicContact CG-CE2 4.35Å; K65-Y69 PolarHBondContact NZ-OH 2.87Å; K65-Y69 PolarHBondContact O-N 2.82Å; S66-Y69 WeakPolarHBondContact O-CB 3.46Å; S66-Y69 PolarHBondContact O-N 3.32Å; S66-Y69 VanDerWaalsContact O-N 3.13Å; Q67-Y69 VanDerWaalsContact C-N 3.33Å; Q67-Y69 PolarHBondContact O-N 2.72Å; Y69-R75 HydrophobicContact CD1-CB 4.29Å; Y69-R75 HydrophobicContact CD1-CG 3.88Å; Y69-R75 HydrophobicContact CE1-CB 4.29Å; Y69-R75 HydrophobicContact CE1-CG 4.3Å; Y69-R75 HydrophobicContact CG-CG 4.25Å; Y69-V78 HydrophobicContact CD1-CB 4.16Å; Y69-V78 HydrophobicContact CD1-CG1 3.99Å; Y69-V78 HydrophobicContact CD1-CG2 4.29Å; Y69-V78 HydrophobicContact CE1-CB 4.02Å; Y69-V78 HydrophobicContact CE1-CG1 3.74Å; Y69-E79 VanDerWaalsContact CE1-OE1 3.31Å; Y69-E79 WeakPolarHBondContact CE1-OE1 3.3Å; Y69-E79 VanDerWaalsContact CZ-OE1 3.28Å; Y69-E79 VanDerWaalsContact OH-CD 3.27Å; Y69-E79 PolarHBondContact OH-OE1 3.41Å
70	T	95.1	Very high	94.3	Very high	22 Å²	22	44.1 Å²	44.1	14%	0.135	22%	0.218	C	C	.	.	H	α-helix	trans	-79.6	-39.2	172.6	-58	0	0	0	0	112	I33 S66 Q67 L68 L230 L233 G234	I33-T70 HydrophobicContact CG2-CG2 3.75Å; S66-T70 PolarHBondContact O-N 3.05Å; Q67-T70 WeakPolarHBondContact O-CB 3.38Å; Q67-T70 PolarHBondContact O-N 3.03Å; L68-T70 PolarHBondContact O-N 2.94Å; T70-L230 HydrophobicContact CG2-CD2 3.57Å; T70-L230 PolarHBondContact OG1-O 2.99Å; T70-L233 HydrophobicContact CG2-CB 3.84Å; T70-L233 HydrophobicContact CG2-CD1 3.93Å; T70-G234 WeakPolarHBondContact OG1-CA 3.44Å; T70-G234 PolarHBondContact OG1-N 3.18Å
71	L	96.4	Very high	94.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-85.7	-24.9	-174.1	-61	-175.1	0	0	0	113.3	I33 P34 V35 M36 A42 Y45 L46 Q67 L68 L230	I33-L71 HydrophobicContact CG2-CD2 4.4Å; P34-L71 HydrophobicContact CB-CD2 4.45Å; P34-L71 HydrophobicContact CG-CD2 3.77Å; P34-L71 WeakPolarHBondContact O-CD2 3.41Å; V35-L71 WeakPolarHBondContact CA-O 3.32Å; M36-L71 HydrophobicContact CG-CB 4.3Å; M36-L71 PolarHBondContact N-O 2.83Å; A42-L71 HydrophobicContact CB-CB 4.12Å; A42-L71 HydrophobicContact CB-CD1 4.12Å; Y45-L71 HydrophobicContact CD1-CD1 3.61Å; Y45-L71 HydrophobicContact CE1-CD1 4.04Å; Y45-L71 HydrophobicContact CE1-CD2 4.39Å; L46-L71 HydrophobicContact CD1-CD1 3.82Å; L46-L71 HydrophobicContact CD2-CD1 3.76Å; L46-L71 HydrophobicContact CG-CD1 3.62Å; Q67-L71 WeakPolarHBondContact O-CG 3.38Å; Q67-L71 PolarHBondContact O-N 2.88Å; L68-L71 PolarHBondContact O-N 3.05Å; L68-L71 VanDerWaalsContact O-N 3.14Å; L71-L230 HydrophobicContact CD1-CD1 4.49Å; L71-L230 HydrophobicContact CD2-CD1 4.16Å; L71-L230 HydrophobicContact CD2-CD2 3.73Å
72	V	96.1	Very high	94.7	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.024	21%	0.211	C	C	.	.			trans	-122.6	116.8	-174.6	-175.9	0	0	0	0	109.5	V39 A42 L68 N74 V78	V39-V72 HydrophobicContact CG2-CG1 4.47Å; V39-V72 HydrophobicContact CG2-CG2 4.35Å; A42-V72 HydrophobicContact CB-CG2 3.8Å; L68-V72 WeakPolarHBondContact O-CB 3.27Å; L68-V72 PolarHBondContact O-N 3.26Å; V72-N74 PolarHBondContact O-N 3.07Å; V72-N74 VanDerWaalsContact O-N 3.11Å; V72-V78 HydrophobicContact CB-CG2 3.73Å; V72-V78 HydrophobicContact CG1-CG2 3.84Å; V72-V78 HydrophobicContact CG2-CG2 4.39Å
73	N	91.8	Very high	94.6	Very high	141 Å²	141	45.6 Å²	45.6	75%	0.754	23%	0.232	S	C	*	.	S	Bend	trans	-61	-25.2	-173.3	-66	-24.1	0	0	0	114.5
74	N	93.3	Very high	94.6	Very high	82 Å²	82	50 Å²	50	44%	0.439	26%	0.256	S	S	.	.			trans	-105.6	100.2	-174.6	-174.2	-23.7	0	0	0	111.4	V72 N76 K77 V78	V72-N74 PolarHBondContact O-N 3.07Å; V72-N74 VanDerWaalsContact O-N 3.11Å; N74-N76 VanDerWaalsContact C-N 3.33Å; N74-N76 PolarHBondContact O-N 3.35Å; N74-N76 WeakPolarHBondContact OD1-CB 3.39Å; N74-N76 PolarHBondContact OD1-N 3.39Å; N74-N76 VanDerWaalsContact OD1-N 3.07Å; N74-K77 HydrophobicContact CB-CB 3.81Å; N74-K77 WeakPolarHBondContact O-CB 3.19Å; N74-K77 PolarHBondContact O-N 2.71Å; N74-K77 PolarHBondContact OD1-N 2.75Å; N74-V78 WeakPolarHBondContact O-CG2 3.47Å; N74-V78 PolarHBondContact O-N 2.71Å
75	R	92.6	Very high	94.6	Very high	141 Å²	141	51 Å²	51	53%	0.532	26%	0.26	S	S	.	.	H	α-helix	trans	-59.8	-38.6	178.4	-65.8	-173.8	177.8	-165.7	-4.8	113.2	Y69 K77 V78 E79	Y69-R75 HydrophobicContact CD1-CB 4.29Å; Y69-R75 HydrophobicContact CD1-CG 3.88Å; Y69-R75 HydrophobicContact CE1-CB 4.29Å; Y69-R75 HydrophobicContact CE1-CG 4.3Å; Y69-R75 HydrophobicContact CG-CG 4.25Å; R75-K77 VanDerWaalsContact C-N 3.31Å; R75-K77 PolarHBondContact O-N 2.91Å; R75-V78 WeakPolarHBondContact O-CB 3.3Å; R75-V78 PolarHBondContact O-N 2.87Å; R75-V78 VanDerWaalsContact O-N 3.14Å; R75-E79 PolarHBondContact O-N 3.34Å
76	N	94	Very high	94.6	Very high	133 Å²	133	50.6 Å²	50.6	71%	0.711	26%	0.259	S	S	*	.	H	α-helix	trans	-65.7	-38	178.2	-64.7	-13.1	0	0	0	111.2	N74 V78 E79 S80	N74-N76 VanDerWaalsContact C-N 3.33Å; N74-N76 PolarHBondContact O-N 3.35Å; N74-N76 WeakPolarHBondContact OD1-CB 3.39Å; N74-N76 PolarHBondContact OD1-N 3.39Å; N74-N76 VanDerWaalsContact OD1-N 3.07Å; N76-V78 VanDerWaalsContact C-N 3.34Å; N76-E79 PolarHBondContact O-N 2.88Å; N76-S80 WeakPolarHBondContact O-CB 3.38Å; N76-S80 PolarHBondContact O-N 2.96Å
77	K	94	Very high	94.5	Very high	76 Å²	76	55 Å²	55	33%	0.33	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-41.8	172.4	-174.8	-178.1	-179.7	-178.1	0	110.9	E37 N74 R75 Q81	E37-K77 PolarHBondContact O-NZ 3.46Å; N74-K77 HydrophobicContact CB-CB 3.81Å; N74-K77 WeakPolarHBondContact O-CB 3.19Å; N74-K77 PolarHBondContact O-N 2.71Å; N74-K77 PolarHBondContact OD1-N 2.75Å; R75-K77 VanDerWaalsContact C-N 3.31Å; R75-K77 PolarHBondContact O-N 2.91Å; K77-Q81 HydrophobicContact CG-CG 4.24Å; K77-Q81 WeakPolarHBondContact O-CB 3.43Å; K77-Q81 VanDerWaalsContact O-CG 3.31Å; K77-Q81 WeakPolarHBondContact O-CG 3.46Å; K77-Q81 PolarHBondContact O-N 3.28Å
78	V	95.9	Very high	94.4	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-53.1	174.6	176.8	0	0	0	0	110.6	V39 L68 Y69 V72 N74 R75 N76 S80 Q81 L82	V39-V78 HydrophobicContact CG2-CB 4.41Å; V39-V78 HydrophobicContact CG2-CG2 4.02Å; L68-V78 HydrophobicContact CB-CG1 3.83Å; L68-V78 HydrophobicContact CB-CG2 4.41Å; L68-V78 HydrophobicContact CD1-CG1 4.08Å; Y69-V78 HydrophobicContact CD1-CB 4.16Å; Y69-V78 HydrophobicContact CD1-CG1 3.99Å; Y69-V78 HydrophobicContact CD1-CG2 4.29Å; Y69-V78 HydrophobicContact CE1-CB 4.02Å; Y69-V78 HydrophobicContact CE1-CG1 3.74Å; V72-V78 HydrophobicContact CB-CG2 3.73Å; V72-V78 HydrophobicContact CG1-CG2 3.84Å; V72-V78 HydrophobicContact CG2-CG2 4.39Å; N74-V78 WeakPolarHBondContact O-CG2 3.47Å; N74-V78 PolarHBondContact O-N 2.71Å; R75-V78 WeakPolarHBondContact O-CB 3.3Å; R75-V78 PolarHBondContact O-N 2.87Å; R75-V78 VanDerWaalsContact O-N 3.14Å; N76-V78 VanDerWaalsContact C-N 3.34Å; V78-S80 PolarHBondContact O-N 2.77Å; V78-Q81 PolarHBondContact O-N 3.07Å; V78-L82 HydrophobicContact CG1-CD1 3.8Å; V78-L82 HydrophobicContact CG1-CG 4.26Å; V78-L82 WeakPolarHBondContact O-CB 3.31Å; V78-L82 VanDerWaalsContact O-CG 3.24Å; V78-L82 WeakPolarHBondContact O-CG 3.43Å; V78-L82 PolarHBondContact O-N 3.38Å
79	E	94.5	Very high	94.2	Very high	76 Å²	76	62.1 Å²	62.1	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-60.1	-46.7	-179.5	-64.7	-49.7	106	0	0	112.4	K65 Y69 R75 N76 L82 S83	K65-E79 WeakPolarHBondContact CD-OE1 3.44Å; K65-E79 IonicContact NZ-OE1 3.72Å; K65-E79 PolarHBondContact NZ-OE1 3.34Å; K65-E79 IonicContact NZ-OE2 3.41Å; K65-E79 PolarHBondContact NZ-OE2 3.19Å; Y69-E79 VanDerWaalsContact CE1-OE1 3.31Å; Y69-E79 WeakPolarHBondContact CE1-OE1 3.3Å; Y69-E79 VanDerWaalsContact CZ-OE1 3.28Å; Y69-E79 VanDerWaalsContact OH-CD 3.27Å; Y69-E79 PolarHBondContact OH-OE1 3.41Å; R75-E79 PolarHBondContact O-N 3.34Å; N76-E79 PolarHBondContact O-N 2.88Å; E79-L82 PolarHBondContact O-N 2.8Å; E79-S83 WeakPolarHBondContact O-CB 3.2Å; E79-S83 PolarHBondContact O-N 3.15Å
80	S	95.3	Very high	94.2	Very high	67 Å²	67	66.2 Å²	66.2	47%	0.469	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-49.7	179.7	-171.7	0	0	0	0	111.5	N76 V78 L82 S83 D84	N76-S80 WeakPolarHBondContact O-CB 3.38Å; N76-S80 PolarHBondContact O-N 2.96Å; V78-S80 PolarHBondContact O-N 2.77Å; S80-L82 VanDerWaalsContact C-N 3.34Å; S80-L82 PolarHBondContact O-N 3.06Å; S80-S83 WeakPolarHBondContact O-CB 3.45Å; S80-S83 PolarHBondContact O-N 3.21Å; S80-D84 VanDerWaalsContact O-CG 3.26Å; S80-D84 PolarHBondContact O-N 2.87Å
81	Q	96.2	Very high	94.2	Very high	52 Å²	52	65.6 Å²	65.6	24%	0.243	34%	0.341	C	S	.	.	H	α-helix	trans	-68.1	-33.9	-177.9	-69.5	-166.9	-45.9	0	0	112.2	V39 K77 V78 D84 M85	V39-Q81 HydrophobicContact CB-CB 4.13Å; V39-Q81 HydrophobicContact CG1-CB 4.45Å; V39-Q81 HydrophobicContact CG2-CB 4.07Å; V39-Q81 HydrophobicContact CG2-CG 4.49Å; K77-Q81 HydrophobicContact CG-CG 4.24Å; K77-Q81 WeakPolarHBondContact O-CB 3.43Å; K77-Q81 VanDerWaalsContact O-CG 3.31Å; K77-Q81 WeakPolarHBondContact O-CG 3.46Å; K77-Q81 PolarHBondContact O-N 3.28Å; V78-Q81 PolarHBondContact O-N 3.07Å; Q81-D84 PolarHBondContact O-N 2.85Å; Q81-M85 WeakPolarHBondContact O-CB 3.28Å; Q81-M85 WeakPolarHBondContact O-CG 3.05Å; Q81-M85 PolarHBondContact O-N 3.4Å
82	L	95.2	Very high	94.2	Very high	4 Å²	4	66 Å²	66	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-66.3	-39.9	172.9	-69.9	179.5	0	0	0	111.7	V39 L43 K65 L68 V78 E79 S80 M85 Q86 I91 I106	V39-L82 HydrophobicContact CG1-CD2 4.13Å; L43-L82 HydrophobicContact CD1-CD2 4.38Å; K65-L82 HydrophobicContact CD-CD1 3.99Å; K65-L82 HydrophobicContact CG-CD1 3.91Å; L68-L82 HydrophobicContact CD1-CD1 3.89Å; L68-L82 HydrophobicContact CD1-CD2 3.88Å; L68-L82 HydrophobicContact CD1-CG 4.27Å; V78-L82 HydrophobicContact CG1-CD1 3.8Å; V78-L82 HydrophobicContact CG1-CG 4.26Å; V78-L82 WeakPolarHBondContact O-CB 3.31Å; V78-L82 VanDerWaalsContact O-CG 3.24Å; V78-L82 WeakPolarHBondContact O-CG 3.43Å; V78-L82 PolarHBondContact O-N 3.38Å; E79-L82 PolarHBondContact O-N 2.8Å; S80-L82 VanDerWaalsContact C-N 3.34Å; S80-L82 PolarHBondContact O-N 3.06Å; L82-M85 PolarHBondContact O-N 3.2Å; L82-Q86 VanDerWaalsContact O-CB 3.31Å; L82-Q86 WeakPolarHBondContact O-CB 3.44Å; L82-Q86 PolarHBondContact O-N 3.3Å; L82-I91 HydrophobicContact CB-CD1 4.34Å; L82-I91 HydrophobicContact CD2-CD1 3.55Å; L82-I106 HydrophobicContact CD1-CD1 3.94Å; L82-I106 HydrophobicContact CD2-CD1 3.84Å
83	S	93.2	Very high	94.1	Very high	62 Å²	62	66.7 Å²	66.7	43%	0.434	35%	0.346	S	S	.	.	H	α-helix	trans	-62.5	-42.5	174.7	-169.7	0	0	0	0	111.8	E79 S80 Q86 T87	E79-S83 WeakPolarHBondContact O-CB 3.2Å; E79-S83 PolarHBondContact O-N 3.15Å; S80-S83 WeakPolarHBondContact O-CB 3.45Å; S80-S83 PolarHBondContact O-N 3.21Å; S83-Q86 PolarHBondContact O-N 3.37Å; S83-T87 WeakPolarHBondContact O-CB 3.47Å; S83-T87 PolarHBondContact O-N 3.46Å; S83-T87 PolarHBondContact O-OG1 3.41Å
84	D	95	Very high	94.2	Very high	95 Å²	95	60 Å²	60	51%	0.508	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-42.5	175.3	-63.9	-27.9	0	0	0	111.7	S80 Q81 Q86 T87 S88	S80-D84 VanDerWaalsContact O-CG 3.26Å; S80-D84 PolarHBondContact O-N 2.87Å; Q81-D84 PolarHBondContact O-N 2.85Å; D84-Q86 VanDerWaalsContact C-N 3.35Å; D84-T87 PolarHBondContact O-N 3.13Å; D84-S88 VanDerWaalsContact O-CB 3.31Å; D84-S88 WeakPolarHBondContact O-CB 3.5Å; D84-S88 PolarHBondContact O-N 2.88Å; D84-S88 PolarHBondContact O-OG 3.32Å
85	M	95.2	Very high	94.2	Very high	21 Å²	21	57.3 Å²	57.3	10%	0.103	30%	0.295	C	S	.	.	H	α-helix	trans	-67.3	-34.4	177.5	-73.8	178.9	-171.5	0	0	112.7	V39 C40 L43 Q81 L82 S88 Q89 K90 I91	V39-M85 HydrophobicContact CB-CE 4.48Å; V39-M85 HydrophobicContact CG1-CE 4.24Å; C40-M85 HydrophobicContact CB-CE 4.44Å; C40-M85 WeakPolarHBondContact SG-CE 3.47Å; L43-M85 HydrophobicContact CD1-CE 4.23Å; L43-M85 HydrophobicContact CD1-SD 3.58Å; L43-M85 VanDerWaalsContact CD1-SD 3.58Å; Q81-M85 WeakPolarHBondContact O-CB 3.28Å; Q81-M85 WeakPolarHBondContact O-CG 3.05Å; Q81-M85 PolarHBondContact O-N 3.4Å; L82-M85 PolarHBondContact O-N 3.2Å; M85-S88 WeakPolarHBondContact CA-OG 3.46Å; M85-S88 PolarHBondContact O-OG 3.33Å; M85-Q89 PolarHBondContact O-N 3.26Å; M85-K90 HydrophobicContact CB-CB 4.34Å; M85-K90 PolarHBondContact O-N 3.01Å; M85-I91 HydrophobicContact CB-CD1 3.63Å; M85-I91 HydrophobicContact CB-CG1 3.72Å; M85-I91 HydrophobicContact CB-CG2 4.37Å; M85-I91 PolarHBondContact O-N 3.37Å; M85-I91 HydrophobicContact SD-CD1 4.42Å
86	Q	92.9	Very high	94	Very high	30 Å²	30	50.7 Å²	50.7	14%	0.14	27%	0.27	C	S	.	.	H	α-helix	trans	-69.7	-44	175.4	-177.3	175	29.9	0	0	110.9	L82 S83 D84 S88 Q89 I91 H139	L82-Q86 VanDerWaalsContact O-CB 3.31Å; L82-Q86 WeakPolarHBondContact O-CB 3.44Å; L82-Q86 PolarHBondContact O-N 3.3Å; S83-Q86 PolarHBondContact O-N 3.37Å; D84-Q86 VanDerWaalsContact C-N 3.35Å; Q86-S88 VanDerWaalsContact C-N 3.35Å; Q86-Q89 PolarHBondContact O-N 3.11Å; Q86-Q89 VanDerWaalsContact O-N 3.16Å; Q86-I91 HydrophobicContact CB-CG1 4.38Å; Q86-H139 HydrophobicContact CG-CB 3.99Å; Q86-H139 PolarHBondContact NE2-O 2.88Å
87	T	91.9	Very high	93	Very high	99 Å²	99	49.6 Å²	49.6	61%	0.607	26%	0.264	S	S	*	.	H	α-helix	trans	-66.7	-36.6	177.1	-54	0	0	0	0	111.9	S83 D84 Q89	S83-T87 WeakPolarHBondContact O-CB 3.47Å; S83-T87 PolarHBondContact O-N 3.46Å; S83-T87 PolarHBondContact O-OG1 3.41Å; D84-T87 PolarHBondContact O-N 3.13Å; T87-Q89 PolarHBondContact O-N 3.27Å
88	S	93.2	Very high	91.5	Very high	61 Å²	61	47.7 Å²	47.7	43%	0.427	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	12.3	174.3	60.4	0	0	0	0	114.1	D84 M85 Q86 K90	D84-S88 VanDerWaalsContact O-CB 3.31Å; D84-S88 WeakPolarHBondContact O-CB 3.5Å; D84-S88 PolarHBondContact O-N 2.88Å; D84-S88 PolarHBondContact O-OG 3.32Å; M85-S88 WeakPolarHBondContact CA-OG 3.46Å; M85-S88 PolarHBondContact O-OG 3.33Å; Q86-S88 VanDerWaalsContact C-N 3.35Å; S88-K90 PolarHBondContact O-N 3.48Å; S88-K90 VanDerWaalsContact O-N 3.14Å
89	Q	92.2	Very high	89.6	Confident	89 Å²	89	56.6 Å²	56.6	42%	0.416	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	23.9	174	-56	175.2	-21.9	0	0	114.5	M85 Q86 T87 S109 Q136	M85-Q89 PolarHBondContact O-N 3.26Å; Q86-Q89 PolarHBondContact O-N 3.11Å; Q86-Q89 VanDerWaalsContact O-N 3.16Å; T87-Q89 PolarHBondContact O-N 3.27Å; Q89-S109 VanDerWaalsContact C-OG 3.24Å; Q89-S109 WeakPolarHBondContact O-CB 3.4Å; Q89-S109 PolarHBondContact O-OG 2.92Å; Q89-Q136 PolarHBondContact NE2-O 2.48Å
90	K	94.5	Very high	87.5	Confident	136 Å²	136	59.9 Å²	59.9	59%	0.591	32%	0.318	S	S	*	.	S	Bend	trans	-84	-32	178.2	-65.3	-177.6	-179.3	178.9	0	112.6	M85 S88 S109	M85-K90 HydrophobicContact CB-CB 4.34Å; M85-K90 PolarHBondContact O-N 3.01Å; S88-K90 PolarHBondContact O-N 3.48Å; S88-K90 VanDerWaalsContact O-N 3.14Å; K90-S109 PolarHBondContact O-N 3.26Å; K90-S109 PolarHBondContact O-OG 2.99Å
91	I	95.5	Very high	85.4	Confident	9 Å²	9	59.8 Å²	59.8	5%	0.046	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.1	-178.6	67.8	178.4	0	0	0	112	L82 M85 Q86 L93 I106 M107 S109	L82-I91 HydrophobicContact CB-CD1 4.34Å; L82-I91 HydrophobicContact CD2-CD1 3.55Å; M85-I91 HydrophobicContact CB-CD1 3.63Å; M85-I91 HydrophobicContact CB-CG1 3.72Å; M85-I91 HydrophobicContact CB-CG2 4.37Å; M85-I91 PolarHBondContact O-N 3.37Å; M85-I91 HydrophobicContact SD-CD1 4.42Å; Q86-I91 HydrophobicContact CB-CG1 4.38Å; I91-L93 HydrophobicContact CD1-CD2 4.04Å; I91-I106 HydrophobicContact CB-CG2 3.99Å; I91-I106 HydrophobicContact CD1-CG2 3.96Å; I91-I106 HydrophobicContact CG1-CG2 4.48Å; I91-I106 HydrophobicContact CG2-CG2 4.11Å; I91-M107 CarbonylContact C-O 3.42Å; I91-M107 WeakPolarHBondContact CA-O 3.3Å; I91-M107 WeakPolarHBondContact CB-O 3.15Å; I91-S109 PolarHBondContact N-OG 3.35Å
