A0A087XR87_POEFO Loading...

Prenylcysteine oxidase 1 like

AlphaFold DB , UniProt , Accession A0A087XR87, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 501 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.9	Very low	28.7	Very low	249 Å²	249	138.7 Å²	138.7	100%	1.227	81%	0.812	S	S	*	*				0	120.2	0	-79.9	177.8	175.3	0	0	107.7
2	G	37.9	Very low	28.3	Very low	87 Å²	87	137.7 Å²	137.7	90%	0.897	81%	0.808	S	S	*	*			trans	60	95.4	160.2	0	0	0	0	0	118.2
3	G	25.4	Very low	28	Very low	67 Å²	67	139.8 Å²	139.8	69%	0.691	81%	0.812	S	S	*	*			trans	-109.7	-174.9	161.2	0	0	0	0	0	111.8
4	F	27.9	Very low	27.8	Very low	190 Å²	190	137.8 Å²	137.8	83%	0.833	80%	0.803	S	S	*	*			trans	82.5	147.2	177	-70.5	-94.8	0	0	0	116.8
5	Q	26.4	Very low	27.9	Very low	163 Å²	163	136.2 Å²	136.2	76%	0.762	80%	0.796	S	S	*	*			cis	-172.6	157.2	-30.5	-118.7	-174.3	-11.6	0	0	104.6
6	L	24.4	Very low	27.7	Very low	161 Å²	161	136 Å²	136	84%	0.843	80%	0.802	S	S	*	*			trans	-52.2	-173.4	167.1	-84.2	100.2	0	0	0	114
7	P	33.8	Very low	27.7	Very low	94 Å²	94	134.5 Å²	134.5	61%	0.61	80%	0.8	S	S	*	*			cis	-135.3	-173.2	-21.9	24.3	0.1	0	0	0	112.2
8	L	25.2	Very low	27.7	Very low	167 Å²	167	132.2 Å²	132.2	87%	0.874	80%	0.798	S	S	*	*			trans	-157.2	96.8	148.6	-137.2	84.5	0	0	0	108.8
9	I	26.4	Very low	28.2	Very low	135 Å²	135	133.1 Å²	133.1	69%	0.692	80%	0.804	S	S	*	*				53.7	107.9	90.7	-58.5	179.4	0	0	0	113.2
10	A	24.8	Very low	28.1	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	80%	0.796	S	S	*	*			trans	-73.4	144	165.5	0	0	0	0	0	111
11	V	26.1	Very low	28.2	Very low	119 Å²	119	130.3 Å²	130.3	72%	0.721	80%	0.795	S	S	*	*			trans	-127	114.8	162.5	175.9	0	0	0	0	108.3	L13	V11-L13 HydrophobicContact CG1-CG 4.45Å
12	V	23.6	Very low	27.9	Very low	126 Å²	126	124.6 Å²	124.6	76%	0.764	78%	0.777	S	S	*	*			trans	-76	131.3	163.1	171.9	0	0	0	0	107.4
13	L	24.6	Very low	27.6	Very low	165 Å²	165	129 Å²	129	86%	0.864	77%	0.774	S	S	*	*			trans	-116.5	123.5	167	-95.8	161.2	0	0	0	109.5	V11	V11-L13 HydrophobicContact CG1-CG 4.45Å
14	T	24	Very low	28.2	Very low	112 Å²	112	131.9 Å²	131.9	69%	0.687	78%	0.778	S	S	*	*			trans	-101.7	127.5	-178.6	-46.3	0	0	0	0	108.9
15	V	29.3	Very low	28.5	Very low	114 Å²	114	128.8 Å²	128.8	69%	0.691	78%	0.777	S	S	*	*			trans	49.5	125	145.7	-174.9	0	0	0	0	120
16	C	25.2	Very low	29	Very low	133 Å²	133	125 Å²	125	90%	0.899	77%	0.774	S	S	*	*			trans	-146	104.6	135.7	-97.5	0	0	0	0	109.5	A18	C16-A18 PolarHBondContact O-N 3.3Å
17	S	28	Very low	29.9	Very low	110 Å²	110	121.7 Å²	121.7	77%	0.769	75%	0.754	S	S	*	*			trans	-74.1	102.3	164.7	42.6	0	0	0	0	109.1
18	A	28.2	Very low	30.4	Very low	93 Å²	93	124.9 Å²	124.9	77%	0.769	76%	0.761	S	S	*	*			trans	-92.9	113.8	162.2	0	0	0	0	0	107.8	C16 G20	C16-A18 PolarHBondContact O-N 3.3Å; A18-G20 VanDerWaalsContact C-N 3.31Å; A18-G20 PolarHBondContact O-N 3Å
19	V	36.4	Very low	31.5	Very low	149 Å²	149	124 Å²	124	90%	0.903	76%	0.757	S	S	*	*			trans	-67.6	95.8	165.7	175.6	0	0	0	0	106.4
20	G	27.2	Very low	33.2	Very low	62 Å²	62	120.4 Å²	120.4	64%	0.639	75%	0.754	S	S	*	*			trans	-88.5	135.7	165.7	0	0	0	0	0	109.2	A18	A18-G20 VanDerWaalsContact C-N 3.31Å; A18-G20 PolarHBondContact O-N 3Å
21	N	30.1	Very low	35.6	Very low	147 Å²	147	117.6 Å²	117.6	79%	0.786	73%	0.73	S	S	*	*			trans	-49.9	150.7	164.3	-76.9	-31.2	0	0	0	109.8	E23	N21-E23 VanDerWaalsContact C-N 3.25Å; N21-E23 PolarHBondContact O-N 2.78Å
22	P	31.5	Very low	38.1	Very low	129 Å²	129	114.5 Å²	114.5	84%	0.838	71%	0.712	S	S	*	*			trans	-68	91.8	171.5	29.1	-30.6	0	0	0	108	T24	P22-T24 PolarHBondContact O-N 3.22Å
23	E	31.9	Very low	41.3	Very low	179 Å²	179	108.5 Å²	108.5	84%	0.836	68%	0.676	S	S	*	*			trans	-63.3	115.2	161.5	-74.1	-178	165.9	0	0	106.4	N21	N21-E23 VanDerWaalsContact C-N 3.25Å; N21-E23 PolarHBondContact O-N 2.78Å
24	T	36.1	Very low	44.5	Very low	127 Å²	127	104.5 Å²	104.5	78%	0.779	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-46.6	126.9	161.3	37.4	0	0	0	0	108.3	P22 A26	P22-T24 PolarHBondContact O-N 3.22Å; T24-A26 PolarHBondContact O-N 2.88Å; T24-A26 VanDerWaalsContact O-N 3.08Å
25	P	35.6	Very low	48	Very low	125 Å²	125	101.7 Å²	101.7	81%	0.812	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-59.8	122	179.5	-15	27.2	0	0	0	108.3	H27	P25-H27 PolarHBondContact O-N 2.96Å