92	R	95	Very high	83.9	Confident	7 Å²	7	64.2 Å²	64.2	3%	0.026	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.6	166	-179.6	49.2	165.1	-116	31.9	109.8	L94 M107 F112 T134 Y138 Y140	R92-L94 HydrophobicContact CG-CD2 3.91Å; R92-L94 HydrophobicContact CG-CG 4.4Å; R92-M107 PolarHBondContact N-O 2.9Å; R92-M107 PolarHBondContact O-N 3.16Å; R92-F112 HydrophobicContact CB-CB 4.11Å; R92-F112 HydrophobicContact CB-CD1 4.48Å; R92-F112 HydrophobicContact CB-CD2 4.29Å; R92-F112 HydrophobicContact CB-CG 4.03Å; R92-F112 HydrophobicContact CG-CD1 4.31Å; R92-F112 HydrophobicContact CG-CD2 3.8Å; R92-F112 HydrophobicContact CG-CE1 4.5Å; R92-F112 HydrophobicContact CG-CE2 4.01Å; R92-F112 HydrophobicContact CG-CG 3.95Å; R92-F112 HydrophobicContact CG-CZ 4.35Å; R92-T134 VanDerWaalsContact NH1-CB 3.3Å; R92-T134 PolarHBondContact NH1-O 3.24Å; R92-Y138 PolarHBondContact NH2-O 2.95Å; R92-Y140 PolarHBondContact NH2-O 2.9Å; R92-Y140 VanDerWaalsContact NH2-O 3.07Å
93	L	94.8	Very high	83.2	Confident	20 Å²	20	64.2 Å²	64.2	11%	0.105	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	141.7	167.4	-54.8	-174.6	0	0	0	110.2	I91 V104 G105 I106 L141	I91-L93 HydrophobicContact CD1-CD2 4.04Å; L93-V104 HydrophobicContact CB-CG1 3.91Å; L93-V104 HydrophobicContact CD1-CG1 4.32Å; L93-V104 HydrophobicContact CD2-CG1 4.02Å; L93-V104 HydrophobicContact CG-CG1 4.31Å; L93-G105 CarbonylContact C-O 3.58Å; L93-G105 VanDerWaalsContact CA-O 3.29Å; L93-G105 WeakPolarHBondContact CA-O 3.24Å; L93-I106 HydrophobicContact CD2-CG1 3.8Å; L93-I106 HydrophobicContact CD2-CG2 4.46Å; L93-L141 VanDerWaalsContact C-CD2 3.44Å; L93-L141 HydrophobicContact CB-CD2 3.56Å; L93-L141 WeakPolarHBondContact O-CD2 3.33Å
94	L	94.4	Very high	83.2	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.2	-179.6	-61.6	177.2	0	0	0	110.2	R92 I96 G105 M107 F112 I176 T178 L181	R92-L94 HydrophobicContact CG-CD2 3.91Å; R92-L94 HydrophobicContact CG-CG 4.4Å; L94-I96 PolarHBondContact O-N 2.64Å; L94-G105 PolarHBondContact N-O 2.94Å; L94-G105 PolarHBondContact O-N 2.83Å; L94-M107 HydrophobicContact CD1-CG 3.86Å; L94-M107 HydrophobicContact CD1-SD 3.44Å; L94-M107 WeakPolarHBondContact CD1-SD 3.25Å; L94-F112 HydrophobicContact CD2-CD2 4.36Å; L94-F112 HydrophobicContact CD2-CE2 4.13Å; L94-I176 WeakPolarHBondContact CD2-O 3.41Å; L94-T178 HydrophobicContact CD1-CG2 3.84Å; L94-L181 HydrophobicContact CD1-CD1 4.46Å
95	N	92.4	Very high	83.2	Confident	26 Å²	26	57.5 Å²	57.5	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	115.3	172.8	-172.4	76.6	0	0	0	109.9	D97 Y175	N95-D97 PolarHBondContact O-N 3.17Å; N95-Y175 HydrophobicContact CB-CD1 3.6Å; N95-Y175 HydrophobicContact CB-CD2 4.36Å; N95-Y175 HydrophobicContact CB-CE1 3.96Å; N95-Y175 HydrophobicContact CB-CG 3.83Å
96	I	88.1	Confident	83.2	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.293	C	S	.	.			trans	-91.7	96.8	168.8	-48.7	-52.4	0	0	0	104.8	I62 L64 L94 D98 S103 L181 F184 I185	I62-I96 HydrophobicContact CG2-CD1 4.45Å; L64-I96 HydrophobicContact CD2-CG1 3.91Å; L94-I96 PolarHBondContact O-N 2.64Å; I96-D98 VanDerWaalsContact C-N 3.31Å; I96-D98 PolarHBondContact O-N 2.85Å; I96-S103 WeakPolarHBondContact CA-O 3.3Å; I96-S103 WeakPolarHBondContact CB-O 3.2Å; I96-S103 WeakPolarHBondContact CG1-O 3.24Å; I96-S103 PolarHBondContact N-O 3.24Å; I96-L181 HydrophobicContact CD1-CD1 3.5Å; I96-F184 HydrophobicContact CD1-CD1 4.34Å; I96-F184 HydrophobicContact CD1-CE1 3.97Å; I96-I185 HydrophobicContact CG2-CD1 4.17Å; I96-I185 HydrophobicContact CG2-CG1 3.86Å
97	D	74	Confident	83.3	Confident	110 Å²	110	55.2 Å²	55.2	59%	0.588	29%	0.287	S	S	*	.			trans	-58	92.9	178.4	179.1	32.5	0	0	0	110.6	N95 K189	N95-D97 PolarHBondContact O-N 3.17Å; D97-K189 PolarHBondContact O-NZ 3.32Å
98	D	62.5	Low	83.5	Confident	36 Å²	36	53.5 Å²	53.5	19%	0.193	27%	0.271	C	S	.	.			trans	-119.1	130.8	172.2	-159.1	18.2	0	0	0	109.4	I96 I100 K189	I96-D98 VanDerWaalsContact C-N 3.31Å; I96-D98 PolarHBondContact O-N 2.85Å; D98-I100 PolarHBondContact O-N 2.7Å; D98-I100 VanDerWaalsContact O-N 3.09Å; D98-K189 VanDerWaalsContact OD1-CE 3.25Å; D98-K189 WeakPolarHBondContact OD1-CE 3.39Å; D98-K189 IonicContact OD1-NZ 3Å; D98-K189 PolarHBondContact OD1-NZ 3.13Å
99	Q	56.4	Low	83.5	Confident	188 Å²	188	51 Å²	51	88%	0.879	25%	0.254	S	S	*	.	S	Bend	trans	-70.5	-7.3	-176.7	-65	178.1	-3	0	0	112.2
100	I	49	Very low	83.6	Confident	145 Å²	145	52.7 Å²	52.7	74%	0.744	27%	0.266	S	S	*	.	S	Bend	trans	-111.8	-28	-167	-54	175.7	0	0	0	111.4	D98	D98-I100 PolarHBondContact O-N 2.7Å; D98-I100 VanDerWaalsContact O-N 3.09Å
101	D	51.7	Low	83.5	Confident	65 Å²	65	47.8 Å²	47.8	35%	0.348	25%	0.246	S	C	.	.	S	Bend	trans	-149.5	148.6	-176.6	-170.7	9.8	0	0	0	109.8	S103	D101-S103 PolarHBondContact O-N 2.92Å
102	D	63.9	Low	83.5	Confident	145 Å²	145	47.4 Å²	47.4	78%	0.775	24%	0.244	S	C	*	.			trans	-69.4	59.3	167.3	-73	-33.8	0	0	0	109	V104	D102-V104 PolarHBondContact O-N 3.45Å
103	S	81.9	Confident	83.4	Confident	4 Å²	4	48.2 Å²	48.2	3%	0.028	25%	0.25	C	C	.	.			trans	-67.4	108.9	-174.2	-80.3	0	0	0	0	109.2	I96 D101	I96-S103 WeakPolarHBondContact CA-O 3.3Å; I96-S103 WeakPolarHBondContact CB-O 3.2Å; I96-S103 WeakPolarHBondContact CG1-O 3.24Å; I96-S103 PolarHBondContact N-O 3.24Å; D101-S103 PolarHBondContact O-N 2.92Å
104	V	92.4	Very high	83.2	Confident	16 Å²	16	49.4 Å²	49.4	10%	0.097	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.9	174.6	177.9	0	0	0	0	109.4	K65 L93 D102	K65-V104 HydrophobicContact CB-CB 4.03Å; K65-V104 WeakPolarHBondContact CB-O 3.31Å; K65-V104 HydrophobicContact CD-CB 4.21Å; K65-V104 PolarHBondContact N-O 3.48Å; L93-V104 HydrophobicContact CB-CG1 3.91Å; L93-V104 HydrophobicContact CD1-CG1 4.32Å; L93-V104 HydrophobicContact CD2-CG1 4.02Å; L93-V104 HydrophobicContact CG-CG1 4.31Å; D102-V104 PolarHBondContact O-N 3.45Å
105	G	94.7	Very high	83	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	152.2	170.2	0	0	0	0	0	110.9	V63 L93 L94	V63-G105 CarbonylContact O-C 3.53Å; V63-G105 WeakPolarHBondContact O-CA 3.28Å; L93-G105 CarbonylContact C-O 3.58Å; L93-G105 VanDerWaalsContact CA-O 3.29Å; L93-G105 WeakPolarHBondContact CA-O 3.24Å; L94-G105 PolarHBondContact N-O 2.94Å; L94-G105 PolarHBondContact O-N 2.83Å
106	I	95.6	Very high	82.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	124.5	-176.7	-53	169.7	0	0	0	107.4	L43 F47 V63 K65 L68 L82 I91 L93	L43-I106 HydrophobicContact CD2-CD1 4.26Å; L43-I106 HydrophobicContact CD2-CG2 4.1Å; F47-I106 HydrophobicContact CZ-CG2 4.5Å; V63-I106 HydrophobicContact CB-CB 4.41Å; V63-I106 PolarHBondContact N-O 3.19Å; V63-I106 PolarHBondContact O-N 2.62Å; K65-I106 HydrophobicContact CB-CD1 4.37Å; L68-I106 HydrophobicContact CD1-CD1 3.46Å; L68-I106 VanDerWaalsContact CD1-CD1 3.46Å; L82-I106 HydrophobicContact CD1-CD1 3.94Å; L82-I106 HydrophobicContact CD2-CD1 3.84Å; I91-I106 HydrophobicContact CB-CG2 3.99Å; I91-I106 HydrophobicContact CD1-CG2 3.96Å; I91-I106 HydrophobicContact CG1-CG2 4.48Å; I91-I106 HydrophobicContact CG2-CG2 4.11Å; L93-I106 HydrophobicContact CD2-CG1 3.8Å; L93-I106 HydrophobicContact CD2-CG2 4.46Å
107	M	95.6	Very high	82.8	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	150.1	170.6	-68.2	-174.7	73.1	0	0	109.8	R60 I62 I91 R92 L94 D111 F112 T178	R60-M107 HydrophobicContact CB-CE 3.83Å; I62-M107 HydrophobicContact CB-CG 4.44Å; I62-M107 HydrophobicContact CD1-SD 4.28Å; I62-M107 HydrophobicContact CG1-CE 4.42Å; I62-M107 HydrophobicContact CG1-CG 3.58Å; I62-M107 HydrophobicContact CG1-SD 3.8Å; I91-M107 CarbonylContact C-O 3.42Å; I91-M107 WeakPolarHBondContact CA-O 3.3Å; I91-M107 WeakPolarHBondContact CB-O 3.15Å; R92-M107 PolarHBondContact N-O 2.9Å; R92-M107 PolarHBondContact O-N 3.16Å; L94-M107 HydrophobicContact CD1-CG 3.86Å; L94-M107 HydrophobicContact CD1-SD 3.44Å; L94-M107 WeakPolarHBondContact CD1-SD 3.25Å; M107-D111 HydrophobicContact CE-CB 4.16Å; M107-F112 HydrophobicContact CB-CB 4.36Å; M107-F112 HydrophobicContact SD-CD2 4.42Å; M107-T178 HydrophobicContact SD-CG2 3.75Å
108	K	95.3	Very high	83	Confident	63 Å²	63	53.9 Å²	53.9	27%	0.274	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	140.8	161.7	-64.3	-173.6	177	-170.6	0	108.3	E44 F47 D110 D111 F112	E44-K108 VanDerWaalsContact CD-NZ 3.33Å; E44-K108 IonicContact OE1-NZ 3.24Å; E44-K108 PolarHBondContact OE1-NZ 2.86Å; E44-K108 IonicContact OE2-NZ 2.9Å; E44-K108 PolarHBondContact OE2-NZ 3.45Å; F47-K108 HydrophobicContact CD2-CD 4.38Å; F47-K108 HydrophobicContact CD2-CG 4.23Å; F47-K108 HydrophobicContact CE1-CG 4.34Å; F47-K108 HydrophobicContact CE2-CD 4.35Å; F47-K108 HydrophobicContact CE2-CG 3.72Å; F47-K108 HydrophobicContact CZ-CG 3.79Å; K108-D110 VanDerWaalsContact C-N 3.26Å; K108-D110 PolarHBondContact O-N 2.91Å; K108-D111 HydrophobicContact CB-CB 4.23Å; K108-D111 WeakPolarHBondContact O-CB 3.41Å; K108-D111 PolarHBondContact O-N 2.86Å; K108-D111 VanDerWaalsContact O-N 3.09Å; K108-F112 PolarHBondContact O-N 2.91Å
109	S	94.6	Very high	83.4	Confident	10 Å²	10	56.2 Å²	56.2	7%	0.07	28%	0.277	C	S	.	.	H	α-helix	trans	-59.2	-39.5	-178.1	-64.3	0	0	0	0	112.5	Q89 K90 I91 D111 F112 V113	Q89-S109 VanDerWaalsContact C-OG 3.24Å; Q89-S109 WeakPolarHBondContact O-CB 3.4Å; Q89-S109 PolarHBondContact O-OG 2.92Å; K90-S109 PolarHBondContact O-N 3.26Å; K90-S109 PolarHBondContact O-OG 2.99Å; I91-S109 PolarHBondContact N-OG 3.35Å; S109-D111 VanDerWaalsContact C-N 3.32Å; S109-D111 PolarHBondContact O-N 2.83Å; S109-F112 WeakPolarHBondContact O-CB 3.34Å; S109-F112 PolarHBondContact O-N 3.29Å; S109-V113 WeakPolarHBondContact O-CG2 3.39Å; S109-V113 PolarHBondContact O-N 3.49Å
110	D	93.6	Very high	83.7	Confident	124 Å²	124	50.7 Å²	50.7	66%	0.663	26%	0.259	S	S	*	.	H	α-helix	trans	-62.8	-40.9	176.2	-66.5	-23.2	0	0	0	111.6	K108 F112 V113 N114	K108-D110 VanDerWaalsContact C-N 3.26Å; K108-D110 PolarHBondContact O-N 2.91Å; D110-F112 VanDerWaalsContact C-N 3.34Å; D110-V113 PolarHBondContact O-N 3.49Å; D110-N114 WeakPolarHBondContact O-CB 3.22Å; D110-N114 PolarHBondContact O-N 3.15Å; D110-N114 PolarHBondContact O-ND2 3.32Å
111	D	93.3	Very high	84.4	Confident	33 Å²	33	49.4 Å²	49.4	18%	0.176	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-38.5	175.4	-80.8	-40.9	0	0	0	111.6	R60 M107 K108 S109 S115	R60-D111 HydrophobicContact CB-CB 4.05Å; R60-D111 WeakPolarHBondContact CD-O 3.46Å; R60-D111 IonicContact NH1-OD1 2.87Å; R60-D111 PolarHBondContact NH1-OD1 3.3Å; M107-D111 HydrophobicContact CE-CB 4.16Å; K108-D111 HydrophobicContact CB-CB 4.23Å; K108-D111 WeakPolarHBondContact O-CB 3.41Å; K108-D111 PolarHBondContact O-N 2.86Å; K108-D111 VanDerWaalsContact O-N 3.09Å; S109-D111 VanDerWaalsContact C-N 3.32Å; S109-D111 PolarHBondContact O-N 2.83Å; D111-S115 WeakPolarHBondContact O-CB 3.45Å; D111-S115 PolarHBondContact O-N 3.16Å
112	F	93.8	Very high	85.4	Confident	1 Å²	1	53.5 Å²	53.5	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-51	174.2	173.7	-98.1	0	0	0	111.3	R92 L94 M107 K108 S109 D110 N114 S115 F116 F130 T134 I176 S177	R92-F112 HydrophobicContact CB-CB 4.11Å; R92-F112 HydrophobicContact CB-CD1 4.48Å; R92-F112 HydrophobicContact CB-CD2 4.29Å; R92-F112 HydrophobicContact CB-CG 4.03Å; R92-F112 HydrophobicContact CG-CD1 4.31Å; R92-F112 HydrophobicContact CG-CD2 3.8Å; R92-F112 HydrophobicContact CG-CE1 4.5Å; R92-F112 HydrophobicContact CG-CE2 4.01Å; R92-F112 HydrophobicContact CG-CG 3.95Å; R92-F112 HydrophobicContact CG-CZ 4.35Å; L94-F112 HydrophobicContact CD2-CD2 4.36Å; L94-F112 HydrophobicContact CD2-CE2 4.13Å; M107-F112 HydrophobicContact CB-CB 4.36Å; M107-F112 HydrophobicContact SD-CD2 4.42Å; K108-F112 PolarHBondContact O-N 2.91Å; S109-F112 WeakPolarHBondContact O-CB 3.34Å; S109-F112 PolarHBondContact O-N 3.29Å; D110-F112 VanDerWaalsContact C-N 3.34Å; F112-N114 PolarHBondContact O-N 2.91Å; F112-S115 WeakPolarHBondContact O-CB 3.31Å; F112-S115 PolarHBondContact O-N 3.49Å; F112-S115 PolarHBondContact O-OG 3.45Å; F112-F116 HydrophobicContact CD1-CE2 4.17Å; F112-F116 HydrophobicContact CD2-CE2 4.13Å; F112-F116 AromaticContact CE1-CE2 3.76Å; F112-F116 HydrophobicContact CE1-CE2 3.76Å; F112-F116 HydrophobicContact CE1-CZ 4.44Å; F112-F116 AromaticContact CE2-CE2 3.73Å; F112-F116 HydrophobicContact CE2-CE2 3.73Å; F112-F116 AromaticContact CE2-CZ 3.89Å; F112-F116 HydrophobicContact CE2-CZ 3.89Å; F112-F116 HydrophobicContact CG-CE2 4.35Å; F112-F116 AromaticContact CZ-CE2 3.53Å; F112-F116 HydrophobicContact CZ-CE2 3.53Å; F112-F116 AromaticContact CZ-CZ 3.79Å; F112-F116 HydrophobicContact CZ-CZ 3.79Å; F112-F116 WeakPolarHBondContact O-CD2 3.48Å; F112-F116 VanDerWaalsContact O-CE2 3.3Å; F112-F116 WeakPolarHBondContact O-CE2 3.47Å; F112-F130 HydrophobicContact CZ-CE1 4.43Å; F112-T134 VanDerWaalsContact CE1-OG1 3.28Å; F112-T134 WeakPolarHBondContact CE1-OG1 3.37Å; F112-I176 HydrophobicContact CE2-CG2 4.37Å; F112-I176 HydrophobicContact CZ-CG2 4Å; F112-S177 WeakPolarHBondContact CE2-O 3.25Å
113	V	92.7	Very high	85.9	Confident	24 Å²	24	48.7 Å²	48.7	15%	0.145	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-46.5	178.6	173.3	0	0	0	0	111.3	S109 D110 S115 F116 A131	S109-V113 WeakPolarHBondContact O-CG2 3.39Å; S109-V113 PolarHBondContact O-N 3.49Å; D110-V113 PolarHBondContact O-N 3.49Å; V113-S115 PolarHBondContact O-N 2.91Å; V113-F116 PolarHBondContact O-N 3.31Å; V113-A131 HydrophobicContact CG1-CB 4.25Å; V113-A131 HydrophobicContact CG2-CB 4.39Å
114	N	90.8	Very high	85.9	Confident	45 Å²	45	50.7 Å²	50.7	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-68.9	-21.6	-179.1	-68.6	-43.6	0	0	0	112.8	R60 D110 F112 F116 R117 D118	R60-N114 VanDerWaalsContact NE-C 3.3Å; R60-N114 PolarHBondContact NE-O 3.02Å; D110-N114 WeakPolarHBondContact O-CB 3.22Å; D110-N114 PolarHBondContact O-N 3.15Å; D110-N114 PolarHBondContact O-ND2 3.32Å; F112-N114 PolarHBondContact O-N 2.91Å; N114-F116 PolarHBondContact O-N 3.38Å; N114-R117 PolarHBondContact O-N 2.99Å; N114-R117 VanDerWaalsContact O-N 3.07Å; N114-R117 PolarHBondContact OD1-NH1 3.15Å; N114-D118 PolarHBondContact O-N 3.19Å
115	S	90.6	Very high	85.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-25.6	175.3	76.4	0	0	0	0	113.6	D111 F112 V113 T178	D111-S115 WeakPolarHBondContact O-CB 3.45Å; D111-S115 PolarHBondContact O-N 3.16Å; F112-S115 WeakPolarHBondContact O-CB 3.31Å; F112-S115 PolarHBondContact O-N 3.49Å; F112-S115 PolarHBondContact O-OG 3.45Å; V113-S115 PolarHBondContact O-N 2.91Å; S115-T178 VanDerWaalsContact CB-OG1 3.24Å; S115-T178 WeakPolarHBondContact CB-OG1 3.48Å; S115-T178 PolarHBondContact OG-OG1 2.98Å
116	F	90.1	Very high	85.7	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.035	31%	0.306	C	S	.	.	H	α-helix	trans	-84	-22.7	176.9	-62.8	-77.7	0	0	0	113	F112 V113 N114 D118 L127 F130 A131 A165 S177 P179	F112-F116 HydrophobicContact CD1-CE2 4.17Å; F112-F116 HydrophobicContact CD2-CE2 4.13Å; F112-F116 AromaticContact CE1-CE2 3.76Å; F112-F116 HydrophobicContact CE1-CE2 3.76Å; F112-F116 HydrophobicContact CE1-CZ 4.44Å; F112-F116 AromaticContact CE2-CE2 3.73Å; F112-F116 HydrophobicContact CE2-CE2 3.73Å; F112-F116 AromaticContact CE2-CZ 3.89Å; F112-F116 HydrophobicContact CE2-CZ 3.89Å; F112-F116 HydrophobicContact CG-CE2 4.35Å; F112-F116 AromaticContact CZ-CE2 3.53Å; F112-F116 HydrophobicContact CZ-CE2 3.53Å; F112-F116 AromaticContact CZ-CZ 3.79Å; F112-F116 HydrophobicContact CZ-CZ 3.79Å; F112-F116 WeakPolarHBondContact O-CD2 3.48Å; F112-F116 VanDerWaalsContact O-CE2 3.3Å; F112-F116 WeakPolarHBondContact O-CE2 3.47Å; V113-F116 PolarHBondContact O-N 3.31Å; N114-F116 PolarHBondContact O-N 3.38Å; F116-D118 VanDerWaalsContact C-N 3.28Å; F116-L127 HydrophobicContact CB-CB 4.21Å; F116-L127 HydrophobicContact CD1-CB 4.29Å; F116-L127 HydrophobicContact CD1-CD2 4.12Å; F116-F130 HydrophobicContact CE1-CD1 4.17Å; F116-F130 HydrophobicContact CE1-CE1 4.3Å; F116-F130 AromaticContact CZ-CD1 3.99Å; F116-F130 HydrophobicContact CZ-CD1 3.99Å; F116-F130 AromaticContact CZ-CE1 3.91Å; F116-F130 HydrophobicContact CZ-CE1 3.91Å; F116-A131 HydrophobicContact CD2-CB 3.7Å; F116-A131 HydrophobicContact CE2-CB 4.2Å; F116-A131 HydrophobicContact CG-CB 4.32Å; F116-A165 HydrophobicContact CD1-CB 4.48Å; F116-A165 HydrophobicContact CE1-CB 3.58Å; F116-A165 HydrophobicContact CZ-CB 4.31Å; F116-S177 WeakPolarHBondContact CZ-O 3.42Å; F116-P179 HydrophobicContact CD1-CG 3.84Å; F116-P179 HydrophobicContact CE1-CG 3.97Å
117	R	85.7	Confident	85.6	Confident	149 Å²	149	59.5 Å²	59.5	56%	0.562	31%	0.306	S	S	*	.	H	α-helix	trans	-77.8	-16.1	176.9	-64.1	179.4	173.6	156.2	-5.8	112.9	N114 F119 E128	N114-R117 PolarHBondContact O-N 2.99Å; N114-R117 VanDerWaalsContact O-N 3.07Å; N114-R117 PolarHBondContact OD1-NH1 3.15Å; R117-F119 PolarHBondContact O-N 3.12Å; R117-E128 IonicContact NH2-OE1 3.91Å
118	D	78.7	Confident	85.3	Confident	73 Å²	73	63.4 Å²	63.4	39%	0.39	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-9.5	179.6	-58.4	-34	0	0	0	112.5	R60 N114 F116 Y180	R60-D118 IonicContact CZ-OD1 3.15Å; R60-D118 IonicContact CZ-OD2 2.91Å; R60-D118 IonicContact NE-OD2 3.48Å; R60-D118 PolarHBondContact NE-OD2 2.84Å; R60-D118 IonicContact NH2-OD1 2.9Å; R60-D118 PolarHBondContact NH2-OD1 2.84Å; R60-D118 IonicContact NH2-OD2 2.97Å; R60-D118 PolarHBondContact NH2-OD2 3.18Å; R60-D118 VanDerWaalsContact NH2-OD2 3.15Å; N114-D118 PolarHBondContact O-N 3.19Å; F116-D118 VanDerWaalsContact C-N 3.28Å; D118-Y180 HydrophobicContact CB-CE2 4.1Å; D118-Y180 WeakPolarHBondContact CB-OH 3.39Å
119	F	71.4	Confident	85.2	Confident	85 Å²	85	65.1 Å²	65.1	37%	0.373	33%	0.329	S	S	.	.	S	Bend	trans	-112.1	165.3	-179.1	-68.2	-90	0	0	0	113.6	R117 P179 Y180	R117-F119 PolarHBondContact O-N 3.12Å; F119-P179 HydrophobicContact CD2-CB 3.78Å; F119-P179 HydrophobicContact CD2-CG 4Å; F119-P179 HydrophobicContact CE2-CB 3.32Å; F119-P179 HydrophobicContact CE2-CG 3.99Å; F119-P179 HydrophobicContact CZ-CB 3.83Å; F119-Y180 HydrophobicContact CD2-CE2 4.37Å; F119-Y180 HydrophobicContact CE2-CD1 4.3Å; F119-Y180 HydrophobicContact CE2-CD2 4.04Å; F119-Y180 AromaticContact CE2-CE1 3.7Å; F119-Y180 HydrophobicContact CE2-CE1 3.7Å; F119-Y180 AromaticContact CE2-CE2 3.44Å; F119-Y180 HydrophobicContact CE2-CE2 3.44Å; F119-Y180 VanDerWaalsContact CE2-CE2 3.44Å; F119-Y180 HydrophobicContact CE2-CG 4.44Å; F119-Y180 AromaticContact CE2-CZ 3.22Å; F119-Y180 WeakPolarHBondContact CE2-OH 3.31Å; F119-Y180 HydrophobicContact CZ-CD1 4.07Å; F119-Y180 AromaticContact CZ-CE1 3.48Å; F119-Y180 HydrophobicContact CZ-CE1 3.48Å; F119-Y180 VanDerWaalsContact CZ-CE1 3.48Å; F119-Y180 HydrophobicContact CZ-CE2 4.13Å; F119-Y180 AromaticContact CZ-CZ 3.51Å
120	S	63.2	Low	85.3	Confident	73 Å²	73	64.6 Å²	64.6	51%	0.51	33%	0.326	S	S	.	.			trans	-57	156.3	-159.8	54.1	0	0	0	0	117.3	D122	S120-D122 PolarHBondContact O-N 2.82Å
121	V	63.6	Low	85.3	Confident	118 Å²	118	58.8 Å²	58.8	72%	0.715	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-61.9	-33.6	-170.9	-176.5	0	0	0	0	114.3	D123 S124	V121-D123 PolarHBondContact O-N 3.1Å; V121-S124 VanDerWaalsContact O-CB 3.31Å; V121-S124 WeakPolarHBondContact O-CB 3.45Å; V121-S124 PolarHBondContact O-N 3.15Å; V121-S124 PolarHBondContact O-OG 2.9Å
122	D	71.1	Confident	85.2	Confident	150 Å²	150	61.5 Å²	61.5	80%	0.802	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-64.7	-38.7	-166.8	-62	-27.7	0	0	0	113.3	S120	S120-D122 PolarHBondContact O-N 2.82Å
123	D	74.6	Confident	85.2	Confident	44 Å²	44	62.2 Å²	62.2	24%	0.235	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-103.6	6.2	179.2	-67.3	-32.2	0	0	0	113.6	V121 K125 I126 L127 I159 N163	V121-D123 PolarHBondContact O-N 3.1Å; D123-K125 VanDerWaalsContact C-N 3.27Å; D123-K125 PolarHBondContact O-N 2.87Å; D123-K125 VanDerWaalsContact O-N 3.12Å; D123-I126 PolarHBondContact O-N 2.95Å; D123-L127 HydrophobicContact CB-CD1 4.41Å; D123-L127 PolarHBondContact O-N 3.47Å; D123-I159 HydrophobicContact CB-CG2 3.97Å; D123-N163 PolarHBondContact OD2-ND2 3.5Å
124	S	82.3	Confident	85.3	Confident	47 Å²	47	61 Å²	61	33%	0.329	30%	0.302	S	S	.	.	H	α-helix	trans	-52.5	-40.7	-170.8	57.1	0	0	0	0	113.6	V121 I126 L127 E128	V121-S124 VanDerWaalsContact O-CB 3.31Å; V121-S124 WeakPolarHBondContact O-CB 3.45Å; V121-S124 PolarHBondContact O-N 3.15Å; V121-S124 PolarHBondContact O-OG 2.9Å; S124-I126 PolarHBondContact O-N 2.89Å; S124-L127 PolarHBondContact O-N 2.9Å; S124-E128 VanDerWaalsContact O-CB 3.24Å; S124-E128 WeakPolarHBondContact O-CB 3.35Å; S124-E128 PolarHBondContact O-N 3.24Å
125	K	89.4	Confident	85.2	Confident	173 Å²	173	59.8 Å²	59.8	75%	0.752	30%	0.297	S	S	*	.	H	α-helix	trans	-65.9	-38.4	-179	-66	-178.8	-178.8	176.5	0	113.2	D123 R129	D123-K125 VanDerWaalsContact C-N 3.27Å; D123-K125 PolarHBondContact O-N 2.87Å; D123-K125 VanDerWaalsContact O-N 3.12Å; K125-R129 VanDerWaalsContact O-CB 3.3Å; K125-R129 WeakPolarHBondContact O-CB 3.32Å; K125-R129 PolarHBondContact O-N 3.02Å
126	I	93.1	Very high	85.1	Confident	26 Å²	26	65 Å²	65	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-71.1	-44.1	-179.3	-62.6	165.2	0	0	0	109	D123 S124 R129 F130 E156 I159 L160	D123-I126 PolarHBondContact O-N 2.95Å; S124-I126 PolarHBondContact O-N 2.89Å; I126-R129 PolarHBondContact O-N 3.24Å; I126-F130 WeakPolarHBondContact O-CB 3.4Å; I126-F130 PolarHBondContact O-N 2.99Å; I126-E156 HydrophobicContact CD1-CG 4.01Å; I126-E156 HydrophobicContact CG1-CG 4.27Å; I126-E156 HydrophobicContact CG2-CB 4.17Å; I126-E156 HydrophobicContact CG2-CG 4.32Å; I126-I159 HydrophobicContact CD1-CD1 3.63Å; I126-I159 HydrophobicContact CD1-CG2 4.26Å; I126-L160 HydrophobicContact CG2-CD2 4.05Å; I126-L160 HydrophobicContact CG2-CG 4.26Å
127	L	93.2	Very high	85	Confident	2 Å²	2	72 Å²	72	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-39.6	178.2	-64.4	173.1	0	0	0	112.3	F116 D123 S124 F130 A131 L160 N163 A165	F116-L127 HydrophobicContact CB-CB 4.21Å; F116-L127 HydrophobicContact CD1-CB 4.29Å; F116-L127 HydrophobicContact CD1-CD2 4.12Å; D123-L127 HydrophobicContact CB-CD1 4.41Å; D123-L127 PolarHBondContact O-N 3.47Å; S124-L127 PolarHBondContact O-N 2.9Å; L127-F130 PolarHBondContact O-N 3.44Å; L127-A131 WeakPolarHBondContact O-CB 3.29Å; L127-A131 PolarHBondContact O-N 3.01Å; L127-L160 HydrophobicContact CD2-CD2 3.93Å; L127-N163 HydrophobicContact CD1-CB 4.21Å; L127-N163 HydrophobicContact CD2-CB 3.78Å; L127-A165 HydrophobicContact CD2-CB 4.15Å
128	E	91.3	Very high	85.4	Confident	83 Å²	83	66.6 Å²	66.6	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-46.8	174.6	-176.9	163.4	-137	0	0	111.2	R117 S124 F130 A131 E132	R117-E128 IonicContact NH2-OE1 3.91Å; S124-E128 VanDerWaalsContact O-CB 3.24Å; S124-E128 WeakPolarHBondContact O-CB 3.35Å; S124-E128 PolarHBondContact O-N 3.24Å; E128-F130 VanDerWaalsContact C-N 3.26Å; E128-F130 PolarHBondContact O-N 3.41Å; E128-A131 PolarHBondContact O-N 2.94Å; E128-A131 VanDerWaalsContact O-N 3.15Å; E128-E132 WeakPolarHBondContact O-CG 3.45Å; E128-E132 PolarHBondContact O-N 3.41Å
129	R	93	Very high	86	Confident	99 Å²	99	65.6 Å²	65.6	37%	0.374	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-38	175.2	-167.6	175.3	81.3	-149.9	7	112	K125 I126 F133 H151 F152 E156	K125-R129 VanDerWaalsContact O-CB 3.3Å; K125-R129 WeakPolarHBondContact O-CB 3.32Å; K125-R129 PolarHBondContact O-N 3.02Å; I126-R129 PolarHBondContact O-N 3.24Å; R129-F133 VanDerWaalsContact O-CB 3.27Å; R129-F133 WeakPolarHBondContact O-CB 3.4Å; R129-F133 PolarHBondContact O-N 3.46Å; R129-H151 PolarHBondContact NH2-O 3.17Å; R129-F152 HydrophobicContact CG-CE1 4.48Å; R129-E156 IonicContact CZ-OE1 3.31Å; R129-E156 VanDerWaalsContact CZ-OE1 3.31Å; R129-E156 IonicContact NH1-OE1 3.44Å; R129-E156 PolarHBondContact NH1-OE1 3.32Å; R129-E156 IonicContact NH2-OE1 2.76Å; R129-E156 PolarHBondContact NH2-OE1 2.96Å; R129-E156 IonicContact NH2-OE2 2.99Å; R129-E156 PolarHBondContact NH2-OE2 3.43Å
130	F	95.2	Very high	86.9	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-66.2	-45.9	173.8	177.2	-95.7	0	0	0	112.6	F112 F116 I126 L127 E128 E132 F133 T134 F152 L160 A165 L166 I176	F112-F130 HydrophobicContact CZ-CE1 4.43Å; F116-F130 HydrophobicContact CE1-CD1 4.17Å; F116-F130 HydrophobicContact CE1-CE1 4.3Å; F116-F130 AromaticContact CZ-CD1 3.99Å; F116-F130 HydrophobicContact CZ-CD1 3.99Å; F116-F130 AromaticContact CZ-CE1 3.91Å; F116-F130 HydrophobicContact CZ-CE1 3.91Å; I126-F130 WeakPolarHBondContact O-CB 3.4Å; I126-F130 PolarHBondContact O-N 2.99Å; L127-F130 PolarHBondContact O-N 3.44Å; E128-F130 VanDerWaalsContact C-N 3.26Å; E128-F130 PolarHBondContact O-N 3.41Å; F130-E132 VanDerWaalsContact C-N 3.33Å; F130-E132 PolarHBondContact O-N 2.96Å; F130-F133 PolarHBondContact O-N 3.44Å; F130-T134 HydrophobicContact CD1-CG2 4.33Å; F130-T134 HydrophobicContact CD2-CG2 3.96Å; F130-T134 HydrophobicContact CE1-CG2 3.99Å; F130-T134 HydrophobicContact CE2-CG2 3.61Å; F130-T134 HydrophobicContact CG-CG2 4.33Å; F130-T134 HydrophobicContact CZ-CG2 3.64Å; F130-T134 WeakPolarHBondContact O-CB 3.43Å; F130-T134 WeakPolarHBondContact O-CG2 3.25Å; F130-T134 PolarHBondContact O-N 3.36Å; F130-T134 PolarHBondContact O-OG1 2.95Å; F130-F152 HydrophobicContact CB-CE1 4.1Å; F130-F152 HydrophobicContact CB-CZ 3.99Å; F130-F152 HydrophobicContact CD2-CE2 4.19Å; F130-F152 HydrophobicContact CD2-CZ 4.01Å; F130-L160 HydrophobicContact CB-CD1 4.44Å; F130-L160 HydrophobicContact CB-CD2 3.57Å; F130-L160 HydrophobicContact CD1-CD2 4.25Å; F130-L160 HydrophobicContact CD2-CD1 3.6Å; F130-L160 HydrophobicContact CD2-CD2 3.9Å; F130-L160 HydrophobicContact CD2-CG 4.37Å; F130-L160 HydrophobicContact CE2-CD1 4.13Å; F130-L160 HydrophobicContact CG-CD1 4.22Å; F130-L160 HydrophobicContact CG-CD2 3.65Å; F130-A165 HydrophobicContact CD1-CB 3.87Å; F130-A165 HydrophobicContact CE1-CB 3.68Å; F130-A165 HydrophobicContact CZ-CB 4.19Å; F130-A165 WeakPolarHBondContact CZ-O 3.36Å; F130-L166 HydrophobicContact CE2-CD2 3.78Å; F130-L166 HydrophobicContact CE2-CG 4.04Å; F130-L166 HydrophobicContact CZ-CD2 3.79Å; F130-L166 HydrophobicContact CZ-CG 4.16Å; F130-I176 HydrophobicContact CE1-CG2 4.2Å; F130-I176 HydrophobicContact CZ-CB 4.48Å; F130-I176 HydrophobicContact CZ-CG1 4.2Å; F130-I176 HydrophobicContact CZ-CG2 3.84Å
131	A	93.5	Very high	88.3	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-59.5	-44.3	176.9	0	0	0	0	0	111.3	V113 F116 L127 E128 T134 S135	V113-A131 HydrophobicContact CG1-CB 4.25Å; V113-A131 HydrophobicContact CG2-CB 4.39Å; F116-A131 HydrophobicContact CD2-CB 3.7Å; F116-A131 HydrophobicContact CE2-CB 4.2Å; F116-A131 HydrophobicContact CG-CB 4.32Å; L127-A131 WeakPolarHBondContact O-CB 3.29Å; L127-A131 PolarHBondContact O-N 3.01Å; E128-A131 PolarHBondContact O-N 2.94Å; E128-A131 VanDerWaalsContact O-N 3.15Å; A131-T134 PolarHBondContact O-OG1 3.43Å; A131-S135 WeakPolarHBondContact O-CB 3.2Å; A131-S135 PolarHBondContact O-N 2.86Å
132	E	91.9	Very high	89.7	Confident	91 Å²	91	63.9 Å²	63.9	43%	0.425	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-50.2	175.7	-72	179.4	172.4	0	0	112.3	E128 F130 T134 S135 Q136	E128-E132 WeakPolarHBondContact O-CG 3.45Å; E128-E132 PolarHBondContact O-N 3.41Å; F130-E132 VanDerWaalsContact C-N 3.33Å; F130-E132 PolarHBondContact O-N 2.96Å; E132-T134 VanDerWaalsContact C-N 3.33Å; E132-T134 PolarHBondContact O-N 3.19Å; E132-S135 PolarHBondContact O-N 2.72Å; E132-Q136 VanDerWaalsContact O-CB 3.3Å; E132-Q136 WeakPolarHBondContact O-CB 2.9Å; E132-Q136 WeakPolarHBondContact O-CG 3.23Å; E132-Q136 PolarHBondContact O-N 3.43Å
133	F	94.3	Very high	90.8	Very high	15 Å²	15	56.8 Å²	56.8	7%	0.066	26%	0.262	C	S	.	.	H	α-helix	trans	-55	-50.5	178.3	165.2	-113.3	0	0	0	111.4	R129 F130 K137 Y138 L143 V147 H151 F152	R129-F133 VanDerWaalsContact O-CB 3.27Å; R129-F133 WeakPolarHBondContact O-CB 3.4Å; R129-F133 PolarHBondContact O-N 3.46Å; F130-F133 PolarHBondContact O-N 3.44Å; F133-K137 HydrophobicContact CD2-CB 4.15Å; F133-K137 HydrophobicContact CD2-CD 4.48Å; F133-K137 HydrophobicContact CE2-CB 4.39Å; F133-K137 WeakPolarHBondContact O-CA 3.5Å; F133-K137 WeakPolarHBondContact O-CB 3.15Å; F133-K137 PolarHBondContact O-N 3.14Å; F133-Y138 HydrophobicContact CE1-CD1 4.46Å; F133-Y138 HydrophobicContact CE1-CG 4.12Å; F133-Y138 HydrophobicContact CE2-CG 4.44Å; F133-Y138 VanDerWaalsContact CZ-CB 3.45Å; F133-Y138 HydrophobicContact CZ-CD1 4.47Å; F133-Y138 HydrophobicContact CZ-CD2 4.01Å; F133-Y138 AromaticContact CZ-CG 3.73Å; F133-Y138 HydrophobicContact CZ-CG 3.73Å; F133-Y138 PolarHBondContact O-N 2.94Å; F133-L143 HydrophobicContact CE1-CD1 4.14Å; F133-L143 HydrophobicContact CZ-CD1 4.3Å; F133-V147 HydrophobicContact CZ-CG1 4.34Å; F133-H151 AromaticContact CD2-CD2 3.85Å; F133-H151 AromaticContact CD2-NE2 3.92Å; F133-H151 AromaticContact CE2-CD2 3.22Å; F133-H151 WeakPolarHBondContact CE2-CD2 3.11Å; F133-H151 AromaticContact CE2-CE1 3.98Å; F133-H151 AromaticContact CE2-CG 3.93Å; F133-H151 AromaticContact CE2-NE2 3.24Å; F133-H151 WeakPolarHBondContact CE2-NE2 3.2Å; F133-H151 AromaticContact CZ-CD2 3.45Å; F133-H151 VanDerWaalsContact CZ-CD2 3.45Å; F133-H151 WeakPolarHBondContact CZ-CD2 3.24Å; F133-H151 AromaticContact CZ-NE2 3.88Å; F133-F152 HydrophobicContact CB-CZ 4.35Å; F133-F152 AromaticContact CD1-CE2 3.78Å; F133-F152 HydrophobicContact CD1-CE2 3.78Å; F133-F152 HydrophobicContact CD1-CZ 4.23Å; F133-F152 HydrophobicContact CE1-CE2 4.25Å; F133-F152 HydrophobicContact CG-CE2 4.31Å; F133-F152 HydrophobicContact CG-CZ 4.5Å
134	T	93.6	Very high	91.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-75.4	-30.4	-175.8	59.6	0	0	0	0	112.3	R92 F112 F130 A131 E132 Y138 I176	R92-T134 VanDerWaalsContact NH1-CB 3.3Å; R92-T134 PolarHBondContact NH1-O 3.24Å; F112-T134 VanDerWaalsContact CE1-OG1 3.28Å; F112-T134 WeakPolarHBondContact CE1-OG1 3.37Å; F130-T134 HydrophobicContact CD1-CG2 4.33Å; F130-T134 HydrophobicContact CD2-CG2 3.96Å; F130-T134 HydrophobicContact CE1-CG2 3.99Å; F130-T134 HydrophobicContact CE2-CG2 3.61Å; F130-T134 HydrophobicContact CG-CG2 4.33Å; F130-T134 HydrophobicContact CZ-CG2 3.64Å; F130-T134 WeakPolarHBondContact O-CB 3.43Å; F130-T134 WeakPolarHBondContact O-CG2 3.25Å; F130-T134 PolarHBondContact O-N 3.36Å; F130-T134 PolarHBondContact O-OG1 2.95Å; A131-T134 PolarHBondContact O-OG1 3.43Å; E132-T134 VanDerWaalsContact C-N 3.33Å; E132-T134 PolarHBondContact O-N 3.19Å; T134-Y138 CarbonylContact O-C 3.51Å; T134-I176 HydrophobicContact CG2-CD1 3.82Å; T134-I176 HydrophobicContact CG2-CG1 4.42Å; T134-I176 HydrophobicContact CG2-CG2 4.24Å
135	S	89	Confident	92.5	Very high	19 Å²	19	59 Å²	59	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-76.7	-38.8	177.2	-168.2	0	0	0	0	112.3	A131 E132 H139	A131-S135 WeakPolarHBondContact O-CB 3.2Å; A131-S135 PolarHBondContact O-N 2.86Å; E132-S135 PolarHBondContact O-N 2.72Å; S135-H139 PolarHBondContact O-CE1 3.34Å; S135-H139 VanDerWaalsContact O-CE1 3.24Å