26	A	36.1	Very low	51.3	Low	85 Å²	85	96.2 Å²	96.2	70%	0.702	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-55.6	134.4	162.1	0	0	0	0	0	107.4	T24 E28	T24-A26 PolarHBondContact O-N 2.88Å; T24-A26 VanDerWaalsContact O-N 3.08Å; A26-E28 PolarHBondContact O-N 3.13Å
27	H	43.5	Very low	54.8	Low	91 Å²	91	89.9 Å²	89.9	42%	0.421	56%	0.563	S	S	.	*			trans	-60.7	103	178.4	-135.9	-68.9	0	0	0	108.1	P25 D29 L284 W481	P25-H27 PolarHBondContact O-N 2.96Å; H27-D29 PolarHBondContact O-N 3.08Å; H27-L284 VanDerWaalsContact CD2-CD1 3.45Å; H27-L284 WeakPolarHBondContact CD2-CD1 3.16Å; H27-W481 AromaticContact CE1-CZ2 3.43Å; H27-W481 VanDerWaalsContact CE1-CZ2 3.43Å; H27-W481 WeakPolarHBondContact CE1-CZ2 3.44Å; H27-W481 AromaticContact NE2-CH2 3.88Å; H27-W481 AromaticContact NE2-CZ2 3.68Å
28	E	43.9	Very low	58.1	Low	160 Å²	160	84.7 Å²	84.7	75%	0.748	53%	0.526	S	S	*	.			trans	-61.5	130.3	171	-73.6	-172.7	160.1	0	0	107.9	A26 G30 A31	A26-E28 PolarHBondContact O-N 3.13Å; E28-G30 PolarHBondContact O-N 3.31Å; E28-A31 PolarHBondContact O-N 2.68Å
29	D	49.5	Very low	61.5	Low	148 Å²	148	80.9 Å²	80.9	79%	0.791	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	112.9	176.6	-107.9	-32.2	0	0	0	108.5	H27 K483	H27-D29 PolarHBondContact O-N 3.08Å; D29-K483 IonicContact OD1-NZ 2.97Å; D29-K483 PolarHBondContact OD1-NZ 2.85Å
30	G	60.8	Low	64.4	Low	61 Å²	61	74.3 Å²	74.3	63%	0.629	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.9	-0.4	179.5	0	0	0	0	0	116.5	E28	E28-G30 PolarHBondContact O-N 3.31Å
31	A	75	Confident	67.8	Low	34 Å²	34	71.3 Å²	71.3	28%	0.281	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-67.8	138.5	171.8	0	0	0	0	0	111.3	E28 W481	E28-A31 PolarHBondContact O-N 2.68Å; A31-W481 PolarHBondContact O-NE1 3.17Å
32	P	79.9	Confident	71.1	Confident	54 Å²	54	65.1 Å²	65.1	35%	0.351	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-63.5	157.2	176.4	27.8	-34.4	0	0	0	111.3	S34	P32-S34 PolarHBondContact O-N 3.27Å
33	P	90.4	Very high	74.2	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-59.6	140.2	171.3	27.8	-32.6	0	0	0	109	I36 F56 V60 D303 I304 W481	P33-I36 HydrophobicContact CB-CG1 4.29Å; P33-I36 HydrophobicContact CG-CD1 3.86Å; P33-I36 HydrophobicContact CG-CG1 4.11Å; P33-F56 HydrophobicContact CG-CD1 3.61Å; P33-F56 HydrophobicContact CG-CE1 3.57Å; P33-F56 HydrophobicContact CG-CG 4.15Å; P33-F56 HydrophobicContact CG-CZ 4.1Å; P33-V60 HydrophobicContact CG-CG2 4.25Å; P33-V60 VanDerWaalsContact O-CG2 3.26Å; P33-V60 WeakPolarHBondContact O-CG2 3.24Å; P33-D303 HydrophobicContact CB-CB 3.92Å; P33-I304 HydrophobicContact CB-CD1 4.14Å; P33-I304 HydrophobicContact CG-CD1 4Å; P33-W481 HydrophobicContact CB-CD2 4.21Å; P33-W481 HydrophobicContact CB-CE3 4.32Å; P33-W481 HydrophobicContact CB-CH2 3.77Å; P33-W481 HydrophobicContact CB-CZ2 3.6Å; P33-W481 HydrophobicContact CB-CZ3 4.12Å; P33-W481 HydrophobicContact CG-CD2 4.36Å; P33-W481 HydrophobicContact CG-CZ2 4.4Å
34	S	92	Very high	77.4	Confident	81 Å²	81	51.4 Å²	51.4	57%	0.566	32%	0.323	S	S	*	.	S	Bend	trans	-74.3	-44.3	179.3	-66.2	0	0	0	0	110.3	P32 Q61 D303	P32-S34 PolarHBondContact O-N 3.27Å; S34-Q61 PolarHBondContact O-N 2.91Å; S34-D303 WeakPolarHBondContact CA-OD2 3.35Å; S34-D303 PolarHBondContact N-OD2 2.76Å
35	R	96.6	Very high	80.4	Confident	52 Å²	52	45.4 Å²	45.4	20%	0.196	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	132.1	-174.9	-59	-178.1	69	-175.4	1.9	112.5	Q61 D63 E300 Y302 D303	R35-Q61 WeakPolarHBondContact CA-O 3.48Å; R35-Q61 HydrophobicContact CG-CB 4.21Å; R35-D63 IonicContact CZ-OD2 3.44Å; R35-D63 IonicContact NE-OD2 3.81Å; R35-D63 IonicContact NH2-OD2 3.31Å; R35-D63 PolarHBondContact NH2-OD2 3.41Å; R35-E300 IonicContact CZ-OE2 3.67Å; R35-E300 IonicContact NH1-OE2 3.22Å; R35-E300 PolarHBondContact NH1-OE2 3.43Å; R35-E300 IonicContact NH2-OE2 2.8Å; R35-E300 PolarHBondContact NH2-OE2 3.05Å; R35-Y302 HydrophobicContact CB-CD1 3.73Å; R35-Y302 HydrophobicContact CB-CE1 4.12Å; R35-Y302 PolarHBondContact NH2-OH 3.41Å; R35-D303 PolarHBondContact N-OD2 3.02Å; R35-D303 PolarHBondContact O-N 2.91Å