136	Q	88.8	Confident	92.8	Very high	109 Å²	109	60.6 Å²	60.6	51%	0.509	27%	0.271	S	S	.	.	H	α-helix	trans	-99.1	-35	-170.7	-62	177.6	7.5	0	0	114.6	Q89 E132	Q89-Q136 PolarHBondContact NE2-O 2.48Å; E132-Q136 VanDerWaalsContact O-CB 3.3Å; E132-Q136 WeakPolarHBondContact O-CB 2.9Å; E132-Q136 WeakPolarHBondContact O-CG 3.23Å; E132-Q136 PolarHBondContact O-N 3.43Å
137	K	88.7	Confident	92.9	Very high	154 Å²	154	61 Å²	61	67%	0.67	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-30.1	-168.7	-61.7	179.7	-179.9	176.5	0	113.5	F133	F133-K137 HydrophobicContact CD2-CB 4.15Å; F133-K137 HydrophobicContact CD2-CD 4.48Å; F133-K137 HydrophobicContact CE2-CB 4.39Å; F133-K137 WeakPolarHBondContact O-CA 3.5Å; F133-K137 WeakPolarHBondContact O-CB 3.15Å; F133-K137 PolarHBondContact O-N 3.14Å
138	Y	93.1	Very high	93	Very high	36 Å²	36	60.9 Å²	60.9	14%	0.141	27%	0.274	C	S	.	.			trans	-131.3	93.8	-169.2	-164.3	-90.5	0	0	0	113.8	R92 F133 T134 Y140 S142 L143 V147 I176	R92-Y138 PolarHBondContact NH2-O 2.95Å; F133-Y138 HydrophobicContact CE1-CD1 4.46Å; F133-Y138 HydrophobicContact CE1-CG 4.12Å; F133-Y138 HydrophobicContact CE2-CG 4.44Å; F133-Y138 VanDerWaalsContact CZ-CB 3.45Å; F133-Y138 HydrophobicContact CZ-CD1 4.47Å; F133-Y138 HydrophobicContact CZ-CD2 4.01Å; F133-Y138 AromaticContact CZ-CG 3.73Å; F133-Y138 HydrophobicContact CZ-CG 3.73Å; F133-Y138 PolarHBondContact O-N 2.94Å; T134-Y138 CarbonylContact O-C 3.51Å; Y138-Y140 HydrophobicContact CD2-CD2 4.17Å; Y138-Y140 HydrophobicContact CE1-CD2 4.15Å; Y138-Y140 HydrophobicContact CE1-CG 4.42Å; Y138-Y140 AromaticContact CE2-CD2 3.69Å; Y138-Y140 HydrophobicContact CE2-CD2 3.69Å; Y138-Y140 HydrophobicContact CE2-CE2 4.38Å; Y138-Y140 AromaticContact CZ-CD2 3.68Å; Y138-S142 VanDerWaalsContact CE1-O 3.31Å; Y138-S142 WeakPolarHBondContact CE1-O 3.42Å; Y138-S142 PolarHBondContact OH-O 3.41Å; Y138-L143 HydrophobicContact CD1-CD1 4.2Å; Y138-L143 HydrophobicContact CE1-CB 4.43Å; Y138-L143 HydrophobicContact CE1-CD1 3.79Å; Y138-L143 HydrophobicContact CE2-CD1 4.19Å; Y138-V147 HydrophobicContact CD2-CG1 4.21Å; Y138-V147 HydrophobicContact CE2-CG1 3.9Å; Y138-I176 HydrophobicContact CD1-CD1 3.62Å; Y138-I176 HydrophobicContact CE1-CD1 3.81Å
139	H	91.1	Very high	93.2	Very high	52 Å²	52	59.9 Å²	59.9	24%	0.241	28%	0.276	C	S	.	.			trans	-88.4	-11.6	-172.4	-51.8	-55.7	0	0	0	114.9	Q86 S135	Q86-H139 HydrophobicContact CG-CB 3.99Å; Q86-H139 PolarHBondContact NE2-O 2.88Å; S135-H139 PolarHBondContact O-CE1 3.34Å; S135-H139 VanDerWaalsContact O-CE1 3.24Å
140	Y	91.7	Very high	93.4	Very high	165 Å²	165	61.2 Å²	61.2	65%	0.647	29%	0.287	S	S	*	.	S	Bend	trans	-62.5	156.1	-178.3	-61	-80.2	0	0	0	112.7	R92 Y138 S142	R92-Y140 PolarHBondContact NH2-O 2.9Å; R92-Y140 VanDerWaalsContact NH2-O 3.07Å; Y138-Y140 HydrophobicContact CD2-CD2 4.17Å; Y138-Y140 HydrophobicContact CE1-CD2 4.15Å; Y138-Y140 HydrophobicContact CE1-CG 4.42Å; Y138-Y140 AromaticContact CE2-CD2 3.69Å; Y138-Y140 HydrophobicContact CE2-CD2 3.69Å; Y138-Y140 HydrophobicContact CE2-CE2 4.38Å; Y138-Y140 AromaticContact CZ-CD2 3.68Å; Y140-S142 VanDerWaalsContact C-N 3.3Å; Y140-S142 PolarHBondContact O-N 3.38Å
141	L	92.2	Very high	93.4	Very high	53 Å²	53	64.7 Å²	64.7	28%	0.277	30%	0.303	S	S	.	.	S	Bend	trans	-67.8	-27.7	178	-74.4	174.1	0	0	0	113.5	L93 I176	L93-L141 VanDerWaalsContact C-CD2 3.44Å; L93-L141 HydrophobicContact CB-CD2 3.56Å; L93-L141 WeakPolarHBondContact O-CD2 3.33Å; L141-I176 PolarHBondContact O-N 2.84Å
142	S	93.4	Very high	93.5	Very high	23 Å²	23	64.9 Å²	64.9	16%	0.161	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	149.8	-175.3	59.7	0	0	0	0	112.1	Y138 Y140 K169 W174	Y138-S142 VanDerWaalsContact CE1-O 3.31Å; Y138-S142 WeakPolarHBondContact CE1-O 3.42Å; Y138-S142 PolarHBondContact OH-O 3.41Å; Y140-S142 VanDerWaalsContact C-N 3.3Å; Y140-S142 PolarHBondContact O-N 3.38Å; S142-K169 PolarHBondContact OG-NZ 3.26Å; S142-W174 CarbonylContact C-O 3.46Å; S142-W174 WeakPolarHBondContact CA-O 3.3Å; S142-W174 VanDerWaalsContact CB-O 3.25Å; S142-W174 WeakPolarHBondContact CB-O 3.5Å
143	L	94.3	Very high	93.7	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.4	176.4	-169.2	65.7	0	0	0	108.7	F133 Y138 V147 A148 L166 S173 W174 I176	F133-L143 HydrophobicContact CE1-CD1 4.14Å; F133-L143 HydrophobicContact CZ-CD1 4.3Å; Y138-L143 HydrophobicContact CD1-CD1 4.2Å; Y138-L143 HydrophobicContact CE1-CB 4.43Å; Y138-L143 HydrophobicContact CE1-CD1 3.79Å; Y138-L143 HydrophobicContact CE2-CD1 4.19Å; L143-V147 HydrophobicContact CD1-CB 3.82Å; L143-V147 HydrophobicContact CD1-CG1 3.62Å; L143-A148 HydrophobicContact CD2-CB 3.53Å; L143-A148 HydrophobicContact CG-CB 3.84Å; L143-L166 HydrophobicContact CD2-CD2 4.48Å; L143-S173 CarbonylContact O-C 3.46Å; L143-S173 VanDerWaalsContact O-CA 3.29Å; L143-S173 WeakPolarHBondContact O-CA 3.14Å; L143-S173 PolarHBondContact O-OG 3.38Å; L143-W174 PolarHBondContact N-O 3.28Å; L143-W174 PolarHBondContact O-N 3.05Å; L143-I176 HydrophobicContact CB-CD1 4.39Å; L143-I176 HydrophobicContact CB-CG1 4.4Å
144	C	96	Very high	93.8	Very high	53 Å²	53	67.3 Å²	67.3	36%	0.358	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	156.7	170.6	71.2	0	0	0	0	110.1	R146 V147 A148	C144-R146 VanDerWaalsContact C-N 3.26Å; C144-R146 PolarHBondContact O-N 3.28Å; C144-V147 PolarHBondContact O-N 3.01Å; C144-V147 VanDerWaalsContact O-N 3.13Å; C144-A148 PolarHBondContact O-N 2.86Å
145	K	95.9	Very high	93.9	Very high	83 Å²	83	72.7 Å²	72.7	36%	0.361	35%	0.353	S	S	.	.	H	α-helix	trans	-52.2	-42.3	-177.8	-174.6	169.4	-178.1	173.4	0	113.5	V147 A148 S149 N172 W174	K145-V147 PolarHBondContact O-N 3.41Å; K145-A148 PolarHBondContact O-N 3.14Å; K145-S149 WeakPolarHBondContact O-CB 3.43Å; K145-S149 PolarHBondContact O-N 3.34Å; K145-S149 PolarHBondContact O-OG 3.05Å; K145-S149 VanDerWaalsContact O-OG 3.05Å; K145-N172 HydrophobicContact CB-CB 3.97Å; K145-N172 WeakPolarHBondContact CD-OD1 3.12Å; K145-N172 PolarHBondContact N-O 3.28Å; K145-W174 HydrophobicContact CB-CH2 4.07Å; K145-W174 HydrophobicContact CB-CZ3 4.08Å; K145-W174 HydrophobicContact CG-CH2 4.22Å
146	R	95.7	Very high	94.2	Very high	207 Å²	207	73.5 Å²	73.5	78%	0.781	36%	0.355	S	S	*	.	H	α-helix	trans	-53.2	-52.9	177.9	-177.1	-178.1	-116.4	179.4	-2.9	111.9	C144 E150	C144-R146 VanDerWaalsContact C-N 3.26Å; C144-R146 PolarHBondContact O-N 3.28Å; R146-E150 PolarHBondContact O-N 3.07Å
147	V	95.4	Very high	94.5	Very high	34 Å²	34	68.6 Å²	68.6	21%	0.206	33%	0.333	C	S	.	.	H	α-helix	trans	-72.6	-35.4	-178.9	-176.8	0	0	0	0	111.2	F133 Y138 L143 C144 K145 S149 E150	F133-V147 HydrophobicContact CZ-CG1 4.34Å; Y138-V147 HydrophobicContact CD2-CG1 4.21Å; Y138-V147 HydrophobicContact CE2-CG1 3.9Å; L143-V147 HydrophobicContact CD1-CB 3.82Å; L143-V147 HydrophobicContact CD1-CG1 3.62Å; C144-V147 PolarHBondContact O-N 3.01Å; C144-V147 VanDerWaalsContact O-N 3.13Å; K145-V147 PolarHBondContact O-N 3.41Å; V147-S149 PolarHBondContact O-N 3.12Å; V147-E150 PolarHBondContact O-N 3.01Å
148	A	95.6	Very high	94.8	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-46.5	175.8	0	0	0	0	0	111.7	L143 C144 K145 E150 H151 F152 I157 W174	L143-A148 HydrophobicContact CD2-CB 3.53Å; L143-A148 HydrophobicContact CG-CB 3.84Å; C144-A148 PolarHBondContact O-N 2.86Å; K145-A148 PolarHBondContact O-N 3.14Å; A148-E150 PolarHBondContact O-N 3.39Å; A148-H151 PolarHBondContact O-N 2.85Å; A148-F152 PolarHBondContact O-N 3.01Å; A148-I157 HydrophobicContact CB-CD1 3.79Å; A148-I157 HydrophobicContact CB-CG1 4.43Å; A148-W174 HydrophobicContact CB-CZ3 3.94Å
149	S	95.7	Very high	94.9	Very high	62 Å²	62	63.1 Å²	63.1	43%	0.434	32%	0.317	S	S	.	.	H	α-helix	trans	-68	-15.7	-178.5	-61.7	0	0	0	0	114	K145 V147 H151 F152	K145-S149 WeakPolarHBondContact O-CB 3.43Å; K145-S149 PolarHBondContact O-N 3.34Å; K145-S149 PolarHBondContact O-OG 3.05Å; K145-S149 VanDerWaalsContact O-OG 3.05Å; V147-S149 PolarHBondContact O-N 3.12Å; S149-H151 VanDerWaalsContact C-N 3.27Å; S149-F152 WeakPolarHBondContact CA-O 3.13Å
150	E	95.7	Very high	95.1	Very high	128 Å²	128	60.7 Å²	60.7	60%	0.598	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.6	171.6	-69.7	169.6	-157.5	0	0	112.6	R146 V147 A148	R146-E150 PolarHBondContact O-N 3.07Å; V147-E150 PolarHBondContact O-N 3.01Å; A148-E150 PolarHBondContact O-N 3.39Å
151	H	95.1	Very high	95.2	Very high	72 Å²	72	55.7 Å²	55.7	33%	0.333	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-20.3	-173	-64	-60.7	0	0	0	114.6	R129 F133 A148 S149	R129-H151 PolarHBondContact NH2-O 3.17Å; F133-H151 AromaticContact CD2-CD2 3.85Å; F133-H151 AromaticContact CD2-NE2 3.92Å; F133-H151 AromaticContact CE2-CD2 3.22Å; F133-H151 WeakPolarHBondContact CE2-CD2 3.11Å; F133-H151 AromaticContact CE2-CE1 3.98Å; F133-H151 AromaticContact CE2-CG 3.93Å; F133-H151 AromaticContact CE2-NE2 3.24Å; F133-H151 WeakPolarHBondContact CE2-NE2 3.2Å; F133-H151 AromaticContact CZ-CD2 3.45Å; F133-H151 VanDerWaalsContact CZ-CD2 3.45Å; F133-H151 WeakPolarHBondContact CZ-CD2 3.24Å; F133-H151 AromaticContact CZ-NE2 3.88Å; A148-H151 PolarHBondContact O-N 2.85Å; S149-H151 VanDerWaalsContact C-N 3.27Å
152	F	96.5	Very high	95.2	Very high	5 Å²	5	60.5 Å²	60.5	2%	0.022	31%	0.311	C	S	.	.			trans	-141.9	133.3	-175	-54.6	-82.6	0	0	0	110.1	R129 F130 F133 A148 S149 E156 I157 L160	R129-F152 HydrophobicContact CG-CE1 4.48Å; F130-F152 HydrophobicContact CB-CE1 4.1Å; F130-F152 HydrophobicContact CB-CZ 3.99Å; F130-F152 HydrophobicContact CD2-CE2 4.19Å; F130-F152 HydrophobicContact CD2-CZ 4.01Å; F133-F152 HydrophobicContact CB-CZ 4.35Å; F133-F152 AromaticContact CD1-CE2 3.78Å; F133-F152 HydrophobicContact CD1-CE2 3.78Å; F133-F152 HydrophobicContact CD1-CZ 4.23Å; F133-F152 HydrophobicContact CE1-CE2 4.25Å; F133-F152 HydrophobicContact CG-CE2 4.31Å; F133-F152 HydrophobicContact CG-CZ 4.5Å; A148-F152 PolarHBondContact O-N 3.01Å; S149-F152 WeakPolarHBondContact CA-O 3.13Å; F152-E156 WeakPolarHBondContact CA-OE2 3.31Å; F152-E156 HydrophobicContact CB-CB 4.1Å; F152-E156 HydrophobicContact CD1-CB 4.42Å; F152-I157 HydrophobicContact CB-CG1 3.86Å; F152-L160 HydrophobicContact CD1-CD1 3.91Å; F152-L160 HydrophobicContact CD2-CD1 4.33Å; F152-L160 HydrophobicContact CE1-CD1 4.22Å; F152-L160 HydrophobicContact CG-CD1 3.99Å
153	S	96.3	Very high	95.1	Very high	61 Å²	61	61.1 Å²	61.1	43%	0.427	31%	0.312	S	S	.	.			trans	-66.6	161	169.2	61.4	0	0	0	0	111.5	N155 E156 I157	S153-N155 PolarHBondContact O-N 3.31Å; S153-E156 PolarHBondContact N-OE2 2.99Å; S153-E156 PolarHBondContact O-N 3.22Å; S153-E156 VanDerWaalsContact OG-CG 3.25Å; S153-E156 WeakPolarHBondContact OG-CG 3.4Å; S153-E156 PolarHBondContact OG-N 3.28Å; S153-E156 PolarHBondContact OG-OE2 2.99Å; S153-I157 WeakPolarHBondContact O-CG1 3.44Å; S153-I157 PolarHBondContact O-N 3.12Å
154	D	95.9	Very high	95	Very high	97 Å²	97	62 Å²	62	52%	0.519	32%	0.321	S	S	.	.	H	α-helix	trans	-58.1	-32.5	177.8	-72.8	-18.7	0	0	0	112.8	S158	D154-S158 PolarHBondContact O-N 3.2Å; D154-S158 PolarHBondContact O-OG 2.99Å
155	N	95.7	Very high	95	Very high	112 Å²	112	59.4 Å²	59.4	60%	0.599	30%	0.304	S	S	*	.	H	α-helix	trans	-68.1	-44.8	173.5	-174.9	64.1	0	0	0	111.6	S153 I157 S158 I159	S153-N155 PolarHBondContact O-N 3.31Å; N155-I157 VanDerWaalsContact C-N 3.34Å; N155-I157 PolarHBondContact O-N 3.38Å; N155-S158 WeakPolarHBondContact O-CB 3.39Å; N155-S158 PolarHBondContact O-N 3.41Å; N155-S158 VanDerWaalsContact O-N 3.17Å; N155-I159 WeakPolarHBondContact O-CG1 3.5Å; N155-I159 PolarHBondContact O-N 2.81Å
156	E	95.4	Very high	94.9	Very high	36 Å²	36	55.5 Å²	55.5	17%	0.168	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-38.4	175.9	-70.8	168	136.3	0	0	111.7	I126 R129 F152 S153 S158 I159 L160	I126-E156 HydrophobicContact CD1-CG 4.01Å; I126-E156 HydrophobicContact CG1-CG 4.27Å; I126-E156 HydrophobicContact CG2-CB 4.17Å; I126-E156 HydrophobicContact CG2-CG 4.32Å; R129-E156 IonicContact CZ-OE1 3.31Å; R129-E156 VanDerWaalsContact CZ-OE1 3.31Å; R129-E156 IonicContact NH1-OE1 3.44Å; R129-E156 PolarHBondContact NH1-OE1 3.32Å; R129-E156 IonicContact NH2-OE1 2.76Å; R129-E156 PolarHBondContact NH2-OE1 2.96Å; R129-E156 IonicContact NH2-OE2 2.99Å; R129-E156 PolarHBondContact NH2-OE2 3.43Å; F152-E156 WeakPolarHBondContact CA-OE2 3.31Å; F152-E156 HydrophobicContact CB-CB 4.1Å; F152-E156 HydrophobicContact CD1-CB 4.42Å; S153-E156 PolarHBondContact N-OE2 2.99Å; S153-E156 PolarHBondContact O-N 3.22Å; S153-E156 VanDerWaalsContact OG-CG 3.25Å; S153-E156 WeakPolarHBondContact OG-CG 3.4Å; S153-E156 PolarHBondContact OG-N 3.28Å; S153-E156 PolarHBondContact OG-OE2 2.99Å; E156-S158 VanDerWaalsContact C-N 3.27Å; E156-S158 PolarHBondContact O-N 2.91Å; E156-I159 WeakPolarHBondContact O-CB 3.47Å; E156-I159 PolarHBondContact O-N 2.9Å; E156-L160 VanDerWaalsContact O-CG 3.29Å; E156-L160 WeakPolarHBondContact O-CG 3.18Å; E156-L160 PolarHBondContact O-N 3.09Å
157	I	96	Very high	94.8	Very high	7 Å²	7	48.1 Å²	48.1	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-59.6	-41.3	173.1	-66.8	170	0	0	0	110.3	A148 F152 S153 N155 L160 I161 L166 W174	A148-I157 HydrophobicContact CB-CD1 3.79Å; A148-I157 HydrophobicContact CB-CG1 4.43Å; F152-I157 HydrophobicContact CB-CG1 3.86Å; S153-I157 WeakPolarHBondContact O-CG1 3.44Å; S153-I157 PolarHBondContact O-N 3.12Å; N155-I157 VanDerWaalsContact C-N 3.34Å; N155-I157 PolarHBondContact O-N 3.38Å; I157-L160 WeakPolarHBondContact O-CB 3.31Å; I157-L160 PolarHBondContact O-N 3.45Å; I157-I161 HydrophobicContact CG2-CD1 4.04Å; I157-I161 WeakPolarHBondContact O-CG1 3.31Å; I157-I161 PolarHBondContact O-N 3.13Å; I157-L166 HydrophobicContact CG2-CD1 4.29Å; I157-W174 HydrophobicContact CD1-CH2 4.49Å; I157-W174 HydrophobicContact CG2-CH2 4.07Å; I157-W174 HydrophobicContact CG2-CZ2 3.98Å; I157-W174 HydrophobicContact CG2-CZ3 4.43Å
158	S	94.8	Very high	94.7	Very high	56 Å²	56	52.6 Å²	52.6	39%	0.392	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-42.4	176.4	-59	0	0	0	0	111.8	D154 N155 E156 I161 Q162	D154-S158 PolarHBondContact O-N 3.2Å; D154-S158 PolarHBondContact O-OG 2.99Å; N155-S158 WeakPolarHBondContact O-CB 3.39Å; N155-S158 PolarHBondContact O-N 3.41Å; N155-S158 VanDerWaalsContact O-N 3.17Å; E156-S158 VanDerWaalsContact C-N 3.27Å; E156-S158 PolarHBondContact O-N 2.91Å; S158-I161 PolarHBondContact O-N 3.41Å; S158-Q162 VanDerWaalsContact O-CG 3.29Å; S158-Q162 WeakPolarHBondContact O-CG 3.09Å; S158-Q162 PolarHBondContact O-N 3.3Å
159	I	94	Very high	94.5	Very high	19 Å²	19	57.1 Å²	57.1	10%	0.097	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-43	174.3	-68.2	167.5	0	0	0	111	D123 I126 N155 E156 I161 Q162 N163	D123-I159 HydrophobicContact CB-CG2 3.97Å; I126-I159 HydrophobicContact CD1-CD1 3.63Å; I126-I159 HydrophobicContact CD1-CG2 4.26Å; N155-I159 WeakPolarHBondContact O-CG1 3.5Å; N155-I159 PolarHBondContact O-N 2.81Å; E156-I159 WeakPolarHBondContact O-CB 3.47Å; E156-I159 PolarHBondContact O-N 2.9Å; I159-I161 VanDerWaalsContact C-N 3.32Å; I159-I161 PolarHBondContact O-N 3.03Å; I159-Q162 PolarHBondContact O-N 3.37Å; I159-N163 WeakPolarHBondContact O-CB 3.24Å; I159-N163 PolarHBondContact O-N 3.47Å; I159-N163 PolarHBondContact O-ND2 2.62Å