36	I	98.5	Very high	83.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.3	174.4	-51.8	178.6	0	0	0	109.4	P33 L52 F56 V60 Q61 V62 D63 I304	P33-I36 HydrophobicContact CB-CG1 4.29Å; P33-I36 HydrophobicContact CG-CD1 3.86Å; P33-I36 HydrophobicContact CG-CG1 4.11Å; I36-L52 HydrophobicContact CD1-CD1 4.42Å; I36-L52 HydrophobicContact CD1-CD2 4.16Å; I36-L52 HydrophobicContact CG2-CD1 3.68Å; I36-F56 HydrophobicContact CD1-CD2 3.8Å; I36-F56 HydrophobicContact CD1-CE2 3.95Å; I36-F56 HydrophobicContact CD1-CG 4.34Å; I36-V60 HydrophobicContact CD1-CG2 3.79Å; I36-V60 HydrophobicContact CG1-CG2 3.72Å; I36-Q61 PolarHBondContact N-O 2.89Å; I36-V62 WeakPolarHBondContact O-CA 3.43Å; I36-D63 PolarHBondContact O-N 2.95Å; I36-I304 WeakPolarHBondContact CA-O 3.23Å; I36-I304 HydrophobicContact CB-CB 4.42Å; I36-I304 HydrophobicContact CD1-CD1 4.11Å; I36-I304 HydrophobicContact CG1-CB 4.08Å; I36-I304 HydrophobicContact CG1-CD1 4.32Å; I36-I304 HydrophobicContact CG2-CB 3.9Å; I36-I304 HydrophobicContact CG2-CG2 3.97Å
37	A	98.8	Very high	86.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	137.1	173.1	0	0	0	0	0	111.4	D63 F65 L289 Y302 I304 V305 V306	A37-D63 CarbonylContact C-O 3.42Å; A37-D63 WeakPolarHBondContact CA-O 3.49Å; A37-F65 HydrophobicContact CB-CD2 4.4Å; A37-F65 HydrophobicContact CB-CE2 4.03Å; A37-L289 HydrophobicContact CB-CD2 3.6Å; A37-Y302 HydrophobicContact CB-CD1 3.56Å; A37-Y302 HydrophobicContact CB-CD2 3.8Å; A37-Y302 HydrophobicContact CB-CE1 3.8Å; A37-Y302 HydrophobicContact CB-CE2 4Å; A37-Y302 HydrophobicContact CB-CG 3.57Å; A37-I304 PolarHBondContact N-O 2.86Å; A37-V305 HydrophobicContact CB-CG2 4.4Å; A37-V305 CarbonylContact O-C 3.59Å; A37-V305 WeakPolarHBondContact O-CA 3.47Å; A37-V306 PolarHBondContact O-N 2.83Å
38	V	98.8	Very high	89	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.4	166.3	-174.8	0	0	0	0	109	T48 L52 V62 D63 V64 F65 V306 A308	V38-T48 HydrophobicContact CG2-CG2 4.1Å; V38-L52 HydrophobicContact CG2-CD1 4.07Å; V38-V62 HydrophobicContact CG2-CG1 4.43Å; V38-D63 PolarHBondContact N-O 3.1Å; V38-V64 HydrophobicContact CB-CG1 4.46Å; V38-V64 HydrophobicContact CB-CG2 4.17Å; V38-V64 CarbonylContact O-C 3.57Å; V38-V64 WeakPolarHBondContact O-CA 3.45Å; V38-F65 PolarHBondContact O-N 3.23Å; V38-V306 CarbonylContact C-O 3.53Å; V38-V306 WeakPolarHBondContact CA-O 3.47Å; V38-V306 HydrophobicContact CG2-CB 4.41Å; V38-A308 HydrophobicContact CG1-CB 4.3Å
39	V	98.6	Very high	91.6	Very high	13 Å²	13	23.4 Å²	23.4	8%	0.079	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	102.2	-178.3	-173.2	0	0	0	0	109.6	V273 L289 V306 L307 A308 T309	V39-V273 HydrophobicContact CG1-CB 4.12Å; V39-V273 HydrophobicContact CG1-CG2 3.92Å; V39-V273 HydrophobicContact CG2-CG2 3.94Å; V39-L289 HydrophobicContact CG2-CD2 4.23Å; V39-V306 PolarHBondContact N-O 2.95Å; V39-L307 HydrophobicContact CB-CD2 3.98Å; V39-L307 HydrophobicContact CG2-CD2 3.8Å; V39-A308 CarbonylContact O-C 3.57Å; V39-A308 VanDerWaalsContact O-C 3.24Å; V39-A308 VanDerWaalsContact O-CA 3.26Å; V39-A308 WeakPolarHBondContact O-CA 3.43Å; V39-A308 WeakPolarHBondContact O-CB 3.23Å; V39-A308 PolarHBondContact O-N 3.45Å; V39-T309 HydrophobicContact CG1-CG2 4.22Å; V39-T309 PolarHBondContact O-N 3.12Å
40	G	98.3	Very high	94	Very high	11 Å²	11	16.8 Å²	16.8	11%	0.113	12%	0.122	C	C	.	.			trans	113.5	129.5	-177.7	0	0	0	0	0	112.6	G45 F65	G40-G45 WeakPolarHBondContact O-CA 3.17Å; G40-F65 WeakPolarHBondContact CA-O 3.14Å; G40-F65 PolarHBondContact N-O 3.24Å
41	A	98.4	Very high	95.8	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.094	C	C	.	.			trans	-106.8	30.3	-179.8	0	0	0	0	0	113.1	V64 E66 V70 G71 L261 L268	A41-V64 HydrophobicContact CB-CG1 3.99Å; A41-E66 WeakPolarHBondContact CA-OE2 3.47Å; A41-E66 HydrophobicContact CB-CB 3.68Å; A41-E66 HydrophobicContact CB-CG 3.84Å; A41-E66 WeakPolarHBondContact CB-OE2 3.47Å; A41-E66 PolarHBondContact N-OE2 3.04Å; A41-V70 HydrophobicContact CB-CB 4.47Å; A41-V70 HydrophobicContact CB-CG1 4.33Å; A41-V70 HydrophobicContact CB-CG2 4.1Å; A41-G71 PolarHBondContact O-N 2.7Å; A41-L261 HydrophobicContact CB-CD1 4.11Å; A41-L268 HydrophobicContact CB-CD1 4.23Å
42	G	98.1	Very high	96.9	Very high	16 Å²	16	12.7 Å²	12.7	17%	0.165	8%	0.081	C	C	.	.	B	Isolated β-bridge	trans	-69.2	-176.3	165.4	0	0	0	0	0	112.3	G44 G45 S46	G42-G44 VanDerWaalsContact C-N 3.28Å; G42-G44 PolarHBondContact O-N 2.88Å; G42-G45 PolarHBondContact O-N 3.07Å; G42-S46 WeakPolarHBondContact O-CB 3.3Å; G42-S46 PolarHBondContact O-N 2.85Å; G42-S46 PolarHBondContact O-OG 3.23Å