160	L	95	Very high	94.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-39.1	176.8	-69.3	174.6	0	0	0	112.2	I126 L127 F130 F152 E156 I157 G164 A165 L166	I126-L160 HydrophobicContact CG2-CD2 4.05Å; I126-L160 HydrophobicContact CG2-CG 4.26Å; L127-L160 HydrophobicContact CD2-CD2 3.93Å; F130-L160 HydrophobicContact CB-CD1 4.44Å; F130-L160 HydrophobicContact CB-CD2 3.57Å; F130-L160 HydrophobicContact CD1-CD2 4.25Å; F130-L160 HydrophobicContact CD2-CD1 3.6Å; F130-L160 HydrophobicContact CD2-CD2 3.9Å; F130-L160 HydrophobicContact CD2-CG 4.37Å; F130-L160 HydrophobicContact CE2-CD1 4.13Å; F130-L160 HydrophobicContact CG-CD1 4.22Å; F130-L160 HydrophobicContact CG-CD2 3.65Å; F152-L160 HydrophobicContact CD1-CD1 3.91Å; F152-L160 HydrophobicContact CD2-CD1 4.33Å; F152-L160 HydrophobicContact CE1-CD1 4.22Å; F152-L160 HydrophobicContact CG-CD1 3.99Å; E156-L160 VanDerWaalsContact O-CG 3.29Å; E156-L160 WeakPolarHBondContact O-CG 3.18Å; E156-L160 PolarHBondContact O-N 3.09Å; I157-L160 WeakPolarHBondContact O-CB 3.31Å; I157-L160 PolarHBondContact O-N 3.45Å; L160-G164 PolarHBondContact O-N 3.24Å; L160-A165 HydrophobicContact CB-CB 4.12Å; L160-A165 HydrophobicContact CD2-CB 3.86Å; L160-A165 WeakPolarHBondContact O-CA 3.41Å; L160-A165 VanDerWaalsContact O-CB 3.32Å; L160-A165 WeakPolarHBondContact O-CB 3.46Å; L160-A165 PolarHBondContact O-N 2.85Å; L160-L166 HydrophobicContact CB-CB 4.46Å; L160-L166 HydrophobicContact CB-CD1 3.89Å; L160-L166 HydrophobicContact CB-CG 4.06Å; L160-L166 HydrophobicContact CD1-CD1 3.95Å; L160-L166 PolarHBondContact O-N 3.24Å
161	I	94.4	Very high	94	Very high	61 Å²	61	59.7 Å²	59.7	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-67.4	-47	175.7	-66.8	165.3	0	0	0	110.6	I157 S158 I159 N163 G164 L166	I157-I161 HydrophobicContact CG2-CD1 4.04Å; I157-I161 WeakPolarHBondContact O-CG1 3.31Å; I157-I161 PolarHBondContact O-N 3.13Å; S158-I161 PolarHBondContact O-N 3.41Å; I159-I161 VanDerWaalsContact C-N 3.32Å; I159-I161 PolarHBondContact O-N 3.03Å; I161-N163 VanDerWaalsContact C-N 3.25Å; I161-N163 PolarHBondContact O-N 3.02Å; I161-G164 PolarHBondContact O-N 3.1Å; I161-L166 HydrophobicContact CG1-CB 3.87Å
162	Q	92.5	Very high	93.9	Very high	154 Å²	154	60 Å²	60	72%	0.72	32%	0.322	S	S	*	.	H	α-helix	trans	-60.5	-35.9	-179.8	-73.4	172.8	2.6	0	0	112.5	S158 I159 G164	S158-Q162 VanDerWaalsContact O-CG 3.29Å; S158-Q162 WeakPolarHBondContact O-CG 3.09Å; S158-Q162 PolarHBondContact O-N 3.3Å; I159-Q162 PolarHBondContact O-N 3.37Å; Q162-G164 VanDerWaalsContact C-N 3.32Å
163	N	91.8	Very high	93.9	Very high	35 Å²	35	60.3 Å²	60.3	19%	0.187	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3.7	177.6	-74.9	-78.6	0	0	0	113.6	D123 L127 I159 I161 A165 P179	D123-N163 PolarHBondContact OD2-ND2 3.5Å; L127-N163 HydrophobicContact CD1-CB 4.21Å; L127-N163 HydrophobicContact CD2-CB 3.78Å; I159-N163 WeakPolarHBondContact O-CB 3.24Å; I159-N163 PolarHBondContact O-N 3.47Å; I159-N163 PolarHBondContact O-ND2 2.62Å; I161-N163 VanDerWaalsContact C-N 3.25Å; I161-N163 PolarHBondContact O-N 3.02Å; N163-A165 VanDerWaalsContact C-N 3.28Å; N163-A165 PolarHBondContact O-N 3.11Å; N163-P179 WeakPolarHBondContact O-CB 3.37Å; N163-P179 WeakPolarHBondContact O-CG 3.35Å
164	G	92.4	Very high	93.9	Very high	19 Å²	19	58.7 Å²	58.7	20%	0.196	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	13.1	176.5	0	0	0	0	0	115.4	L160 I161 Q162 L166 S177 T178	L160-G164 PolarHBondContact O-N 3.24Å; I161-G164 PolarHBondContact O-N 3.1Å; Q162-G164 VanDerWaalsContact C-N 3.32Å; G164-L166 VanDerWaalsContact C-N 3.35Å; G164-S177 CarbonylContact O-C 3.5Å; G164-S177 WeakPolarHBondContact O-CB 3.44Å; G164-S177 PolarHBondContact O-OG 3.5Å; G164-T178 CarbonylContact O-C 3.37Å
165	A	94.4	Very high	93.8	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	-72.4	-31.3	172.9	0	0	0	0	0	111.9	F116 L127 F130 L160 N163 S177	F116-A165 HydrophobicContact CD1-CB 4.48Å; F116-A165 HydrophobicContact CE1-CB 3.58Å; F116-A165 HydrophobicContact CZ-CB 4.31Å; L127-A165 HydrophobicContact CD2-CB 4.15Å; F130-A165 HydrophobicContact CD1-CB 3.87Å; F130-A165 HydrophobicContact CE1-CB 3.68Å; F130-A165 HydrophobicContact CZ-CB 4.19Å; F130-A165 WeakPolarHBondContact CZ-O 3.36Å; L160-A165 HydrophobicContact CB-CB 4.12Å; L160-A165 HydrophobicContact CD2-CB 3.86Å; L160-A165 WeakPolarHBondContact O-CA 3.41Å; L160-A165 VanDerWaalsContact O-CB 3.32Å; L160-A165 WeakPolarHBondContact O-CB 3.46Å; L160-A165 PolarHBondContact O-N 2.85Å; N163-A165 VanDerWaalsContact C-N 3.28Å; N163-A165 PolarHBondContact O-N 3.11Å; A165-S177 PolarHBondContact O-N 2.89Å
166	L	95.2	Very high	93.8	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.8	173.8	-69.8	177.9	0	0	0	110.3	F130 L143 I157 L160 I161 G164 W174 Y175 I176	F130-L166 HydrophobicContact CE2-CD2 3.78Å; F130-L166 HydrophobicContact CE2-CG 4.04Å; F130-L166 HydrophobicContact CZ-CD2 3.79Å; F130-L166 HydrophobicContact CZ-CG 4.16Å; L143-L166 HydrophobicContact CD2-CD2 4.48Å; I157-L166 HydrophobicContact CG2-CD1 4.29Å; L160-L166 HydrophobicContact CB-CB 4.46Å; L160-L166 HydrophobicContact CB-CD1 3.89Å; L160-L166 HydrophobicContact CB-CG 4.06Å; L160-L166 HydrophobicContact CD1-CD1 3.95Å; L160-L166 PolarHBondContact O-N 3.24Å; I161-L166 HydrophobicContact CG1-CB 3.87Å; G164-L166 VanDerWaalsContact C-N 3.35Å; L166-W174 HydrophobicContact CB-CB 4.02Å; L166-W174 HydrophobicContact CB-CG 4.35Å; L166-W174 HydrophobicContact CD1-CB 4.44Å; L166-W174 HydrophobicContact CD1-CG 4.48Å; L166-W174 HydrophobicContact CD2-CB 3.98Å; L166-W174 HydrophobicContact CG-CB 4.37Å; L166-Y175 WeakPolarHBondContact CA-O 3.46Å; L166-I176 HydrophobicContact CD2-CG1 4.04Å
167	T	93.9	Very high	93.8	Very high	51 Å²	51	49.9 Å²	49.9	31%	0.313	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.7	172.4	58.4	0	0	0	0	110.5	K169 W174 Y175	T167-K169 PolarHBondContact O-N 2.92Å; T167-W174 CarbonylContact O-C 3.34Å; T167-W174 WeakPolarHBondContact O-CA 3.3Å; T167-W174 VanDerWaalsContact O-CB 3.25Å; T167-W174 WeakPolarHBondContact O-CB 3.49Å; T167-Y175 PolarHBondContact N-O 3.39Å; T167-Y175 PolarHBondContact O-N 3.21Å; T167-Y175 WeakPolarHBondContact OG1-CB 3.46Å
168	I	91.9	Very high	93.6	Very high	128 Å²	128	49.6 Å²	49.6	66%	0.656	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	127.3	-173	-58.3	174.1	0	0	0	110
169	K	91.6	Very high	93.4	Very high	96 Å²	96	48.3 Å²	48.3	42%	0.417	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-44.8	167.7	176.3	179.7	-174.1	-171.1	0	111.1	S142 T167 S173 Y175	S142-K169 PolarHBondContact OG-NZ 3.26Å; T167-K169 PolarHBondContact O-N 2.92Å; K169-S173 WeakPolarHBondContact CA-O 3.28Å; K169-S173 WeakPolarHBondContact CB-O 3.39Å; K169-S173 PolarHBondContact N-O 3.32Å; K169-Y175 HydrophobicContact CB-CD2 3.67Å; K169-Y175 HydrophobicContact CB-CE1 4.42Å; K169-Y175 HydrophobicContact CB-CE2 3.55Å; K169-Y175 HydrophobicContact CB-CG 4.17Å; K169-Y175 HydrophobicContact CD-CD1 4.16Å; K169-Y175 HydrophobicContact CD-CE1 3.64Å; K169-Y175 HydrophobicContact CD-CE2 4.17Å; K169-Y175 HydrophobicContact CG-CD2 4.2Å; K169-Y175 HydrophobicContact CG-CE1 4.03Å; K169-Y175 HydrophobicContact CG-CE2 3.6Å
170	S	91.5	Very high	93.2	Very high	63 Å²	63	49 Å²	49	44%	0.441	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	178.9	177.3	60.5	0	0	0	0	109.8	N172 S173	S170-N172 PolarHBondContact O-N 3.29Å; S170-S173 PolarHBondContact N-O 3.02Å; S170-S173 PolarHBondContact O-N 3.38Å; S170-S173 VanDerWaalsContact O-N 3.15Å; S170-S173 WeakPolarHBondContact OG-CB 3.18Å
171	E	89.5	Confident	93.1	Very high	180 Å²	180	49.2 Å²	49.2	84%	0.841	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-32.3	-175	-170.6	179	178.1	0	0	114.7
172	N	93.7	Very high	92.9	Very high	78 Å²	78	48 Å²	48	42%	0.417	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	29	-179.7	-70.7	-60.5	0	0	0	112.6	K145 S170	K145-N172 HydrophobicContact CB-CB 3.97Å; K145-N172 WeakPolarHBondContact CD-OD1 3.12Å; K145-N172 PolarHBondContact N-O 3.28Å; S170-N172 PolarHBondContact O-N 3.29Å
173	S	95.5	Very high	92.8	Very high	13 Å²	13	41.7 Å²	41.7	9%	0.091	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	145.1	175.8	-172.9	0	0	0	0	111.7	L143 K169 S170	L143-S173 CarbonylContact O-C 3.46Å; L143-S173 VanDerWaalsContact O-CA 3.29Å; L143-S173 WeakPolarHBondContact O-CA 3.14Å; L143-S173 PolarHBondContact O-OG 3.38Å; K169-S173 WeakPolarHBondContact CA-O 3.28Å; K169-S173 WeakPolarHBondContact CB-O 3.39Å; K169-S173 PolarHBondContact N-O 3.32Å; S170-S173 PolarHBondContact N-O 3.02Å; S170-S173 PolarHBondContact O-N 3.38Å; S170-S173 VanDerWaalsContact O-N 3.15Å; S170-S173 WeakPolarHBondContact OG-CB 3.18Å
174	W	95.9	Very high	92.8	Very high	26 Å²	26	40 Å²	40	10%	0.098	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.7	-179.5	-54.8	-86.7	0	0	0	110.3	S142 L143 K145 A148 I157 L166 T167	S142-W174 CarbonylContact C-O 3.46Å; S142-W174 WeakPolarHBondContact CA-O 3.3Å; S142-W174 VanDerWaalsContact CB-O 3.25Å; S142-W174 WeakPolarHBondContact CB-O 3.5Å; L143-W174 PolarHBondContact N-O 3.28Å; L143-W174 PolarHBondContact O-N 3.05Å; K145-W174 HydrophobicContact CB-CH2 4.07Å; K145-W174 HydrophobicContact CB-CZ3 4.08Å; K145-W174 HydrophobicContact CG-CH2 4.22Å; A148-W174 HydrophobicContact CB-CZ3 3.94Å; I157-W174 HydrophobicContact CD1-CH2 4.49Å; I157-W174 HydrophobicContact CG2-CH2 4.07Å; I157-W174 HydrophobicContact CG2-CZ2 3.98Å; I157-W174 HydrophobicContact CG2-CZ3 4.43Å; L166-W174 HydrophobicContact CB-CB 4.02Å; L166-W174 HydrophobicContact CB-CG 4.35Å; L166-W174 HydrophobicContact CD1-CB 4.44Å; L166-W174 HydrophobicContact CD1-CG 4.48Å; L166-W174 HydrophobicContact CD2-CB 3.98Å; L166-W174 HydrophobicContact CG-CB 4.37Å; T167-W174 CarbonylContact O-C 3.34Å; T167-W174 WeakPolarHBondContact O-CA 3.3Å; T167-W174 VanDerWaalsContact O-CB 3.25Å; T167-W174 WeakPolarHBondContact O-CB 3.49Å
175	Y	95.5	Very high	92.8	Very high	56 Å²	56	40.4 Å²	40.4	22%	0.22	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	142.6	162.3	-65.8	-68.1	0	0	0	109.6	N95 L166 T167 K169	N95-Y175 HydrophobicContact CB-CD1 3.6Å; N95-Y175 HydrophobicContact CB-CD2 4.36Å; N95-Y175 HydrophobicContact CB-CE1 3.96Å; N95-Y175 HydrophobicContact CB-CG 3.83Å; L166-Y175 WeakPolarHBondContact CA-O 3.46Å; T167-Y175 PolarHBondContact N-O 3.39Å; T167-Y175 PolarHBondContact O-N 3.21Å; T167-Y175 WeakPolarHBondContact OG1-CB 3.46Å; K169-Y175 HydrophobicContact CB-CD2 3.67Å; K169-Y175 HydrophobicContact CB-CE1 4.42Å; K169-Y175 HydrophobicContact CB-CE2 3.55Å; K169-Y175 HydrophobicContact CB-CG 4.17Å; K169-Y175 HydrophobicContact CD-CD1 4.16Å; K169-Y175 HydrophobicContact CD-CE1 3.64Å; K169-Y175 HydrophobicContact CD-CE2 4.17Å; K169-Y175 HydrophobicContact CG-CD2 4.2Å; K169-Y175 HydrophobicContact CG-CE1 4.03Å; K169-Y175 HydrophobicContact CG-CE2 3.6Å
176	I	95.3	Very high	92.6	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	130.4	169.2	-66.3	168.4	0	0	0	107.7	L94 F112 F130 T134 Y138 L141 L143 L166	L94-I176 WeakPolarHBondContact CD2-O 3.41Å; F112-I176 HydrophobicContact CE2-CG2 4.37Å; F112-I176 HydrophobicContact CZ-CG2 4Å; F130-I176 HydrophobicContact CE1-CG2 4.2Å; F130-I176 HydrophobicContact CZ-CB 4.48Å; F130-I176 HydrophobicContact CZ-CG1 4.2Å; F130-I176 HydrophobicContact CZ-CG2 3.84Å; T134-I176 HydrophobicContact CG2-CD1 3.82Å; T134-I176 HydrophobicContact CG2-CG1 4.42Å; T134-I176 HydrophobicContact CG2-CG2 4.24Å; Y138-I176 HydrophobicContact CD1-CD1 3.62Å; Y138-I176 HydrophobicContact CE1-CD1 3.81Å; L141-I176 PolarHBondContact O-N 2.84Å; L143-I176 HydrophobicContact CB-CD1 4.39Å; L143-I176 HydrophobicContact CB-CG1 4.4Å; L166-I176 HydrophobicContact CD2-CG1 4.04Å
177	S	94.8	Very high	92.5	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.021	25%	0.249	C	C	.	.			trans	-135.5	175.1	-169	174.6	0	0	0	0	110.6	F112 F116 G164 A165 L181	F112-S177 WeakPolarHBondContact CE2-O 3.25Å; F116-S177 WeakPolarHBondContact CZ-O 3.42Å; G164-S177 CarbonylContact O-C 3.5Å; G164-S177 WeakPolarHBondContact O-CB 3.44Å; G164-S177 PolarHBondContact O-OG 3.5Å; A165-S177 PolarHBondContact O-N 2.89Å; S177-L181 WeakPolarHBondContact OG-CD2 3.48Å
178	T	93.1	Very high	92.4	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.012	24%	0.235	C	C	.	.			trans	-118.9	150.1	169.8	172.9	0	0	0	0	109	I62 L94 M107 S115 G164 Y180 L181	I62-T178 HydrophobicContact CD1-CG2 4.3Å; L94-T178 HydrophobicContact CD1-CG2 3.84Å; M107-T178 HydrophobicContact SD-CG2 3.75Å; S115-T178 VanDerWaalsContact CB-OG1 3.24Å; S115-T178 WeakPolarHBondContact CB-OG1 3.48Å; S115-T178 PolarHBondContact OG-OG1 2.98Å; G164-T178 CarbonylContact O-C 3.37Å; T178-Y180 PolarHBondContact O-N 3.41Å; T178-L181 HydrophobicContact CG2-CB 3.81Å; T178-L181 WeakPolarHBondContact O-CB 3.42Å; T178-L181 PolarHBondContact O-N 2.88Å
179	P	90.6	Very high	92.4	Very high	29 Å²	29	43.3 Å²	43.3	19%	0.188	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.8	-178.5	-27.3	35.7	0	0	0	114.1	F116 F119 N163	F116-P179 HydrophobicContact CD1-CG 3.84Å; F116-P179 HydrophobicContact CE1-CG 3.97Å; F119-P179 HydrophobicContact CD2-CB 3.78Å; F119-P179 HydrophobicContact CD2-CG 4Å; F119-P179 HydrophobicContact CE2-CB 3.32Å; F119-P179 HydrophobicContact CE2-CG 3.99Å; F119-P179 HydrophobicContact CZ-CB 3.83Å; N163-P179 WeakPolarHBondContact O-CB 3.37Å; N163-P179 WeakPolarHBondContact O-CG 3.35Å
180	Y	89.5	Confident	92.5	Very high	32 Å²	32	39.4 Å²	39.4	13%	0.125	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.2	-179.5	-63.2	-72.7	0	0	0	114.4	G59 D118 F119 T178 G182 A183 F184	G59-Y180 VanDerWaalsContact CA-CG 3.42Å; D118-Y180 HydrophobicContact CB-CE2 4.1Å; D118-Y180 WeakPolarHBondContact CB-OH 3.39Å; F119-Y180 HydrophobicContact CD2-CE2 4.37Å; F119-Y180 HydrophobicContact CE2-CD1 4.3Å; F119-Y180 HydrophobicContact CE2-CD2 4.04Å; F119-Y180 AromaticContact CE2-CE1 3.7Å; F119-Y180 HydrophobicContact CE2-CE1 3.7Å; F119-Y180 AromaticContact CE2-CE2 3.44Å; F119-Y180 HydrophobicContact CE2-CE2 3.44Å; F119-Y180 VanDerWaalsContact CE2-CE2 3.44Å; F119-Y180 HydrophobicContact CE2-CG 4.44Å; F119-Y180 AromaticContact CE2-CZ 3.22Å; F119-Y180 WeakPolarHBondContact CE2-OH 3.31Å; F119-Y180 HydrophobicContact CZ-CD1 4.07Å; F119-Y180 AromaticContact CZ-CE1 3.48Å; F119-Y180 HydrophobicContact CZ-CE1 3.48Å; F119-Y180 VanDerWaalsContact CZ-CE1 3.48Å; F119-Y180 HydrophobicContact CZ-CE2 4.13Å; F119-Y180 AromaticContact CZ-CZ 3.51Å; T178-Y180 PolarHBondContact O-N 3.41Å; Y180-G182 VanDerWaalsContact C-N 3.33Å; Y180-G182 PolarHBondContact O-N 3.39Å; Y180-A183 PolarHBondContact O-N 3.48Å; Y180-A183 VanDerWaalsContact O-N 3.11Å; Y180-F184 PolarHBondContact O-N 2.97Å
181	L	91.6	Very high	92.6	Very high	6 Å²	6	36.4 Å²	36.4	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-44.2	-170.5	-173.8	60.1	0	0	0	111.9	I62 L94 I96 S177 T178 A183 F184 I185	I62-L181 HydrophobicContact CD1-CD1 4.06Å; L94-L181 HydrophobicContact CD1-CD1 4.46Å; I96-L181 HydrophobicContact CD1-CD1 3.5Å; S177-L181 WeakPolarHBondContact OG-CD2 3.48Å; T178-L181 HydrophobicContact CG2-CB 3.81Å; T178-L181 WeakPolarHBondContact O-CB 3.42Å; T178-L181 PolarHBondContact O-N 2.88Å; L181-A183 VanDerWaalsContact C-N 3.33Å; L181-A183 PolarHBondContact O-N 3.03Å; L181-F184 HydrophobicContact CD1-CD1 4.25Å; L181-F184 WeakPolarHBondContact O-CB 3.2Å; L181-F184 PolarHBondContact O-N 2.97Å; L181-I185 HydrophobicContact CD1-CD1 4.31Å; L181-I185 HydrophobicContact CD1-CG1 4.28Å; L181-I185 HydrophobicContact CD2-CD1 4.49Å; L181-I185 HydrophobicContact CG-CD1 3.95Å; L181-I185 HydrophobicContact CG-CG1 4.31Å; L181-I185 VanDerWaalsContact O-CG1 3.3Å; L181-I185 WeakPolarHBondContact O-CG1 3.37Å; L181-I185 PolarHBondContact O-N 3.18Å