43	I	98.4	Very high	97.7	Very high	14 Å²	14	11.8 Å²	11.8	7%	0.072	7%	0.071	C	C	.	.	H	α-helix	trans	-58.4	-39	179.3	-174.4	58.8	0	0	0	112.7	S46 A47 L74 M98 V256 C257 L260 M463	I43-S46 WeakPolarHBondContact CA-OG 3.32Å; I43-S46 PolarHBondContact O-OG 3.27Å; I43-A47 WeakPolarHBondContact O-CB 3.36Å; I43-A47 PolarHBondContact O-N 3.45Å; I43-L74 HydrophobicContact CB-CD1 3.85Å; I43-L74 HydrophobicContact CG1-CD1 4.42Å; I43-L74 HydrophobicContact CG2-CD1 4.34Å; I43-M98 HydrophobicContact CD1-CE 4.3Å; I43-M98 HydrophobicContact CD1-SD 3.71Å; I43-M98 HydrophobicContact CG1-SD 3.9Å; I43-V256 HydrophobicContact CD1-CB 4.46Å; I43-V256 HydrophobicContact CD1-CG1 3.84Å; I43-C257 VanDerWaalsContact CA-SG 3.54Å; I43-L260 HydrophobicContact CD1-CD1 4.23Å; I43-M463 HydrophobicContact CG2-CG 4.4Å
44	G	98.4	Very high	98	Very high	6 Å²	6	16.1 Å²	16.1	6%	0.062	9%	0.091	C	C	.	.	H	α-helix	trans	-60	-59.1	174.9	0	0	0	0	0	112.1	G42 S46 A47 T48 L453 A470	G42-G44 VanDerWaalsContact C-N 3.28Å; G42-G44 PolarHBondContact O-N 2.88Å; G44-S46 PolarHBondContact O-N 2.8Å; G44-A47 PolarHBondContact O-N 2.92Å; G44-T48 PolarHBondContact O-N 2.66Å; G44-T48 PolarHBondContact O-OG1 3.15Å; G44-T48 VanDerWaalsContact O-OG1 3.08Å; G44-L453 VanDerWaalsContact C-CD1 3.46Å; G44-A470 WeakPolarHBondContact O-CB 3.35Å
45	G	98.6	Very high	98.2	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.01	8%	0.075	C	C	.	.	H	α-helix	trans	-66.5	-37	-176.6	0	0	0	0	0	114.2	G40 G42 T48 A49	G40-G45 WeakPolarHBondContact O-CA 3.17Å; G42-G45 PolarHBondContact O-N 3.07Å; G45-T48 PolarHBondContact O-N 2.97Å; G45-A49 PolarHBondContact O-N 3.31Å
46	S	98.8	Very high	98.1	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-67.3	-39.1	174.4	55.7	0	0	0	0	112.7	G42 I43 G44 H50 C257	G42-S46 WeakPolarHBondContact O-CB 3.3Å; G42-S46 PolarHBondContact O-N 2.85Å; G42-S46 PolarHBondContact O-OG 3.23Å; I43-S46 WeakPolarHBondContact CA-OG 3.32Å; I43-S46 PolarHBondContact O-OG 3.27Å; G44-S46 PolarHBondContact O-N 2.8Å; S46-H50 PolarHBondContact O-N 2.97Å; S46-H50 VanDerWaalsContact O-N 3.13Å; S46-C257 WeakPolarHBondContact CB-O 3.36Å; S46-C257 WeakPolarHBondContact OG-CA 3.47Å; S46-C257 WeakPolarHBondContact OG-CB 3.48Å
47	A	98.8	Very high	97.9	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65.6	-38.6	171.2	0	0	0	0	0	111.9	I43 G44 H50 F51 F101 L260 A470	I43-A47 WeakPolarHBondContact O-CB 3.36Å; I43-A47 PolarHBondContact O-N 3.45Å; G44-A47 PolarHBondContact O-N 2.92Å; A47-H50 WeakPolarHBondContact O-CB 3.28Å; A47-H50 PolarHBondContact O-N 3.41Å; A47-F51 HydrophobicContact CB-CD2 4.37Å; A47-F51 HydrophobicContact CB-CE2 4.19Å; A47-F51 WeakPolarHBondContact O-CD2 3.41Å; A47-F51 WeakPolarHBondContact O-CG 3.48Å; A47-F51 PolarHBondContact O-N 3.18Å; A47-F101 HydrophobicContact CB-CE2 4.06Å; A47-F101 HydrophobicContact CB-CZ 3.89Å; A47-L260 HydrophobicContact CB-CD1 4.21Å; A47-A470 HydrophobicContact CB-CB 3.69Å
48	T	98.8	Very high	97.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.4	-49	175.9	-67.2	0	0	0	0	110.5	V38 G44 G45 H50 F51 L52 V306 L453 A470	V38-T48 HydrophobicContact CG2-CG2 4.1Å; G44-T48 PolarHBondContact O-N 2.66Å; G44-T48 PolarHBondContact O-OG1 3.15Å; G44-T48 VanDerWaalsContact O-OG1 3.08Å; G45-T48 PolarHBondContact O-N 2.97Å; T48-H50 VanDerWaalsContact C-N 3.27Å; T48-H50 PolarHBondContact O-N 2.8Å; T48-F51 PolarHBondContact O-N 3.03Å; T48-L52 HydrophobicContact CG2-CD1 3.61Å; T48-L52 HydrophobicContact CG2-CG 3.99Å; T48-L52 WeakPolarHBondContact O-CB 3.49Å; T48-L52 VanDerWaalsContact O-CG 3.23Å; T48-L52 WeakPolarHBondContact O-CG 3.44Å; T48-L52 PolarHBondContact O-N 2.98Å; T48-V306 HydrophobicContact CG2-CB 4.17Å; T48-V306 HydrophobicContact CG2-CG1 3.99Å; T48-V306 HydrophobicContact CG2-CG2 3.99Å; T48-L453 VanDerWaalsContact OG1-CD1 3.23Å; T48-L453 WeakPolarHBondContact OG1-CD1 3.45Å; T48-A470 WeakPolarHBondContact OG1-CA 3.48Å; T48-A470 VanDerWaalsContact OG1-CB 3.25Å; T48-A470 WeakPolarHBondContact OG1-CB 3.42Å
49	A	98.8	Very high	97.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.7	-43.1	177.4	0	0	0	0	0	111.7	G45 R53 V62 V64 L261 A264 A266	G45-A49 PolarHBondContact O-N 3.31Å; A49-R53 WeakPolarHBondContact O-CB 3.49Å; A49-R53 PolarHBondContact O-N 2.83Å; A49-R53 VanDerWaalsContact O-N 3.08Å; A49-V62 HydrophobicContact CB-CG1 3.9Å; A49-V64 HydrophobicContact CB-CG2 3.87Å; A49-L261 HydrophobicContact CB-CD2 4Å; A49-A264 HydrophobicContact CB-CB 4.39Å; A49-A266 HydrophobicContact CB-CB 4.35Å