182	G	90.9	Very high	92.8	Very high	35 Å²	35	28.9 Å²	28.9	36%	0.361	15%	0.146	S	C	.	.	H	α-helix	trans	-62.5	-38	180	0	0	0	0	0	113.4	Y180 R186	Y180-G182 VanDerWaalsContact C-N 3.33Å; Y180-G182 PolarHBondContact O-N 3.39Å; G182-R186 WeakPolarHBondContact O-CG 3.26Å; G182-R186 PolarHBondContact O-N 3.06Å; G182-R186 PolarHBondContact O-NH1 3.31Å
183	A	90.5	Very high	92.9	Very high	21 Å²	21	33.6 Å²	33.6	17%	0.174	16%	0.158	C	C	.	.	H	α-helix	trans	-69.5	-42.5	176.5	0	0	0	0	0	111.5	I57 Y180 L181 R186 A187	I57-A183 VanDerWaalsContact O-CB 3.22Å; I57-A183 WeakPolarHBondContact O-CB 3.46Å; Y180-A183 PolarHBondContact O-N 3.48Å; Y180-A183 VanDerWaalsContact O-N 3.11Å; L181-A183 VanDerWaalsContact C-N 3.33Å; L181-A183 PolarHBondContact O-N 3.03Å; A183-R186 PolarHBondContact O-N 3.11Å; A183-A187 PolarHBondContact O-N 3.42Å; A183-A187 VanDerWaalsContact O-N 3.13Å
184	F	91.9	Very high	92.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57	-51.2	172.5	168.8	-95	0	0	0	111.9	I62 L64 I96 Y180 L181 R186 A187 Y188 L223 Y227	I62-F184 HydrophobicContact CB-CD1 4.35Å; I62-F184 HydrophobicContact CB-CD2 3.93Å; I62-F184 HydrophobicContact CB-CE1 4.16Å; I62-F184 HydrophobicContact CB-CE2 3.71Å; I62-F184 HydrophobicContact CB-CG 4.25Å; I62-F184 HydrophobicContact CB-CZ 3.84Å; I62-F184 HydrophobicContact CD1-CB 3.86Å; I62-F184 HydrophobicContact CD1-CD1 3.8Å; I62-F184 HydrophobicContact CD1-CD2 4.04Å; I62-F184 HydrophobicContact CD1-CE1 4.41Å; I62-F184 HydrophobicContact CD1-CG 3.6Å; I62-F184 HydrophobicContact CG1-CD2 4.48Å; I62-F184 HydrophobicContact CG1-CG 4.48Å; I62-F184 HydrophobicContact CG2-CD1 4.18Å; I62-F184 HydrophobicContact CG2-CE1 3.68Å; I62-F184 HydrophobicContact CG2-CE2 4.04Å; I62-F184 HydrophobicContact CG2-CZ 3.6Å; L64-F184 HydrophobicContact CD2-CE1 4.08Å; L64-F184 HydrophobicContact CD2-CZ 3.9Å; I96-F184 HydrophobicContact CD1-CD1 4.34Å; I96-F184 HydrophobicContact CD1-CE1 3.97Å; Y180-F184 PolarHBondContact O-N 2.97Å; L181-F184 HydrophobicContact CD1-CD1 4.25Å; L181-F184 WeakPolarHBondContact O-CB 3.2Å; L181-F184 PolarHBondContact O-N 2.97Å; F184-R186 VanDerWaalsContact C-N 3.3Å; F184-R186 PolarHBondContact O-N 3.14Å; F184-A187 PolarHBondContact O-N 3.24Å; F184-A187 VanDerWaalsContact O-N 3.1Å; F184-Y188 WeakPolarHBondContact O-CB 3.28Å; F184-Y188 PolarHBondContact O-N 3.17Å; F184-L223 HydrophobicContact CD2-CD1 4.21Å; F184-L223 HydrophobicContact CD2-CD2 4.33Å; F184-L223 HydrophobicContact CE2-CD1 3.77Å; F184-L223 HydrophobicContact CE2-CD2 4.13Å; F184-L223 HydrophobicContact CZ-CD1 4.47Å; F184-Y227 HydrophobicContact CE2-CE1 4.5Å; F184-Y227 VanDerWaalsContact CE2-OH 3.25Å; F184-Y227 WeakPolarHBondContact CE2-OH 3.25Å; F184-Y227 HydrophobicContact CZ-CE1 4.5Å; F184-Y227 WeakPolarHBondContact CZ-OH 3.48Å
185	I	91.8	Very high	92.9	Very high	28 Å²	28	32.3 Å²	32.3	14%	0.144	16%	0.155	C	C	.	.	H	α-helix	trans	-57.9	-43.4	-179.2	-68	177.9	0	0	0	111	I96 L181 A187 Y188 K189	I96-I185 HydrophobicContact CG2-CD1 4.17Å; I96-I185 HydrophobicContact CG2-CG1 3.86Å; L181-I185 HydrophobicContact CD1-CD1 4.31Å; L181-I185 HydrophobicContact CD1-CG1 4.28Å; L181-I185 HydrophobicContact CD2-CD1 4.49Å; L181-I185 HydrophobicContact CG-CD1 3.95Å; L181-I185 HydrophobicContact CG-CG1 4.31Å; L181-I185 VanDerWaalsContact O-CG1 3.3Å; L181-I185 WeakPolarHBondContact O-CG1 3.37Å; L181-I185 PolarHBondContact O-N 3.18Å; I185-A187 PolarHBondContact O-N 3.45Å; I185-Y188 PolarHBondContact O-N 3.07Å; I185-K189 HydrophobicContact CG2-CD 3.85Å; I185-K189 HydrophobicContact CG2-CG 4.19Å; I185-K189 WeakPolarHBondContact O-CB 3.47Å; I185-K189 WeakPolarHBondContact O-CG 3.31Å; I185-K189 PolarHBondContact O-N 3.39Å
186	R	91.5	Very high	92.9	Very high	171 Å²	171	31.1 Å²	31.1	65%	0.645	15%	0.152	S	C	*	.	H	α-helix	trans	-60.8	-44.4	177.6	-73.6	-172.2	-60.9	-92.7	5.4	111.9	G182 A183 F184 A190	G182-R186 WeakPolarHBondContact O-CG 3.26Å; G182-R186 PolarHBondContact O-N 3.06Å; G182-R186 PolarHBondContact O-NH1 3.31Å; A183-R186 PolarHBondContact O-N 3.11Å; F184-R186 VanDerWaalsContact C-N 3.3Å; F184-R186 PolarHBondContact O-N 3.14Å; R186-A190 VanDerWaalsContact O-CB 3.31Å; R186-A190 WeakPolarHBondContact O-CB 3.41Å; R186-A190 PolarHBondContact O-N 2.87Å
187	A	91.9	Very high	93	Very high	3 Å²	3	33.2 Å²	33.2	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-42	178.1	0	0	0	0	0	112.1	L58 A183 F184 I185 A190 G191 G220 Y222	L58-A187 HydrophobicContact CD2-CB 3.47Å; L58-A187 VanDerWaalsContact CD2-CB 3.47Å; A183-A187 PolarHBondContact O-N 3.42Å; A183-A187 VanDerWaalsContact O-N 3.13Å; F184-A187 PolarHBondContact O-N 3.24Å; F184-A187 VanDerWaalsContact O-N 3.1Å; I185-A187 PolarHBondContact O-N 3.45Å; A187-A190 PolarHBondContact O-N 2.86Å; A187-G191 PolarHBondContact O-N 3.24Å; A187-G191 VanDerWaalsContact O-N 3.12Å; A187-G220 VanDerWaalsContact CA-O 3.31Å; A187-G220 WeakPolarHBondContact CA-O 3.36Å; A187-Y222 HydrophobicContact CB-CD2 3.96Å
188	Y	92	Very high	93.1	Very high	6 Å²	6	34.3 Å²	34.3	2%	0.024	18%	0.175	C	C	.	.	H	α-helix	trans	-58.3	-55.4	174.7	174.7	-116.6	0	0	0	111.5	L64 F184 I185 A190 G191 Q192 L223 Y227 H228 A231	L64-Y188 HydrophobicContact CD1-CD1 4.22Å; L64-Y188 HydrophobicContact CD1-CD2 3.93Å; L64-Y188 HydrophobicContact CD1-CE1 3.65Å; L64-Y188 HydrophobicContact CD1-CE2 3.32Å; L64-Y188 HydrophobicContact CD1-CG 4.35Å; L64-Y188 WeakPolarHBondContact CD1-OH 3.3Å; L64-Y188 HydrophobicContact CG-CE2 4.49Å; F184-Y188 WeakPolarHBondContact O-CB 3.28Å; F184-Y188 PolarHBondContact O-N 3.17Å; I185-Y188 PolarHBondContact O-N 3.07Å; Y188-A190 VanDerWaalsContact C-N 3.28Å; Y188-A190 PolarHBondContact O-N 3.21Å; Y188-G191 PolarHBondContact O-N 3.38Å; Y188-Q192 HydrophobicContact CD1-CG 4.35Å; Y188-Q192 HydrophobicContact CD2-CG 3.83Å; Y188-Q192 HydrophobicContact CE1-CG 3.91Å; Y188-Q192 VanDerWaalsContact CE2-CD 3.41Å; Y188-Q192 HydrophobicContact CE2-CG 3.32Å; Y188-Q192 HydrophobicContact CG-CG 4.3Å; Y188-Q192 WeakPolarHBondContact O-CG 3.5Å; Y188-Q192 PolarHBondContact O-N 2.67Å; Y188-Q192 PolarHBondContact OH-OE1 3.4Å; Y188-L223 HydrophobicContact CD2-CD1 4.47Å; Y188-Y227 HydrophobicContact CD2-CD1 4.49Å; Y188-Y227 AromaticContact CD2-CE1 3.95Å; Y188-Y227 HydrophobicContact CD2-CE1 3.95Å; Y188-Y227 HydrophobicContact CE2-CE1 4.38Å; Y188-H228 AromaticContact CD2-ND1 3.97Å; Y188-A231 HydrophobicContact CE2-CB 3.98Å
189	K	92.3	Very high	93.3	Very high	60 Å²	60	34.2 Å²	34.2	26%	0.261	17%	0.174	S	C	.	.	H	α-helix	trans	-62.8	-32	178.9	-70.7	-174.3	178.7	-177.5	0	112.8	D97 D98 I185 R193	D97-K189 PolarHBondContact O-NZ 3.32Å; D98-K189 VanDerWaalsContact OD1-CE 3.25Å; D98-K189 WeakPolarHBondContact OD1-CE 3.39Å; D98-K189 IonicContact OD1-NZ 3Å; D98-K189 PolarHBondContact OD1-NZ 3.13Å; I185-K189 HydrophobicContact CG2-CD 3.85Å; I185-K189 HydrophobicContact CG2-CG 4.19Å; I185-K189 WeakPolarHBondContact O-CB 3.47Å; I185-K189 WeakPolarHBondContact O-CG 3.31Å; I185-K189 PolarHBondContact O-N 3.39Å; K189-R193 WeakPolarHBondContact O-CB 3.34Å; K189-R193 VanDerWaalsContact O-CG 3.28Å; K189-R193 WeakPolarHBondContact O-CG 3.28Å; K189-R193 PolarHBondContact O-N 2.96Å; K189-R193 PolarHBondContact O-NE 3.5Å; K189-R193 VanDerWaalsContact O-NE 3.15Å
190	A	93.2	Very high	93.6	Very high	15 Å²	15	38.4 Å²	38.4	12%	0.124	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-49.9	173.8	0	0	0	0	0	111.4	R186 A187 Y188 R193 G194	R186-A190 VanDerWaalsContact O-CB 3.31Å; R186-A190 WeakPolarHBondContact O-CB 3.41Å; R186-A190 PolarHBondContact O-N 2.87Å; A187-A190 PolarHBondContact O-N 2.86Å; Y188-A190 VanDerWaalsContact C-N 3.28Å; Y188-A190 PolarHBondContact O-N 3.21Å; A190-R193 PolarHBondContact O-N 3.32Å; A190-G194 PolarHBondContact O-N 3.37Å
191	G	93.6	Very high	94	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72.6	-34.5	-179.8	0	0	0	0	0	114.5	A187 Y188 R193 G194 L195 H228	A187-G191 PolarHBondContact O-N 3.24Å; A187-G191 VanDerWaalsContact O-N 3.12Å; Y188-G191 PolarHBondContact O-N 3.38Å; G191-R193 PolarHBondContact O-N 2.93Å; G191-G194 PolarHBondContact O-N 3.45Å; G191-L195 PolarHBondContact O-N 2.81Å; G191-H228 WeakPolarHBondContact CA-NE2 3.31Å
192	Q	93.8	Very high	94.3	Very high	21 Å²	21	46.8 Å²	46.8	10%	0.098	23%	0.229	C	C	.	.	H	α-helix	trans	-58.4	-47.9	172.2	-71.1	-67.5	-70.1	0	0	111.5	Y188 L196 H228 H232	Y188-Q192 HydrophobicContact CD1-CG 4.35Å; Y188-Q192 HydrophobicContact CD2-CG 3.83Å; Y188-Q192 HydrophobicContact CE1-CG 3.91Å; Y188-Q192 VanDerWaalsContact CE2-CD 3.41Å; Y188-Q192 HydrophobicContact CE2-CG 3.32Å; Y188-Q192 HydrophobicContact CG-CG 4.3Å; Y188-Q192 WeakPolarHBondContact O-CG 3.5Å; Y188-Q192 PolarHBondContact O-N 2.67Å; Y188-Q192 PolarHBondContact OH-OE1 3.4Å; Q192-L196 WeakPolarHBondContact O-CG 3.32Å; Q192-L196 PolarHBondContact O-N 3.15Å; Q192-L196 VanDerWaalsContact O-N 3.16Å; Q192-H228 VanDerWaalsContact NE2-CA 3.25Å; Q192-H228 PolarHBondContact NE2-O 3Å; Q192-H232 VanDerWaalsContact CD-NE2 3.32Å; Q192-H232 PolarHBondContact NE2-CD2 2.94Å; Q192-H232 PolarHBondContact O-NE2 3.26Å; Q192-H232 VanDerWaalsContact O-NE2 3.12Å; Q192-H232 PolarHBondContact OE1-CD2 2.81Å; Q192-H232 PolarHBondContact OE1-CE1 2.87Å; Q192-H232 PolarHBondContact OE1-ND1 2.97Å; Q192-H232 PolarHBondContact OE1-NE2 2.88Å
193	R	94.9	Very high	94.5	Very high	178 Å²	178	55.7 Å²	55.7	67%	0.672	25%	0.252	S	S	*	.	H	α-helix	trans	-64.3	-41.1	175.7	-72.3	-176.8	-64.2	168.6	-0.2	111.9	K189 A190 G191 L196 A197	K189-R193 WeakPolarHBondContact O-CB 3.34Å; K189-R193 VanDerWaalsContact O-CG 3.28Å; K189-R193 WeakPolarHBondContact O-CG 3.28Å; K189-R193 PolarHBondContact O-N 2.96Å; K189-R193 PolarHBondContact O-NE 3.5Å; K189-R193 VanDerWaalsContact O-NE 3.15Å; A190-R193 PolarHBondContact O-N 3.32Å; G191-R193 PolarHBondContact O-N 2.93Å; R193-L196 PolarHBondContact O-N 3.12Å; R193-A197 VanDerWaalsContact O-CB 3.24Å; R193-A197 WeakPolarHBondContact O-CB 3.38Å; R193-A197 PolarHBondContact O-N 3.36Å
194	G	96.5	Very high	94.8	Very high	12 Å²	12	61.1 Å²	61.1	12%	0.124	27%	0.272	C	S	.	.	H	α-helix	trans	-57.4	-51.1	177.1	0	0	0	0	0	112.7	A190 G191 A197 I198 L217	A190-G194 PolarHBondContact O-N 3.37Å; G191-G194 PolarHBondContact O-N 3.45Å; G194-A197 PolarHBondContact O-N 3.19Å; G194-I198 WeakPolarHBondContact O-CD1 3.48Å; G194-I198 WeakPolarHBondContact O-CG1 3.39Å; G194-I198 PolarHBondContact O-N 3.18Å; G194-L217 VanDerWaalsContact CA-O 3.26Å; G194-L217 WeakPolarHBondContact CA-O 3.36Å
195	L	96.4	Very high	95.1	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-46.6	179.7	-174.9	54.3	0	0	0	111.9	G191 A197 I198 I199 I212 L217 H228 L229 L238	G191-L195 PolarHBondContact O-N 2.81Å; L195-A197 VanDerWaalsContact C-N 3.3Å; L195-A197 PolarHBondContact O-N 3.14Å; L195-I198 WeakPolarHBondContact O-CB 3.49Å; L195-I198 PolarHBondContact O-N 3.2Å; L195-I199 HydrophobicContact CD1-CD1 4.14Å; L195-I199 HydrophobicContact CD1-CG1 4.49Å; L195-I199 HydrophobicContact CG-CD1 4.19Å; L195-I199 PolarHBondContact O-N 3.42Å; L195-I199 VanDerWaalsContact O-N 3.11Å; L195-I212 HydrophobicContact CD1-CD1 4.42Å; L195-I212 HydrophobicContact CD1-CG1 4.44Å; L195-I212 HydrophobicContact CD1-CG2 3.68Å; L195-L217 HydrophobicContact CB-CD2 4.03Å; L195-L217 HydrophobicContact CD1-CD2 4.21Å; L195-H228 HydrophobicContact CD2-CB 4.32Å; L195-L229 HydrophobicContact CD2-CB 4.05Å; L195-L229 HydrophobicContact CD2-CD1 4.31Å; L195-L238 HydrophobicContact CD2-CD1 4.15Å; L195-L238 HydrophobicContact CG-CD1 4.38Å
196	L	95.9	Very high	95.3	Very high	31 Å²	31	68.1 Å²	68.1	16%	0.162	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-40.2	176	-74.9	176.9	0	0	0	112.2	Q192 R193 I198 I199 K200 H232 T237 L238 L251	Q192-L196 WeakPolarHBondContact O-CG 3.32Å; Q192-L196 PolarHBondContact O-N 3.15Å; Q192-L196 VanDerWaalsContact O-N 3.16Å; R193-L196 PolarHBondContact O-N 3.12Å; L196-I198 VanDerWaalsContact C-N 3.32Å; L196-I198 PolarHBondContact O-N 3.19Å; L196-I199 PolarHBondContact O-N 3.47Å; L196-K200 VanDerWaalsContact O-CB 3.25Å; L196-K200 WeakPolarHBondContact O-CB 3.15Å; L196-K200 VanDerWaalsContact O-CG 3.23Å; L196-K200 WeakPolarHBondContact O-CG 3.37Å; L196-K200 PolarHBondContact O-N 2.72Å; L196-H232 VanDerWaalsContact CD1-CE1 3.46Å; L196-H232 WeakPolarHBondContact CD1-CE1 3.33Å; L196-H232 VanDerWaalsContact CG-CE1 3.41Å; L196-H232 WeakPolarHBondContact CG-CE1 3.48Å; L196-T237 HydrophobicContact CD1-CG2 4.37Å; L196-T237 HydrophobicContact CD2-CG2 3.95Å; L196-L238 HydrophobicContact CD2-CD2 4.02Å; L196-L238 HydrophobicContact CD2-CG 4.42Å; L196-L251 HydrophobicContact CD2-CD1 3.61Å
197	A	96.7	Very high	95.6	Very high	44 Å²	44	60.5 Å²	60.5	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-36	179	0	0	0	0	0	112.2	R193 G194 L195 K201	R193-A197 VanDerWaalsContact O-CB 3.24Å; R193-A197 WeakPolarHBondContact O-CB 3.38Å; R193-A197 PolarHBondContact O-N 3.36Å; G194-A197 PolarHBondContact O-N 3.19Å; L195-A197 VanDerWaalsContact C-N 3.3Å; L195-A197 PolarHBondContact O-N 3.14Å; A197-K201 WeakPolarHBondContact O-CD 3.32Å; A197-K201 WeakPolarHBondContact O-CG 3.5Å; A197-K201 PolarHBondContact O-N 2.97Å
198	I	96.9	Very high	95.8	Very high	26 Å²	26	62 Å²	62	13%	0.133	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-51.7	173.7	-72.2	157	0	0	0	110.3	G194 L195 L196 K201 L207 R215 L217	G194-I198 WeakPolarHBondContact O-CD1 3.48Å; G194-I198 WeakPolarHBondContact O-CG1 3.39Å; G194-I198 PolarHBondContact O-N 3.18Å; L195-I198 WeakPolarHBondContact O-CB 3.49Å; L195-I198 PolarHBondContact O-N 3.2Å; L196-I198 VanDerWaalsContact C-N 3.32Å; L196-I198 PolarHBondContact O-N 3.19Å; I198-K201 PolarHBondContact O-N 3.4Å; I198-L207 HydrophobicContact CG2-CD2 3.73Å; I198-R215 HydrophobicContact CD1-CB 3.62Å; I198-R215 HydrophobicContact CG1-CB 4.14Å; I198-R215 HydrophobicContact CG2-CB 3.95Å; I198-R215 HydrophobicContact CG2-CG 3.72Å; I198-L217 HydrophobicContact CD1-CD2 3.76Å
199	I	97.4	Very high	96	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-44.7	-176.1	-65.2	172.3	0	0	0	110.6	L195 L196 K201 T202 K205 I212 L238 I249 L251	L195-I199 HydrophobicContact CD1-CD1 4.14Å; L195-I199 HydrophobicContact CD1-CG1 4.49Å; L195-I199 HydrophobicContact CG-CD1 4.19Å; L195-I199 PolarHBondContact O-N 3.42Å; L195-I199 VanDerWaalsContact O-N 3.11Å; L196-I199 PolarHBondContact O-N 3.47Å; I199-K201 PolarHBondContact O-N 3.31Å; I199-K201 VanDerWaalsContact O-N 3.1Å; I199-T202 PolarHBondContact O-N 3.18Å; I199-T202 PolarHBondContact O-OG1 2.82Å; I199-K205 VanDerWaalsContact CG2-C 3.48Å; I199-K205 WeakPolarHBondContact CG2-O 3.46Å; I199-K205 WeakPolarHBondContact O-CA 3.48Å; I199-I212 HydrophobicContact CD1-CD1 4.5Å; I199-L238 HydrophobicContact CD1-CD1 3.57Å; I199-L238 HydrophobicContact CD1-CD2 3.72Å; I199-L238 HydrophobicContact CD1-CG 4.34Å; I199-I249 HydrophobicContact CD1-CG2 4.06Å; I199-L251 HydrophobicContact CG2-CB 4.48Å
200	K	97.4	Very high	96.1	Very high	117 Å²	117	61.7 Å²	61.7	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-22.2	178.5	-75.6	177.4	179.2	-176.6	0	114.2	L196 L251	L196-K200 VanDerWaalsContact O-CB 3.25Å; L196-K200 WeakPolarHBondContact O-CB 3.15Å; L196-K200 VanDerWaalsContact O-CG 3.23Å; L196-K200 WeakPolarHBondContact O-CG 3.37Å; L196-K200 PolarHBondContact O-N 2.72Å; K200-L251 HydrophobicContact CG-CD2 4.12Å
201	K	96.8	Very high	96.1	Very high	180 Å²	180	64.4 Å²	64.4	78%	0.783	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-13.6	177.6	-76.8	174.7	-177.7	-175.7	0	113.4	A197 I198 I199	A197-K201 WeakPolarHBondContact O-CD 3.32Å; A197-K201 WeakPolarHBondContact O-CG 3.5Å; A197-K201 PolarHBondContact O-N 2.97Å; I198-K201 PolarHBondContact O-N 3.4Å; I199-K201 PolarHBondContact O-N 3.31Å; I199-K201 VanDerWaalsContact O-N 3.1Å
202	T	97.1	Very high	96.2	Very high	35 Å²	35	64.4 Å²	64.4	22%	0.215	30%	0.298	C	S	.	.	S	Bend	trans	-77.1	152.7	176.4	76.6	0	0	0	0	110.2	I199 F204 K205 E206 L207	I199-T202 PolarHBondContact O-N 3.18Å; I199-T202 PolarHBondContact O-OG1 2.82Å; T202-F204 PolarHBondContact O-N 3.37Å; T202-K205 PolarHBondContact O-N 3.42Å; T202-K205 WeakPolarHBondContact OG1-CA 3.04Å; T202-K205 PolarHBondContact OG1-N 3.42Å; T202-E206 WeakPolarHBondContact CB-O 3.46Å; T202-E206 WeakPolarHBondContact CG2-O 3.43Å; T202-E206 PolarHBondContact OG1-N 3.15Å; T202-E206 PolarHBondContact OG1-O 3.17Å; T202-L207 HydrophobicContact CG2-CB 4.47Å; T202-L207 HydrophobicContact CG2-CD1 4.2Å
203	R	95.7	Very high	96.1	Very high	222 Å²	222	65.8 Å²	65.8	84%	0.838	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-40	-175.3	178.4	177.6	174.5	171.1	-1	113.1
204	F	96.9	Very high	96	Very high	134 Å²	134	63.5 Å²	63.5	59%	0.588	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	9.4	-175.3	-56.1	-66	0	0	0	113.1	T202 E206	T202-F204 PolarHBondContact O-N 3.37Å; F204-E206 HydrophobicContact CB-CG 3.79Å; F204-E206 PolarHBondContact O-N 3.48Å
205	K	98	Very high	95.9	Very high	116 Å²	116	68.4 Å²	68.4	50%	0.504	32%	0.315	S	S	.	.	S	Bend	trans	56.2	36.3	-176.3	-53	174	-177.1	171.5	0	113.1	I199 T202 R250 L251	I199-K205 VanDerWaalsContact CG2-C 3.48Å; I199-K205 WeakPolarHBondContact CG2-O 3.46Å; I199-K205 WeakPolarHBondContact O-CA 3.48Å; T202-K205 PolarHBondContact O-N 3.42Å; T202-K205 WeakPolarHBondContact OG1-CA 3.04Å; T202-K205 PolarHBondContact OG1-N 3.42Å; K205-R250 WeakPolarHBondContact O-CA 3.49Å; K205-L251 HydrophobicContact CB-CB 4.18Å; K205-L251 HydrophobicContact CD-CD2 4.29Å; K205-L251 PolarHBondContact O-N 3.03Å
206	E	97.3	Very high	95.8	Very high	60 Å²	60	75 Å²	75	28%	0.28	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156	178.3	67.8	-165.4	-169.8	0	0	110.6	T202 F204 L248 I249 R250	T202-E206 WeakPolarHBondContact CB-O 3.46Å; T202-E206 WeakPolarHBondContact CG2-O 3.43Å; T202-E206 PolarHBondContact OG1-N 3.15Å; T202-E206 PolarHBondContact OG1-O 3.17Å; F204-E206 HydrophobicContact CB-CG 3.79Å; F204-E206 PolarHBondContact O-N 3.48Å; E206-L248 HydrophobicContact CB-CD1 4.15Å; E206-L248 HydrophobicContact CB-CD2 4.22Å; E206-L248 HydrophobicContact CB-CG 4.1Å; E206-L248 HydrophobicContact CG-CD1 4.08Å; E206-L248 HydrophobicContact CG-CD2 4.14Å; E206-L248 HydrophobicContact CG-CG 4.34Å; E206-L248 WeakPolarHBondContact OE2-CD2 3.43Å; E206-I249 CarbonylContact C-O 3.6Å; E206-I249 WeakPolarHBondContact CA-O 3.49Å; E206-R250 HydrophobicContact CB-CB 3.59Å
207	L	96.6	Very high	95.7	Very high	10 Å²	10	74.1 Å²	74.1	5%	0.052	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	140	-178.7	-167.6	61.3	0	0	0	109.9	I198 T202 E211 I212 R215 I249	I198-L207 HydrophobicContact CG2-CD2 3.73Å; T202-L207 HydrophobicContact CG2-CB 4.47Å; T202-L207 HydrophobicContact CG2-CD1 4.2Å; L207-E211 HydrophobicContact CD1-CB 3.81Å; L207-E211 HydrophobicContact CD1-CG 4.46Å; L207-E211 WeakPolarHBondContact CD1-OE2 3.45Å; L207-E211 HydrophobicContact CD2-CB 4.33Å; L207-E211 HydrophobicContact CG-CB 3.87Å; L207-I212 HydrophobicContact CB-CG1 4.27Å; L207-I212 HydrophobicContact CD2-CG1 3.72Å; L207-I212 HydrophobicContact CG-CG1 4.08Å; L207-R215 HydrophobicContact CD2-CG 4.01Å; L207-I249 PolarHBondContact N-O 3.16Å; L207-I249 PolarHBondContact O-N 3.22Å
208	L	96.5	Very high	95.5	Very high	34 Å²	34	73.9 Å²	73.9	18%	0.178	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	143.2	174.2	-70.4	173.1	0	0	0	110.6	S210 E211 I212 L248	L208-S210 VanDerWaalsContact C-N 3.26Å; L208-S210 PolarHBondContact O-N 3.2Å; L208-E211 HydrophobicContact CB-CB 4.37Å; L208-E211 HydrophobicContact CB-CG 4.21Å; L208-E211 WeakPolarHBondContact O-CB 3.34Å; L208-E211 PolarHBondContact O-N 3.02Å; L208-I212 PolarHBondContact O-N 3.45Å; L208-I212 VanDerWaalsContact O-N 3.12Å; L208-L248 HydrophobicContact CD2-CB 4.41Å; L208-L248 HydrophobicContact CD2-CD1 3.97Å; L208-L248 HydrophobicContact CG-CD1 4.3Å
209	L	96	Very high	95.3	Very high	1 Å²	1	82.4 Å²	82.4	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-54.5	-45.4	178.1	176.4	58	0	0	0	111.4	V30 E211 I212 F213 L229 L247 I249	V30-L209 HydrophobicContact CG1-CD2 4.15Å; L209-E211 PolarHBondContact O-N 2.78Å; L209-I212 WeakPolarHBondContact O-CB 3.4Å; L209-I212 PolarHBondContact O-N 3.02Å; L209-I212 VanDerWaalsContact O-N 3.15Å; L209-F213 HydrophobicContact CD1-CD2 4.44Å; L209-F213 HydrophobicContact CD1-CE2 3.65Å; L209-F213 HydrophobicContact CD1-CZ 4.48Å; L209-F213 HydrophobicContact CG-CE2 4.02Å; L209-F213 WeakPolarHBondContact O-CD2 3.43Å; L209-L229 HydrophobicContact CD1-CD2 3.23Å; L209-L247 HydrophobicContact CB-CB 4.21Å; L209-L247 WeakPolarHBondContact CB-O 3.15Å; L209-L247 HydrophobicContact CD2-CD2 3.88Å; L209-L247 PolarHBondContact N-O 3.13Å; L209-I249 HydrophobicContact CB-CG1 4.36Å; L209-I249 HydrophobicContact CD1-CG1 4.49Å
210	S	93.6	Very high	94.9	Very high	60 Å²	60	83.2 Å²	83.2	42%	0.42	39%	0.392	S	S	.	.	H	α-helix	trans	-57.4	-36.6	176.9	51.7	0	0	0	0	112.5	L208 H214	L208-S210 VanDerWaalsContact C-N 3.26Å; L208-S210 PolarHBondContact O-N 3.2Å; S210-H214 PolarHBondContact O-CD2 2.84Å
211	E	94.2	Very high	94.6	Very high	71 Å²	71	78.5 Å²	78.5	33%	0.332	38%	0.375	S	S	.	.	H	α-helix	trans	-73.4	-33.4	178.3	-73.5	-170	-138.1	0	0	113.1	L207 L208 L209 F213 H214 R215	L207-E211 HydrophobicContact CD1-CB 3.81Å; L207-E211 HydrophobicContact CD1-CG 4.46Å; L207-E211 WeakPolarHBondContact CD1-OE2 3.45Å; L207-E211 HydrophobicContact CD2-CB 4.33Å; L207-E211 HydrophobicContact CG-CB 3.87Å; L208-E211 HydrophobicContact CB-CB 4.37Å; L208-E211 HydrophobicContact CB-CG 4.21Å; L208-E211 WeakPolarHBondContact O-CB 3.34Å; L208-E211 PolarHBondContact O-N 3.02Å; L209-E211 PolarHBondContact O-N 2.78Å; E211-F213 PolarHBondContact O-N 3.28Å; E211-H214 WeakPolarHBondContact O-CB 3.23Å; E211-H214 PolarHBondContact O-N 3.41Å; E211-R215 WeakPolarHBondContact O-CG 3.46Å; E211-R215 IonicContact OE2-NH2 2.94Å; E211-R215 PolarHBondContact OE2-NH2 3.41Å
212	I	95.2	Very high	94.3	Very high	0 Å²	0	75 Å²	75	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-54.9	-42.4	179.8	-73.5	171	0	0	0	111	L195 I199 L207 L208 L209 H214 R215 H225 L229 I249	L195-I212 HydrophobicContact CD1-CD1 4.42Å; L195-I212 HydrophobicContact CD1-CG1 4.44Å; L195-I212 HydrophobicContact CD1-CG2 3.68Å; I199-I212 HydrophobicContact CD1-CD1 4.5Å; L207-I212 HydrophobicContact CB-CG1 4.27Å; L207-I212 HydrophobicContact CD2-CG1 3.72Å; L207-I212 HydrophobicContact CG-CG1 4.08Å; L208-I212 PolarHBondContact O-N 3.45Å; L208-I212 VanDerWaalsContact O-N 3.12Å; L209-I212 WeakPolarHBondContact O-CB 3.4Å; L209-I212 PolarHBondContact O-N 3.02Å; L209-I212 VanDerWaalsContact O-N 3.15Å; I212-H214 PolarHBondContact O-N 3.5Å; I212-R215 WeakPolarHBondContact O-CB 3.18Å; I212-R215 PolarHBondContact O-N 2.95Å; I212-H225 HydrophobicContact CG2-CB 4.44Å; I212-H225 PolarHBondContact O-CD2 2.83Å; I212-H225 PolarHBondContact O-NE2 3.38Å; I212-L229 HydrophobicContact CD1-CD1 4.46Å; I212-I249 HydrophobicContact CD1-CB 3.75Å; I212-I249 HydrophobicContact CD1-CG1 3.65Å; I212-I249 HydrophobicContact CD1-CG2 4.13Å
213	F	92.4	Very high	94	Very high	51 Å²	51	73.5 Å²	73.5	22%	0.224	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.3	179.8	-70.7	-85.5	0	0	0	114.2	V30 L209 E211 H225 M226	V30-F213 HydrophobicContact CB-CD2 4.27Å; V30-F213 HydrophobicContact CB-CE2 3.55Å; V30-F213 HydrophobicContact CB-CZ 3.68Å; V30-F213 HydrophobicContact CG1-CE2 3.81Å; V30-F213 HydrophobicContact CG1-CZ 3.77Å; V30-F213 HydrophobicContact CG2-CE1 4.19Å; V30-F213 HydrophobicContact CG2-CE2 4.09Å; V30-F213 HydrophobicContact CG2-CZ 3.76Å; L209-F213 HydrophobicContact CD1-CD2 4.44Å; L209-F213 HydrophobicContact CD1-CE2 3.65Å; L209-F213 HydrophobicContact CD1-CZ 4.48Å; L209-F213 HydrophobicContact CG-CE2 4.02Å; L209-F213 WeakPolarHBondContact O-CD2 3.43Å; E211-F213 PolarHBondContact O-N 3.28Å; F213-H225 HydrophobicContact CD1-CB 3.86Å; F213-H225 HydrophobicContact CE1-CB 3.88Å; F213-M226 HydrophobicContact CE1-CG 3.77Å; F213-M226 HydrophobicContact CE1-SD 4.4Å; F213-M226 HydrophobicContact CE2-SD 4.37Å; F213-M226 HydrophobicContact CZ-CG 3.5Å; F213-M226 HydrophobicContact CZ-SD 3.54Å; F213-M226 VanDerWaalsContact CZ-SD 3.54Å
214	H	92.8	Very high	93.8	Very high	130 Å²	130	64.3 Å²	64.3	60%	0.602	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.1	175.8	-62.8	-62.7	0	0	0	113.1	S210 E211 I212	S210-H214 PolarHBondContact O-CD2 2.84Å; E211-H214 WeakPolarHBondContact O-CB 3.23Å; E211-H214 PolarHBondContact O-N 3.41Å; I212-H214 PolarHBondContact O-N 3.5Å
215	R	93.5	Very high	93.6	Very high	114 Å²	114	60 Å²	60	43%	0.43	30%	0.304	S	S	.	.	S	Bend	trans	-94.9	144.9	179.9	-53.9	-61.8	-178	-168.6	-2.8	110.7	I198 L207 E211 I212 H225	I198-R215 HydrophobicContact CD1-CB 3.62Å; I198-R215 HydrophobicContact CG1-CB 4.14Å; I198-R215 HydrophobicContact CG2-CB 3.95Å; I198-R215 HydrophobicContact CG2-CG 3.72Å; L207-R215 HydrophobicContact CD2-CG 4.01Å; E211-R215 WeakPolarHBondContact O-CG 3.46Å; E211-R215 IonicContact OE2-NH2 2.94Å; E211-R215 PolarHBondContact OE2-NH2 3.41Å; I212-R215 WeakPolarHBondContact O-CB 3.18Å; I212-R215 PolarHBondContact O-N 2.95Å; R215-H225 PolarHBondContact O-NE2 3.15Å
216	N	94.6	Very high	93.5	Very high	139 Å²	139	55.3 Å²	55.3	74%	0.743	28%	0.284	S	S	*	.			trans	-84.8	116.9	174.8	-174.5	-12.7	0	0	0	110.1	G218	N216-G218 PolarHBondContact O-N 3.4Å; N216-G218 WeakPolarHBondContact OD1-CA 3.09Å; N216-G218 PolarHBondContact OD1-N 2.77Å
217	L	94.8	Very high	93.3	Very high	12 Å²	12	52.5 Å²	52.5	6%	0.063	27%	0.271	C	S	.	.			trans	-68.2	-10.3	177.4	-61.8	-179	0	0	0	113.8	G194 L195 I198 A221	G194-L217 VanDerWaalsContact CA-O 3.26Å; G194-L217 WeakPolarHBondContact CA-O 3.36Å; L195-L217 HydrophobicContact CB-CD2 4.03Å; L195-L217 HydrophobicContact CD1-CD2 4.21Å; I198-L217 HydrophobicContact CD1-CD2 3.76Å; L217-A221 HydrophobicContact CB-CB 3.44Å; L217-A221 VanDerWaalsContact CB-CB 3.44Å; L217-A221 HydrophobicContact CD1-CB 4.09Å; L217-A221 HydrophobicContact CG-CB 4.44Å
218	G	93.1	Very high	93.2	Very high	39 Å²	39	52 Å²	52	40%	0.402	27%	0.268	S	S	.	.			trans	93.2	-178.6	-179.3	0	0	0	0	0	113.5	N216	N216-G218 PolarHBondContact O-N 3.4Å; N216-G218 WeakPolarHBondContact OD1-CA 3.09Å; N216-G218 PolarHBondContact OD1-N 2.77Å
219	K	91.4	Very high	93.2	Very high	206 Å²	206	50.4 Å²	50.4	90%	0.896	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	139.9	-178.3	-64.1	-176.7	-179.4	-179.4	0	110.6	A221	K219-A221 VanDerWaalsContact C-N 3.31Å; K219-A221 PolarHBondContact O-N 3.06Å
220	G	89.6	Confident	93.1	Very high	16 Å²	16	50.4 Å²	50.4	17%	0.165	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	-9.5	176.1	0	0	0	0	0	115.3	A187 Y222	A187-G220 VanDerWaalsContact CA-O 3.31Å; A187-G220 WeakPolarHBondContact CA-O 3.36Å; G220-Y222 WeakPolarHBondContact O-CD2 3.09Å; G220-Y222 PolarHBondContact O-N 2.63Å
221	A	90.2	Very high	93.2	Very high	19 Å²	19	47.5 Å²	47.5	16%	0.157	24%	0.24	C	C	.	.			trans	-79	64.6	178.7	0	0	0	0	0	111.6	L217 K219	L217-A221 HydrophobicContact CB-CB 3.44Å; L217-A221 VanDerWaalsContact CB-CB 3.44Å; L217-A221 HydrophobicContact CD1-CB 4.09Å; L217-A221 HydrophobicContact CG-CB 4.44Å; K219-A221 VanDerWaalsContact C-N 3.31Å; K219-A221 PolarHBondContact O-N 3.06Å
222	Y	90.2	Very high	93.2	Very high	107 Å²	107	44.4 Å²	44.4	42%	0.42	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-20	-170.4	-59.2	-58.7	0	0	0	114.2	P51 L58 A187 G220 G224	P51-Y222 WeakPolarHBondContact CG-O 3.29Å; L58-Y222 HydrophobicContact CD2-CD2 4.49Å; A187-Y222 HydrophobicContact CB-CD2 3.96Å; G220-Y222 WeakPolarHBondContact O-CD2 3.09Å; G220-Y222 PolarHBondContact O-N 2.63Å; Y222-G224 VanDerWaalsContact C-N 3.32Å; Y222-G224 PolarHBondContact O-N 3.47Å
223	L	91.6	Very high	93.2	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.016	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-7.1	-171	-64.6	162.5	0	0	0	114.1	L58 F184 Y188 Y227	L58-L223 HydrophobicContact CD1-CD2 3.81Å; L58-L223 HydrophobicContact CD1-CG 4.37Å; F184-L223 HydrophobicContact CD2-CD1 4.21Å; F184-L223 HydrophobicContact CD2-CD2 4.33Å; F184-L223 HydrophobicContact CE2-CD1 3.77Å; F184-L223 HydrophobicContact CE2-CD2 4.13Å; F184-L223 HydrophobicContact CZ-CD1 4.47Å; Y188-L223 HydrophobicContact CD2-CD1 4.47Å; L223-Y227 HydrophobicContact CB-CD1 3.7Å; L223-Y227 HydrophobicContact CB-CD2 4.27Å; L223-Y227 HydrophobicContact CB-CE1 4.28Å; L223-Y227 HydrophobicContact CB-CG 3.73Å; L223-Y227 HydrophobicContact CD1-CD1 3.92Å; L223-Y227 HydrophobicContact CD1-CE1 3.68Å; L223-Y227 HydrophobicContact CD2-CE2 4.36Å; L223-Y227 HydrophobicContact CG-CD1 4.31Å; L223-Y227 HydrophobicContact CG-CE1 4.41Å; L223-Y227 WeakPolarHBondContact O-CB 3.43Å
224	G	91	Very high	93.2	Very high	29 Å²	29	43.2 Å²	43.2	30%	0.299	22%	0.222	S	C	.	.			trans	84.3	159.8	176.4	0	0	0	0	0	114.8	Y222 M226 Y227 H228	Y222-G224 VanDerWaalsContact C-N 3.32Å; Y222-G224 PolarHBondContact O-N 3.47Å; G224-M226 PolarHBondContact O-N 3.45Å; G224-Y227 PolarHBondContact O-N 3.44Å; G224-H228 PolarHBondContact O-CD2 2.84Å; G224-H228 PolarHBondContact O-N 3.48Å
225	H	93.9	Very high	93.2	Very high	43 Å²	43	39 Å²	39	20%	0.199	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-47.7	-172.1	-58.6	72.2	0	0	0	113.7	I212 F213 R215 Y227 H228 L229	I212-H225 HydrophobicContact CG2-CB 4.44Å; I212-H225 PolarHBondContact O-CD2 2.83Å; I212-H225 PolarHBondContact O-NE2 3.38Å; F213-H225 HydrophobicContact CD1-CB 3.86Å; F213-H225 HydrophobicContact CE1-CB 3.88Å; R215-H225 PolarHBondContact O-NE2 3.15Å; H225-Y227 VanDerWaalsContact C-N 3.31Å; H225-Y227 PolarHBondContact O-N 2.94Å; H225-H228 PolarHBondContact O-N 2.96Å; H225-L229 WeakPolarHBondContact O-CB 3.47Å; H225-L229 PolarHBondContact O-N 3.43Å
226	M	94.4	Very high	93.1	Very high	17 Å²	17	35.4 Å²	35.4	8%	0.084	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-42.8	-179.9	-83	-57.3	-80.1	0	0	111.9	V30 P34 Y45 L49 F213 G224 H228 L229 L230	V30-M226 HydrophobicContact CG1-SD 4.1Å; P34-M226 HydrophobicContact CG-CE 4.44Å; Y45-M226 WeakPolarHBondContact OH-CE 2.94Å; L49-M226 HydrophobicContact CD1-CB 4.07Å; L49-M226 HydrophobicContact CD2-CB 4.48Å; F213-M226 HydrophobicContact CE1-CG 3.77Å; F213-M226 HydrophobicContact CE1-SD 4.4Å; F213-M226 HydrophobicContact CE2-SD 4.37Å; F213-M226 HydrophobicContact CZ-CG 3.5Å; F213-M226 HydrophobicContact CZ-SD 3.54Å; F213-M226 VanDerWaalsContact CZ-SD 3.54Å; G224-M226 PolarHBondContact O-N 3.45Å; M226-H228 VanDerWaalsContact C-N 3.32Å; M226-H228 PolarHBondContact O-N 3.46Å; M226-L229 PolarHBondContact O-N 2.84Å; M226-L229 HydrophobicContact SD-CD2 4.27Å; M226-L230 HydrophobicContact CE-CD1 4.2Å; M226-L230 HydrophobicContact CE-CD2 4.14Å; M226-L230 HydrophobicContact CE-CG 4.2Å; M226-L230 WeakPolarHBondContact O-CB 3.39Å; M226-L230 VanDerWaalsContact O-CG 3.23Å; M226-L230 WeakPolarHBondContact O-CG 3.28Å; M226-L230 PolarHBondContact O-N 2.61Å