50	H	98.6	Very high	97.2	Very high	8 Å²	8	27 Å²	27	4%	0.037	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-48.2	175.4	175.7	80	0	0	0	112.9	S46 A47 T48 R53 Q54 Q104 L260 A264	S46-H50 PolarHBondContact O-N 2.97Å; S46-H50 VanDerWaalsContact O-N 3.13Å; A47-H50 WeakPolarHBondContact O-CB 3.28Å; A47-H50 PolarHBondContact O-N 3.41Å; T48-H50 VanDerWaalsContact C-N 3.27Å; T48-H50 PolarHBondContact O-N 2.8Å; H50-R53 WeakPolarHBondContact O-CB 3.23Å; H50-R53 PolarHBondContact O-N 2.78Å; H50-Q54 PolarHBondContact NE2-NE2 2.83Å; H50-Q54 PolarHBondContact O-N 2.88Å; H50-Q54 VanDerWaalsContact O-N 3.15Å; H50-Q104 PolarHBondContact CE1-OE1 2.84Å; H50-Q104 PolarHBondContact NE2-OE1 3.37Å; H50-L260 HydrophobicContact CB-CB 4.23Å; H50-L260 HydrophobicContact CB-CD2 4.09Å; H50-A264 HydrophobicContact CB-CB 4.46Å
51	F	98.7	Very high	97.1	Very high	9 Å²	9	30.2 Å²	30.2	4%	0.039	16%	0.162	C	C	.	.	H	α-helix	trans	-71.9	-34.1	-179.3	-67.8	-48	0	0	0	113.5	A47 T48 R53 Q54 H55 H97 F101 A470 K471 A474	A47-F51 HydrophobicContact CB-CD2 4.37Å; A47-F51 HydrophobicContact CB-CE2 4.19Å; A47-F51 WeakPolarHBondContact O-CD2 3.41Å; A47-F51 WeakPolarHBondContact O-CG 3.48Å; A47-F51 PolarHBondContact O-N 3.18Å; T48-F51 PolarHBondContact O-N 3.03Å; F51-R53 VanDerWaalsContact C-N 3.33Å; F51-Q54 PolarHBondContact O-N 2.92Å; F51-H55 PolarHBondContact O-CD2 2.94Å; F51-H55 VanDerWaalsContact O-CD2 3.3Å; F51-H55 PolarHBondContact O-N 3.45Å; F51-H97 AromaticContact CZ-ND1 3.65Å; F51-F101 AromaticContact CE1-CE1 3.99Å; F51-F101 HydrophobicContact CE1-CE1 3.99Å; F51-F101 HydrophobicContact CE1-CZ 4.36Å; F51-F101 HydrophobicContact CE2-CE1 4.14Å; F51-F101 AromaticContact CE2-CZ 3.69Å; F51-F101 HydrophobicContact CE2-CZ 3.69Å; F51-F101 AromaticContact CZ-CE1 3.5Å; F51-F101 HydrophobicContact CZ-CE1 3.5Å; F51-F101 VanDerWaalsContact CZ-CE1 3.5Å; F51-F101 AromaticContact CZ-CZ 3.45Å; F51-F101 HydrophobicContact CZ-CZ 3.45Å; F51-F101 VanDerWaalsContact CZ-CZ 3.45Å; F51-A470 HydrophobicContact CD2-CB 4.15Å; F51-A470 HydrophobicContact CE2-CB 4.44Å; F51-K471 HydrophobicContact CB-CD 4.16Å; F51-K471 HydrophobicContact CD1-CD 3.56Å; F51-K471 HydrophobicContact CD2-CB 3.75Å; F51-K471 HydrophobicContact CD2-CD 3.99Å; F51-K471 HydrophobicContact CD2-CG 4.48Å; F51-K471 HydrophobicContact CE1-CD 3.79Å; F51-K471 HydrophobicContact CE2-CB 3.61Å; F51-K471 HydrophobicContact CE2-CD 4.19Å; F51-K471 HydrophobicContact CE2-CG 4.41Å; F51-K471 HydrophobicContact CG-CB 4.31Å; F51-K471 HydrophobicContact CG-CD 3.65Å; F51-K471 HydrophobicContact CZ-CB 4.07Å; F51-K471 HydrophobicContact CZ-CD 4.08Å; F51-K471 HydrophobicContact CZ-CG 4.46Å; F51-A474 HydrophobicContact CB-CB 3.5Å; F51-A474 VanDerWaalsContact CB-CB 3.5Å
52	L	98.4	Very high	97.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-44.7	171.6	-73.4	171	0	0	0	110.5	I36 V38 T48 Q54 H55 F56 A474 A477	I36-L52 HydrophobicContact CD1-CD1 4.42Å; I36-L52 HydrophobicContact CD1-CD2 4.16Å; I36-L52 HydrophobicContact CG2-CD1 3.68Å; V38-L52 HydrophobicContact CG2-CD1 4.07Å; T48-L52 HydrophobicContact CG2-CD1 3.61Å; T48-L52 HydrophobicContact CG2-CG 3.99Å; T48-L52 WeakPolarHBondContact O-CB 3.49Å; T48-L52 VanDerWaalsContact O-CG 3.23Å; T48-L52 WeakPolarHBondContact O-CG 3.44Å; T48-L52 PolarHBondContact O-N 2.98Å; L52-Q54 VanDerWaalsContact C-N 3.29Å; L52-Q54 PolarHBondContact O-N 2.9Å; L52-H55 PolarHBondContact O-N 2.62Å; L52-F56 HydrophobicContact CB-CD2 4.48Å; L52-F56 HydrophobicContact CD2-CD2 3.97Å; L52-F56 HydrophobicContact CD2-CE2 3.71Å; L52-F56 PolarHBondContact O-N 3Å; L52-A474 HydrophobicContact CD2-CB 4.08Å; L52-A474 HydrophobicContact CG-CB 4.23Å; L52-A477 HydrophobicContact CD2-CB 4.4Å
53	R	97	Very high	97.1	Very high	36 Å²	36	29.6 Å²	29.6	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-39.6	175.5	177.3	61.6	69	-159.6	4.2	112.5	A49 H50 F51 H55 G57 P58 V60 A264	A49-R53 WeakPolarHBondContact O-CB 3.49Å; A49-R53 PolarHBondContact O-N 2.83Å; A49-R53 VanDerWaalsContact O-N 3.08Å; H50-R53 WeakPolarHBondContact O-CB 3.23Å; H50-R53 PolarHBondContact O-N 2.78Å; F51-R53 VanDerWaalsContact C-N 3.33Å; R53-H55 VanDerWaalsContact C-N 3.32Å; R53-H55 PolarHBondContact O-N 3.46Å; R53-G57 WeakPolarHBondContact CD-O 3.26Å; R53-G57 PolarHBondContact NH1-O 2.8Å; R53-G57 WeakPolarHBondContact O-CA 3.4Å; R53-G57 PolarHBondContact O-N 3.45Å; R53-G57 VanDerWaalsContact O-N 3.14Å; R53-P58 VanDerWaalsContact NH1-CA 3.27Å; R53-P58 PolarHBondContact NH1-O 2.91Å; R53-V60 VanDerWaalsContact CZ-O 3.25Å; R53-V60 PolarHBondContact NH1-O 2.79Å; R53-V60 PolarHBondContact NH2-O 3.36Å; R53-A264 HydrophobicContact CB-CB 4.23Å; R53-A264 PolarHBondContact NE-O 3.15Å
54	Q	96.4	Very high	97.1	Very high	92 Å²	92	28.9 Å²	28.9	43%	0.43	15%	0.151	S	C	.	.	H	α-helix	trans	-63.5	-36.6	177.7	-72.5	-177.6	-13.3	0	0	112.9	H50 F51 L52	H50-Q54 PolarHBondContact NE2-NE2 2.83Å; H50-Q54 PolarHBondContact O-N 2.88Å; H50-Q54 VanDerWaalsContact O-N 3.15Å; F51-Q54 PolarHBondContact O-N 2.92Å; L52-Q54 VanDerWaalsContact C-N 3.29Å; L52-Q54 PolarHBondContact O-N 2.9Å
55	H	95.7	Very high	97.2	Very high	52 Å²	52	28.8 Å²	28.8	24%	0.241	15%	0.148	C	C	.	.	H	α-helix	trans	-90.6	-41.6	-173.9	-71.9	-55.5	0	0	0	113.5	F51 L52 R53 K471 L475 Y478	F51-H55 PolarHBondContact O-CD2 2.94Å; F51-H55 VanDerWaalsContact O-CD2 3.3Å; F51-H55 PolarHBondContact O-N 3.45Å; L52-H55 PolarHBondContact O-N 2.62Å; R53-H55 VanDerWaalsContact C-N 3.32Å; R53-H55 PolarHBondContact O-N 3.46Å; H55-K471 PolarHBondContact NE2-NZ 2.96Å; H55-K471 VanDerWaalsContact NE2-NZ 3.19Å; H55-L475 WeakPolarHBondContact CE1-CD2 3.19Å; H55-L475 WeakPolarHBondContact NE2-CD2 3.47Å; H55-Y478 HydrophobicContact CB-CD2 3.9Å; H55-Y478 HydrophobicContact CB-CG 4.2Å; H55-Y478 WeakPolarHBondContact O-CE2 3.48Å
56	F	95.9	Very high	97.1	Very high	16 Å²	16	29.9 Å²	29.9	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-90.8	-5.8	-178.2	-71.1	-73.9	0	0	0	113.9	P33 I36 L52 V60 I304 A477 Y478 W481	P33-F56 HydrophobicContact CG-CD1 3.61Å; P33-F56 HydrophobicContact CG-CE1 3.57Å; P33-F56 HydrophobicContact CG-CG 4.15Å; P33-F56 HydrophobicContact CG-CZ 4.1Å; I36-F56 HydrophobicContact CD1-CD2 3.8Å; I36-F56 HydrophobicContact CD1-CE2 3.95Å; I36-F56 HydrophobicContact CD1-CG 4.34Å; L52-F56 HydrophobicContact CB-CD2 4.48Å; L52-F56 HydrophobicContact CD2-CD2 3.97Å; L52-F56 HydrophobicContact CD2-CE2 3.71Å; L52-F56 PolarHBondContact O-N 3Å; F56-V60 HydrophobicContact CB-CB 4.23Å; F56-V60 HydrophobicContact CB-CG1 3.59Å; F56-I304 HydrophobicContact CE2-CD1 4.39Å; F56-I304 HydrophobicContact CZ-CD1 3.93Å; F56-A477 HydrophobicContact CE2-CB 4.37Å; F56-A477 HydrophobicContact CZ-CB 4.47Å; F56-Y478 HydrophobicContact CD1-CD2 4.08Å; F56-Y478 AromaticContact CE1-CD2 3.97Å; F56-Y478 HydrophobicContact CE1-CD2 3.97Å; F56-Y478 HydrophobicContact CG-CD2 4.49Å; F56-Y478 HydrophobicContact CZ-CD2 4.26Å; F56-W481 HydrophobicContact CE1-CB 4.13Å; F56-W481 HydrophobicContact CE1-CG 4.09Å; F56-W481 HydrophobicContact CZ-CB 4.29Å
57	G	94.6	Very high	97	Very high	21 Å²	21	35.3 Å²	35.3	22%	0.216	18%	0.177	C	C	.	.			trans	78.3	-175.9	176.8	0	0	0	0	0	114.1	R53 E59 V60	R53-G57 WeakPolarHBondContact CD-O 3.26Å; R53-G57 PolarHBondContact NH1-O 2.8Å; R53-G57 WeakPolarHBondContact O-CA 3.4Å; R53-G57 PolarHBondContact O-N 3.45Å; R53-G57 VanDerWaalsContact O-N 3.14Å; G57-E59 VanDerWaalsContact C-N 3.34Å; G57-E59 PolarHBondContact O-N 3.05Å; G57-V60 WeakPolarHBondContact O-CG1 3.48Å
58	P	93.8	Very high	96.7	Very high	115 Å²	115	36.9 Å²	36.9	75%	0.747	19%	0.193	S	C	*	.	S	Bend	trans	-76.4	-15.6	-172.2	30.6	-35.7	0	0	0	114.6	R53	R53-P58 VanDerWaalsContact NH1-CA 3.27Å; R53-P58 PolarHBondContact NH1-O 2.91Å
59	E	91.4	Very high	96.6	Very high	168 Å²	168	43.3 Å²	43.3	79%	0.785	22%	0.223	S	C	*	.	S	Bend	trans	-77.9	-28.2	-173.3	-61.3	-175.7	173.9	0	0	113.1	G57	G57-E59 VanDerWaalsContact C-N 3.34Å; G57-E59 PolarHBondContact O-N 3.05Å
60	V	94.4	Very high	96.5	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.012	23%	0.231	C	C	.	.	S	Bend	trans	-69.4	136.5	177.8	63.1	0	0	0	0	111.4	P33 I36 R53 F56 G57 V62	P33-V60 HydrophobicContact CG-CG2 4.25Å; P33-V60 VanDerWaalsContact O-CG2 3.26Å; P33-V60 WeakPolarHBondContact O-CG2 3.24Å; I36-V60 HydrophobicContact CD1-CG2 3.79Å; I36-V60 HydrophobicContact CG1-CG2 3.72Å; R53-V60 VanDerWaalsContact CZ-O 3.25Å; R53-V60 PolarHBondContact NH1-O 2.79Å; R53-V60 PolarHBondContact NH2-O 3.36Å; F56-V60 HydrophobicContact CB-CB 4.23Å; F56-V60 HydrophobicContact CB-CG1 3.59Å; G57-V60 WeakPolarHBondContact O-CG1 3.48Å; V60-V62 HydrophobicContact CG1-CG2 4.14Å