227	Y	94.3	Very high	93.1	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-55.3	-50	179.2	-170.7	-76.4	0	0	0	111.1	I62 Q67 F184 Y188 L223 G224 H225 A231	I62-Y227 WeakPolarHBondContact O-CE2 3.47Å; I62-Y227 PolarHBondContact O-OH 2.9Å; Q67-Y227 VanDerWaalsContact NE2-CD1 3.26Å; Q67-Y227 VanDerWaalsContact NE2-CE1 3.28Å; Q67-Y227 VanDerWaalsContact NE2-CG 3.29Å; Q67-Y227 PolarHBondContact NE2-O 2.81Å; F184-Y227 HydrophobicContact CE2-CE1 4.5Å; F184-Y227 VanDerWaalsContact CE2-OH 3.25Å; F184-Y227 WeakPolarHBondContact CE2-OH 3.25Å; F184-Y227 HydrophobicContact CZ-CE1 4.5Å; F184-Y227 WeakPolarHBondContact CZ-OH 3.48Å; Y188-Y227 HydrophobicContact CD2-CD1 4.49Å; Y188-Y227 AromaticContact CD2-CE1 3.95Å; Y188-Y227 HydrophobicContact CD2-CE1 3.95Å; Y188-Y227 HydrophobicContact CE2-CE1 4.38Å; L223-Y227 HydrophobicContact CB-CD1 3.7Å; L223-Y227 HydrophobicContact CB-CD2 4.27Å; L223-Y227 HydrophobicContact CB-CE1 4.28Å; L223-Y227 HydrophobicContact CB-CG 3.73Å; L223-Y227 HydrophobicContact CD1-CD1 3.92Å; L223-Y227 HydrophobicContact CD1-CE1 3.68Å; L223-Y227 HydrophobicContact CD2-CE2 4.36Å; L223-Y227 HydrophobicContact CG-CD1 4.31Å; L223-Y227 HydrophobicContact CG-CE1 4.41Å; L223-Y227 WeakPolarHBondContact O-CB 3.43Å; G224-Y227 PolarHBondContact O-N 3.44Å; H225-Y227 VanDerWaalsContact C-N 3.31Å; H225-Y227 PolarHBondContact O-N 2.94Å; Y227-A231 PolarHBondContact O-N 3.3Å
228	H	94.4	Very high	93.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-72.3	-37.8	-178.1	-61.3	-61.1	0	0	0	113.1	Y188 G191 Q192 L195 G224 H225 M226 A231 H232	Y188-H228 AromaticContact CD2-ND1 3.97Å; G191-H228 WeakPolarHBondContact CA-NE2 3.31Å; Q192-H228 VanDerWaalsContact NE2-CA 3.25Å; Q192-H228 PolarHBondContact NE2-O 3Å; L195-H228 HydrophobicContact CD2-CB 4.32Å; G224-H228 PolarHBondContact O-CD2 2.84Å; G224-H228 PolarHBondContact O-N 3.48Å; H225-H228 PolarHBondContact O-N 2.96Å; M226-H228 VanDerWaalsContact C-N 3.32Å; M226-H228 PolarHBondContact O-N 3.46Å; H228-A231 PolarHBondContact O-N 3.47Å; H228-H232 PolarHBondContact O-CD2 2.99Å; H228-H232 PolarHBondContact O-N 2.98Å; H228-H232 VanDerWaalsContact O-N 3.13Å
229	L	95.6	Very high	93.3	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-49	178.6	175.6	64.8	0	0	0	111.4	L195 L209 I212 H225 M226 A231 H232 L233 L238 I249	L195-L229 HydrophobicContact CD2-CB 4.05Å; L195-L229 HydrophobicContact CD2-CD1 4.31Å; L209-L229 HydrophobicContact CD1-CD2 3.23Å; I212-L229 HydrophobicContact CD1-CD1 4.46Å; H225-L229 WeakPolarHBondContact O-CB 3.47Å; H225-L229 PolarHBondContact O-N 3.43Å; M226-L229 PolarHBondContact O-N 2.84Å; M226-L229 HydrophobicContact SD-CD2 4.27Å; L229-A231 PolarHBondContact O-N 3.12Å; L229-H232 PolarHBondContact O-N 3.15Å; L229-L233 HydrophobicContact CD1-CD1 3.89Å; L229-L233 HydrophobicContact CD1-CG 4.03Å; L229-L233 HydrophobicContact CD2-CD1 4.43Å; L229-L233 HydrophobicContact CG-CD1 3.77Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CG 3.11Å; L229-L233 PolarHBondContact O-N 3.24Å; L229-L238 HydrophobicContact CD1-CD1 4.23Å; L229-I249 HydrophobicContact CD1-CD1 4.24Å; L229-I249 HydrophobicContact CD1-CG1 4.08Å; L229-I249 HydrophobicContact CD1-CG2 3.71Å
230	L	95.4	Very high	93.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-36	-179.9	-67.2	174.7	0	0	0	111.9	I33 Y45 L46 L49 Q67 T70 L71 M226 G234	I33-L230 HydrophobicContact CG2-CD2 3.79Å; Y45-L230 HydrophobicContact CE1-CD1 4.02Å; L46-L230 HydrophobicContact CD2-CD1 3.69Å; L49-L230 HydrophobicContact CD1-CD1 3.94Å; Q67-L230 HydrophobicContact CB-CB 4.1Å; Q67-L230 HydrophobicContact CG-CB 3.95Å; T70-L230 HydrophobicContact CG2-CD2 3.57Å; T70-L230 PolarHBondContact OG1-O 2.99Å; L71-L230 HydrophobicContact CD1-CD1 4.49Å; L71-L230 HydrophobicContact CD2-CD1 4.16Å; L71-L230 HydrophobicContact CD2-CD2 3.73Å; M226-L230 HydrophobicContact CE-CD1 4.2Å; M226-L230 HydrophobicContact CE-CD2 4.14Å; M226-L230 HydrophobicContact CE-CG 4.2Å; M226-L230 WeakPolarHBondContact O-CB 3.39Å; M226-L230 VanDerWaalsContact O-CG 3.23Å; M226-L230 WeakPolarHBondContact O-CG 3.28Å; M226-L230 PolarHBondContact O-N 2.61Å; L230-G234 PolarHBondContact O-N 3.36Å
231	A	94.1	Very high	93.8	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68.1	-44.6	177.1	0	0	0	0	0	111.8	L64 Q67 Y188 Y227 H228 L229 G234 A235	L64-A231 HydrophobicContact CD1-CB 4.32Å; Q67-A231 HydrophobicContact CG-CB 3.85Å; Y188-A231 HydrophobicContact CE2-CB 3.98Å; Y227-A231 PolarHBondContact O-N 3.3Å; H228-A231 PolarHBondContact O-N 3.47Å; L229-A231 PolarHBondContact O-N 3.12Å; A231-G234 PolarHBondContact O-N 3.26Å; A231-A235 WeakPolarHBondContact O-CB 3.46Å; A231-A235 PolarHBondContact O-N 3.04Å
232	H	94.7	Very high	94	Very high	5 Å²	5	32.4 Å²	32.4	2%	0.023	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-42.1	177.9	-90.4	-59.4	0	0	0	113.1	Q192 L196 H228 L229 G234 G236 T237 L238	Q192-H232 VanDerWaalsContact CD-NE2 3.32Å; Q192-H232 PolarHBondContact NE2-CD2 2.94Å; Q192-H232 PolarHBondContact O-NE2 3.26Å; Q192-H232 VanDerWaalsContact O-NE2 3.12Å; Q192-H232 PolarHBondContact OE1-CD2 2.81Å; Q192-H232 PolarHBondContact OE1-CE1 2.87Å; Q192-H232 PolarHBondContact OE1-ND1 2.97Å; Q192-H232 PolarHBondContact OE1-NE2 2.88Å; L196-H232 VanDerWaalsContact CD1-CE1 3.46Å; L196-H232 WeakPolarHBondContact CD1-CE1 3.33Å; L196-H232 VanDerWaalsContact CG-CE1 3.41Å; L196-H232 WeakPolarHBondContact CG-CE1 3.48Å; H228-H232 PolarHBondContact O-CD2 2.99Å; H228-H232 PolarHBondContact O-N 2.98Å; H228-H232 VanDerWaalsContact O-N 3.13Å; L229-H232 PolarHBondContact O-N 3.15Å; H232-G234 VanDerWaalsContact C-N 3.34Å; H232-G236 PolarHBondContact O-N 3.16Å; H232-G236 VanDerWaalsContact O-N 3.12Å; H232-T237 WeakPolarHBondContact ND1-CB 3.41Å; H232-T237 PolarHBondContact O-N 2.69Å; H232-L238 HydrophobicContact CB-CB 4.02Å; H232-L238 HydrophobicContact CB-CD1 3.55Å; H232-L238 HydrophobicContact CB-CG 3.71Å; H232-L238 PolarHBondContact O-N 3.28Å
233	L	95	Very high	94.2	Very high	21 Å²	21	29.5 Å²	29.5	11%	0.11	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-42	178.5	-70	168.6	0	0	0	111.4	I33 T70 L229 G236 L238 I249	I33-L233 HydrophobicContact CD1-CD1 3.36Å; I33-L233 HydrophobicContact CG1-CD1 4.09Å; T70-L233 HydrophobicContact CG2-CB 3.84Å; T70-L233 HydrophobicContact CG2-CD1 3.93Å; L229-L233 HydrophobicContact CD1-CD1 3.89Å; L229-L233 HydrophobicContact CD1-CG 4.03Å; L229-L233 HydrophobicContact CD2-CD1 4.43Å; L229-L233 HydrophobicContact CG-CD1 3.77Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CG 3.11Å; L229-L233 PolarHBondContact O-N 3.24Å; L233-G236 PolarHBondContact O-N 2.94Å; L233-L238 WeakPolarHBondContact CA-O 3.39Å; L233-L238 HydrophobicContact CD2-CB 4.08Å; L233-I249 HydrophobicContact CD2-CD1 4.46Å
234	G	93.3	Very high	94.3	Very high	5 Å²	5	35.6 Å²	35.6	5%	0.052	23%	0.227	C	C	.	.	H	α-helix	trans	-75.1	-30.1	-177	0	0	0	0	0	113.4	S66 T70 L230 A231 H232	S66-G234 VanDerWaalsContact O-CA 3.28Å; S66-G234 WeakPolarHBondContact O-CA 3.37Å; T70-G234 WeakPolarHBondContact OG1-CA 3.44Å; T70-G234 PolarHBondContact OG1-N 3.18Å; L230-G234 PolarHBondContact O-N 3.36Å; A231-G234 PolarHBondContact O-N 3.26Å; H232-G234 VanDerWaalsContact C-N 3.34Å
235	A	91.9	Very high	94.3	Very high	42 Å²	42	38.7 Å²	38.7	35%	0.347	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.5	168.5	0	0	0	0	0	112.8	A231 T237	A231-A235 WeakPolarHBondContact O-CB 3.46Å; A231-A235 PolarHBondContact O-N 3.04Å; A235-T237 PolarHBondContact O-N 2.95Å
236	G	92.4	Very high	94.3	Very high	39 Å²	39	37.7 Å²	37.7	40%	0.402	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	6.6	-177.3	0	0	0	0	0	114.6	H232 L233 L238	H232-G236 PolarHBondContact O-N 3.16Å; H232-G236 VanDerWaalsContact O-N 3.12Å; L233-G236 PolarHBondContact O-N 2.94Å; G236-L238 VanDerWaalsContact C-N 3.27Å
237	T	93.6	Very high	94.4	Very high	52 Å²	52	37.7 Å²	37.7	32%	0.319	25%	0.246	S	C	.	.	S	Bend	trans	-68.4	-30.1	174.6	-52.6	0	0	0	0	111.8	L196 H232 A235	L196-T237 HydrophobicContact CD1-CG2 4.37Å; L196-T237 HydrophobicContact CD2-CG2 3.95Å; H232-T237 WeakPolarHBondContact ND1-CB 3.41Å; H232-T237 PolarHBondContact O-N 2.69Å; A235-T237 PolarHBondContact O-N 2.95Å
238	L	95.8	Very high	94.5	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	25%	0.252	C	S	.	.	S	Bend	trans	-121.3	153.7	169.9	-64.1	177.7	0	0	0	109.2	L195 L196 I199 L229 H232 L233 G236 I249 R250 L251	L195-L238 HydrophobicContact CD2-CD1 4.15Å; L195-L238 HydrophobicContact CG-CD1 4.38Å; L196-L238 HydrophobicContact CD2-CD2 4.02Å; L196-L238 HydrophobicContact CD2-CG 4.42Å; I199-L238 HydrophobicContact CD1-CD1 3.57Å; I199-L238 HydrophobicContact CD1-CD2 3.72Å; I199-L238 HydrophobicContact CD1-CG 4.34Å; L229-L238 HydrophobicContact CD1-CD1 4.23Å; H232-L238 HydrophobicContact CB-CB 4.02Å; H232-L238 HydrophobicContact CB-CD1 3.55Å; H232-L238 HydrophobicContact CB-CG 3.71Å; H232-L238 PolarHBondContact O-N 3.28Å; L233-L238 WeakPolarHBondContact CA-O 3.39Å; L233-L238 HydrophobicContact CD2-CB 4.08Å; G236-L238 VanDerWaalsContact C-N 3.27Å; L238-I249 HydrophobicContact CB-CG2 4.08Å; L238-I249 HydrophobicContact CD1-CG2 3.89Å; L238-I249 HydrophobicContact CG-CG2 4.42Å; L238-R250 CarbonylContact C-O 3.46Å; L238-R250 VanDerWaalsContact CA-O 3.3Å; L238-R250 WeakPolarHBondContact CA-O 3.46Å; L238-L251 HydrophobicContact CD2-CB 4.39Å; L238-L251 HydrophobicContact CD2-CD1 3.94Å
239	N	96.5	Very high	94.6	Very high	75 Å²	75	38.9 Å²	38.9	40%	0.401	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.2	176	-67.6	-70.8	0	0	0	110.4	I249 R250	N239-I249 WeakPolarHBondContact O-CA 3.41Å; N239-R250 HydrophobicContact CB-CG 4.12Å; N239-R250 PolarHBondContact N-O 3.38Å; N239-R250 PolarHBondContact O-N 3.29Å
240	S	95.8	Very high	94.7	Very high	58 Å²	58	44.3 Å²	44.3	41%	0.406	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.5	174.5	62.5	0	0	0	0	111.4	L248	S240-L248 CarbonylContact C-O 3.53Å; S240-L248 WeakPolarHBondContact CA-O 3.21Å
241	V	95.4	Very high	94.7	Very high	48 Å²	48	48.2 Å²	48.2	29%	0.291	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.4	178.5	-177.4	0	0	0	0	109	L248	V241-L248 PolarHBondContact N-O 3.3Å; V241-L248 WeakPolarHBondContact O-CB 3.48Å; V241-L248 PolarHBondContact O-N 3.22Å
242	Q	95.2	Very high	94.7	Very high	134 Å²	134	50.7 Å²	50.7	63%	0.626	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	130.4	175	-171.9	61	40.2	0	0	110.1
243	T	94.1	Very high	94.7	Very high	45 Å²	45	53.1 Å²	53.1	28%	0.276	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	170.1	175.8	75.3	0	0	0	0	110.7	S245 G246 L248	T243-S245 PolarHBondContact O-N 2.82Å; T243-S245 PolarHBondContact OG1-N 3.05Å; T243-G246 WeakPolarHBondContact CB-O 3.46Å; T243-G246 PolarHBondContact N-O 2.81Å; T243-G246 PolarHBondContact O-N 3.09Å; T243-G246 VanDerWaalsContact O-N 3.16Å; T243-G246 PolarHBondContact OG1-N 2.75Å; T243-G246 PolarHBondContact OG1-O 2.76Å; T243-L248 HydrophobicContact CG2-CB 3.8Å; T243-L248 HydrophobicContact CG2-CD2 4.11Å
244	S	93	Very high	94.7	Very high	132 Å²	132	54.8 Å²	54.8	92%	0.923	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-25.3	173.7	53	0	0	0	0	113.1
245	S	91.2	Very high	94.8	Very high	93 Å²	93	57.8 Å²	57.8	65%	0.65	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-3.6	178.1	-54.8	0	0	0	0	113.8	T243	T243-S245 PolarHBondContact O-N 2.82Å; T243-S245 PolarHBondContact OG1-N 3.05Å
246	G	93.7	Very high	95	Very high	23 Å²	23	58.8 Å²	58.8	24%	0.237	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.6	-168.3	-177.7	0	0	0	0	0	113	T243 L248	T243-G246 WeakPolarHBondContact CB-O 3.46Å; T243-G246 PolarHBondContact N-O 2.81Å; T243-G246 PolarHBondContact O-N 3.09Å; T243-G246 VanDerWaalsContact O-N 3.16Å; T243-G246 PolarHBondContact OG1-N 2.75Å; T243-G246 PolarHBondContact OG1-O 2.76Å; G246-L248 PolarHBondContact O-N 2.73Å
247	L	96.3	Very high	95.1	Very high	17 Å²	17	60.1 Å²	60.1	9%	0.089	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	120.3	-178.5	-167.1	70.3	0	0	0	110.9	I33 L209 I249	I33-L247 HydrophobicContact CD1-CD2 3.58Å; I33-L247 HydrophobicContact CG1-CD2 3.67Å; L209-L247 HydrophobicContact CB-CB 4.21Å; L209-L247 WeakPolarHBondContact CB-O 3.15Å; L209-L247 HydrophobicContact CD2-CD2 3.88Å; L209-L247 PolarHBondContact N-O 3.13Å; L247-I249 HydrophobicContact CD2-CD1 4.16Å; L247-I249 HydrophobicContact CG-CD1 4.28Å
248	L	96.8	Very high	95.2	Very high	25 Å²	25	60.6 Å²	60.6	13%	0.131	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.8	178.4	-171.2	72.1	0	0	0	109.9	E206 L208 S240 V241 T243 G246	E206-L248 HydrophobicContact CB-CD1 4.15Å; E206-L248 HydrophobicContact CB-CD2 4.22Å; E206-L248 HydrophobicContact CB-CG 4.1Å; E206-L248 HydrophobicContact CG-CD1 4.08Å; E206-L248 HydrophobicContact CG-CD2 4.14Å; E206-L248 HydrophobicContact CG-CG 4.34Å; E206-L248 WeakPolarHBondContact OE2-CD2 3.43Å; L208-L248 HydrophobicContact CD2-CB 4.41Å; L208-L248 HydrophobicContact CD2-CD1 3.97Å; L208-L248 HydrophobicContact CG-CD1 4.3Å; S240-L248 CarbonylContact C-O 3.53Å; S240-L248 WeakPolarHBondContact CA-O 3.21Å; V241-L248 PolarHBondContact N-O 3.3Å; V241-L248 WeakPolarHBondContact O-CB 3.48Å; V241-L248 PolarHBondContact O-N 3.22Å; T243-L248 HydrophobicContact CG2-CB 3.8Å; T243-L248 HydrophobicContact CG2-CD2 4.11Å; G246-L248 PolarHBondContact O-N 2.73Å
249	I	97.7	Very high	95.2	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.6	175.7	-52	-56.2	0	0	0	108.2	I199 E206 L207 L209 I212 L229 L233 L238 N239 L247	I199-I249 HydrophobicContact CD1-CG2 4.06Å; E206-I249 CarbonylContact C-O 3.6Å; E206-I249 WeakPolarHBondContact CA-O 3.49Å; L207-I249 PolarHBondContact N-O 3.16Å; L207-I249 PolarHBondContact O-N 3.22Å; L209-I249 HydrophobicContact CB-CG1 4.36Å; L209-I249 HydrophobicContact CD1-CG1 4.49Å; I212-I249 HydrophobicContact CD1-CB 3.75Å; I212-I249 HydrophobicContact CD1-CG1 3.65Å; I212-I249 HydrophobicContact CD1-CG2 4.13Å; L229-I249 HydrophobicContact CD1-CD1 4.24Å; L229-I249 HydrophobicContact CD1-CG1 4.08Å; L229-I249 HydrophobicContact CD1-CG2 3.71Å; L233-I249 HydrophobicContact CD2-CD1 4.46Å; L238-I249 HydrophobicContact CB-CG2 4.08Å; L238-I249 HydrophobicContact CD1-CG2 3.89Å; L238-I249 HydrophobicContact CG-CG2 4.42Å; N239-I249 WeakPolarHBondContact O-CA 3.41Å; L247-I249 HydrophobicContact CD2-CD1 4.16Å; L247-I249 HydrophobicContact CG-CD1 4.28Å
250	R	97.2	Very high	95.1	Very high	115 Å²	115	64.4 Å²	64.4	43%	0.434	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	153.6	-177.7	68.4	-178.6	-174.9	178.4	2	112.1	K205 E206 L238 N239	K205-R250 WeakPolarHBondContact O-CA 3.49Å; E206-R250 HydrophobicContact CB-CB 3.59Å; L238-R250 CarbonylContact C-O 3.46Å; L238-R250 VanDerWaalsContact CA-O 3.3Å; L238-R250 WeakPolarHBondContact CA-O 3.46Å; N239-R250 HydrophobicContact CB-CG 4.12Å; N239-R250 PolarHBondContact N-O 3.38Å; N239-R250 PolarHBondContact O-N 3.29Å
251	L	95	Very high	95	Very high	83 Å²	83	65 Å²	65	44%	0.435	37%	0.372	S	S	.	.			trans	-68.9	0	168.1	-165.3	76.1	0	0	0	110.1	L196 I199 K200 K205 L238	L196-L251 HydrophobicContact CD2-CD1 3.61Å; I199-L251 HydrophobicContact CG2-CB 4.48Å; K200-L251 HydrophobicContact CG-CD2 4.12Å; K205-L251 HydrophobicContact CB-CB 4.18Å; K205-L251 HydrophobicContact CD-CD2 4.29Å; K205-L251 PolarHBondContact O-N 3.03Å; L238-L251 HydrophobicContact CD2-CB 4.39Å; L238-L251 HydrophobicContact CD2-CD1 3.94Å

Retrieved 251 of 251 residues in 166.7 ms (Link to these results)

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