61	Q	97.1	Very high	96.4	Very high	79 Å²	79	44.3 Å²	44.3	37%	0.369	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.9	169.2	-178.1	175.5	-19.6	0	0	109.7	S34 R35 I36 D63	S34-Q61 PolarHBondContact O-N 2.91Å; R35-Q61 WeakPolarHBondContact CA-O 3.48Å; R35-Q61 HydrophobicContact CG-CB 4.21Å; I36-Q61 PolarHBondContact N-O 2.89Å; Q61-D63 WeakPolarHBondContact CG-OD1 3.39Å; Q61-D63 PolarHBondContact NE2-OD1 2.91Å; Q61-D63 PolarHBondContact NE2-OD2 2.78Å
62	V	98.4	Very high	96.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	104.5	175.8	-176.8	0	0	0	0	108.5	I36 V38 A49 V60 V64 N267	I36-V62 WeakPolarHBondContact O-CA 3.43Å; V38-V62 HydrophobicContact CG2-CG1 4.43Å; A49-V62 HydrophobicContact CB-CG1 3.9Å; V60-V62 HydrophobicContact CG1-CG2 4.14Å; V62-V64 HydrophobicContact CG1-CG2 4.34Å; V62-N267 PolarHBondContact O-N 3.05Å
63	D	98.6	Very high	96.1	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.5	175.9	-68.1	-24	0	0	0	109.4	R35 I36 A37 V38 Q61 F65 N267 L269 Y302	R35-D63 IonicContact CZ-OD2 3.44Å; R35-D63 IonicContact NE-OD2 3.81Å; R35-D63 IonicContact NH2-OD2 3.31Å; R35-D63 PolarHBondContact NH2-OD2 3.41Å; I36-D63 PolarHBondContact O-N 2.95Å; A37-D63 CarbonylContact C-O 3.42Å; A37-D63 WeakPolarHBondContact CA-O 3.49Å; V38-D63 PolarHBondContact N-O 3.1Å; Q61-D63 WeakPolarHBondContact CG-OD1 3.39Å; Q61-D63 PolarHBondContact NE2-OD1 2.91Å; Q61-D63 PolarHBondContact NE2-OD2 2.78Å; D63-F65 HydrophobicContact CB-CE2 4.16Å; D63-N267 WeakPolarHBondContact CA-O 3.46Å; D63-N267 VanDerWaalsContact OD1-CB 3.28Å; D63-N267 WeakPolarHBondContact OD1-CB 3.47Å; D63-N267 PolarHBondContact OD1-ND2 3.17Å; D63-L269 HydrophobicContact CB-CD1 4.1Å; D63-Y302 HydrophobicContact CB-CE1 3.83Å; D63-Y302 WeakPolarHBondContact CB-OH 3.46Å; D63-Y302 VanDerWaalsContact OD2-CE1 3.24Å; D63-Y302 WeakPolarHBondContact OD2-CE1 3.27Å; D63-Y302 PolarHBondContact OD2-OH 3.24Å
64	V	98.8	Very high	96.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	115.8	178.4	-176.2	0	0	0	0	109.1	V38 A41 A49 V62 L261 A266 N267 L268 L269	V38-V64 HydrophobicContact CB-CG1 4.46Å; V38-V64 HydrophobicContact CB-CG2 4.17Å; V38-V64 CarbonylContact O-C 3.57Å; V38-V64 WeakPolarHBondContact O-CA 3.45Å; A41-V64 HydrophobicContact CB-CG1 3.99Å; A49-V64 HydrophobicContact CB-CG2 3.87Å; V62-V64 HydrophobicContact CG1-CG2 4.34Å; V64-L261 HydrophobicContact CB-CD2 4.26Å; V64-L261 HydrophobicContact CG1-CD2 4.14Å; V64-L261 HydrophobicContact CG2-CD2 3.8Å; V64-A266 HydrophobicContact CG2-CB 3.92Å; V64-N267 PolarHBondContact N-O 3.19Å; V64-L268 HydrophobicContact CB-CD1 4.35Å; V64-L268 HydrophobicContact CG1-CD1 4.29Å; V64-L269 PolarHBondContact O-N 2.94Å
65	F	98.6	Very high	96.1	Very high	3 Å²	3	44 Å²	44	1%	0.013	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.6	179.7	-66.1	-92.2	0	0	0	110.5	A37 V38 G40 D63 L269 A271 V273 L289 F291 Y302	A37-F65 HydrophobicContact CB-CD2 4.4Å; A37-F65 HydrophobicContact CB-CE2 4.03Å; V38-F65 PolarHBondContact O-N 3.23Å; G40-F65 WeakPolarHBondContact CA-O 3.14Å; G40-F65 PolarHBondContact N-O 3.24Å; D63-F65 HydrophobicContact CB-CE2 4.16Å; F65-L269 WeakPolarHBondContact CA-O 3.34Å; F65-L269 HydrophobicContact CD1-CB 4.04Å; F65-L269 HydrophobicContact CD1-CD1 4.02Å; F65-L269 HydrophobicContact CE1-CB 4.26Å; F65-L269 HydrophobicContact CE1-CD1 3.45Å; F65-L269 VanDerWaalsContact CE1-CD1 3.45Å; F65-L269 HydrophobicContact CE2-CD1 4.22Å; F65-L269 HydrophobicContact CZ-CD1 3.58Å; F65-A271 HydrophobicContact CD1-CB 4.08Å; F65-V273 HydrophobicContact CB-CG2 3.71Å; F65-V273 HydrophobicContact CD1-CG2 3.89Å; F65-V273 HydrophobicContact CD2-CG2 4.13Å; F65-V273 HydrophobicContact CG-CG2 3.65Å; F65-L289 HydrophobicContact CD2-CD2 4.42Å; F65-L289 HydrophobicContact CE2-CD2 4.05Å; F65-F291 HydrophobicContact CD1-CB 4.37Å; F65-F291 HydrophobicContact CD1-CD1 4.38Å; F65-F291 HydrophobicContact CD1-CG 4.22Å; F65-F291 HydrophobicContact CE1-CB 4.24Å; F65-F291 AromaticContact CE1-CD1 3.46Å; F65-F291 HydrophobicContact CE1-CD1 3.46Å; F65-F291 VanDerWaalsContact CE1-CD1 3.46Å; F65-F291 HydrophobicContact CE1-CD2 4.11Å; F65-F291 AromaticContact CE1-CE1 3.71Å; F65-F291 HydrophobicContact CE1-CE1 3.71Å; F65-F291 HydrophobicContact CE1-CE2 4.32Å; F65-F291 AromaticContact CE1-CG 3.67Å; F65-F291 HydrophobicContact CE1-CG 3.67Å; F65-F291 HydrophobicContact CE1-CZ 4.14Å; F65-F291 AromaticContact CZ-CD1 3.98Å; F65-F291 HydrophobicContact CZ-CD1 3.98Å; F65-F291 HydrophobicContact CZ-CE1 4.02Å; F65-Y302 AromaticContact CE2-CE2 3.96Å; F65-Y302 HydrophobicContact CE2-CE2 3.96Å; F65-Y302 AromaticContact CE2-CZ 3.76Å; F65-Y302 WeakPolarHBondContact CE2-OH 3.39Å; F65-Y302 HydrophobicContact CZ-CE2 4Å; F65-Y302 AromaticContact CZ-CZ 3.87Å; F65-Y302 WeakPolarHBondContact CZ-OH 3.39Å
66	E	98	Very high	96.2	Very high	24 Å²	24	42.5 Å²	42.5	11%	0.112	23%	0.234	C	C	.	.			trans	-129.4	122.3	175.9	179	50.8	-111	0	0	111.2	A41 G68 L268 L269 K270 A271	A41-E66 WeakPolarHBondContact CA-OE2 3.47Å; A41-E66 HydrophobicContact CB-CB 3.68Å; A41-E66 HydrophobicContact CB-CG 3.84Å; A41-E66 WeakPolarHBondContact CB-OE2 3.47Å; A41-E66 PolarHBondContact N-OE2 3.04Å; E66-G68 WeakPolarHBondContact OE1-CA 3.19Å; E66-G68 PolarHBondContact OE1-N 2.95Å; E66-L268 HydrophobicContact CB-CD1 4.02Å; E66-L269 PolarHBondContact N-O 3.09Å; E66-K270 CarbonylContact O-C 3.59Å; E66-K270 VanDerWaalsContact O-CA 3.26Å; E66-K270 WeakPolarHBondContact O-CA 3.37Å; E66-A271 CarbonylContact C-O 3.6Å; E66-A271 VanDerWaalsContact C-O 3.32Å; E66-A271 PolarHBondContact O-N 2.85Å
67	K	95.2	Very high	96.2	Very high	115 Å²	115	42.9 Å²	42.9	50%	0.5	24%	0.238	S	C	.	.	S	Bend	trans	-82.2	-28.6	-179.7	68.2	179.3	-178.7	-178.9	0	113.3	A271 Q272	K67-A271 PolarHBondContact N-O 2.84Å; K67-Q272 HydrophobicContact CB-CB 3.82Å; K67-Q272 HydrophobicContact CB-CG 4.33Å; K67-Q272 HydrophobicContact CD-CG 4.19Å
68	G	94.1	Very high	96.3	Very high	32 Å²	32	45.7 Å²	45.7	33%	0.33	25%	0.251	S	S	.	.	S	Bend	trans	-111.9	-127	-178.5	0	0	0	0	0	112	E66 K270	E66-G68 WeakPolarHBondContact OE1-CA 3.19Å; E66-G68 PolarHBondContact OE1-N 2.95Å; G68-K270 WeakPolarHBondContact O-CE 3.3Å
69	E	95.6	Very high	96.4	Very high	135 Å²	135	40.3 Å²	40.3	63%	0.631	22%	0.216	S	C	*	.			trans	-109.1	141.8	-179.6	-64.6	-60.7	132.1	0	0	110.4	G71 G72 K270	E69-G71 PolarHBondContact O-N 2.75Å; E69-G72 PolarHBondContact O-N 3.03Å; E69-K270 IonicContact OE1-NZ 2.68Å; E69-K270 PolarHBondContact OE1-NZ 3.42Å
70	V	98.1	Very high	96.3	Very high	29 Å²	29	36.3 Å²	36.3	18%	0.176	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	133	176.4	176.9	0	0	0	0	109.8	A41 C257 S258 L261 L268	A41-V70 HydrophobicContact CB-CB 4.47Å; A41-V70 HydrophobicContact CB-CG1 4.33Å; A41-V70 HydrophobicContact CB-CG2 4.1Å; V70-C257 HydrophobicContact CG1-CB 3.84Å; V70-S258 WeakPolarHBondContact CG1-OG 3.33Å; V70-L261 HydrophobicContact CG1-CD1 3.86Å; V70-L261 HydrophobicContact CG2-CD1 4.21Å; V70-L268 HydrophobicContact CG2-CD1 4.21Å; V70-L268 HydrophobicContact CG2-CD2 3.53Å
71	G	96.4	Very high	96.1	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.01	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	115.1	-29.6	-173.7	0	0	0	0	0	113	A41 E69 R73 L74	A41-G71 PolarHBondContact O-N 2.7Å; E69-G71 PolarHBondContact O-N 2.75Å; G71-R73 PolarHBondContact O-N 3.45Å; G71-R73 VanDerWaalsContact O-N 3.11Å; G71-L74 CarbonylContact C-O 3.55Å; G71-L74 WeakPolarHBondContact O-CB 3.35Å; G71-L74 PolarHBondContact O-N 2.74Å
72	G	95.3	Very high	96	Very high	32 Å²	32	44.8 Å²	44.8	33%	0.33	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	-114.7	-178.4	0	0	0	0	0	111.6	E69 L74	E69-G72 PolarHBondContact O-N 3.03Å; G72-L74 PolarHBondContact O-N 2.79Å
73	R	95.4	Very high	95.9	Very high	67 Å²	67	47.7 Å²	47.7	25%	0.253	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-2.2	175.6	-74.1	170.1	-69.4	174.8	-3.5	114.2	G71 G87 G88 W429 A431 E457	G71-R73 PolarHBondContact O-N 3.45Å; G71-R73 VanDerWaalsContact O-N 3.11Å; R73-G87 VanDerWaalsContact O-CA 3.24Å; R73-G87 WeakPolarHBondContact O-CA 3.39Å; R73-G88 PolarHBondContact O-N 3.23Å; R73-W429 HydrophobicContact CB-CE3 4.5Å; R73-W429 HydrophobicContact CG-CD2 4.27Å; R73-W429 HydrophobicContact CG-CE3 3.75Å; R73-W429 HydrophobicContact CG-CZ3 4.18Å; R73-A431 PolarHBondContact NH1-O 2.89Å; R73-E457 IonicContact CZ-OE1 2.83Å; R73-E457 IonicContact CZ-OE2 3.75Å; R73-E457 IonicContact NH1-OE1 3.59Å; R73-E457 IonicContact NH1-OE2 3.47Å; R73-E457 PolarHBondContact NH1-OE2 2.88Å; R73-E457 IonicContact NH2-OE1 2.89Å; R73-E457 PolarHBondContact NH2-OE1 2.92Å; R73-E457 IonicContact NH2-OE2 3.76Å; R73-E457 PolarHBondContact NH2-OE2 2.88Å
74	L	96.8	Very high	95.8	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.047	26%	0.258	C	S	.	.	S	Bend	trans	-93.7	93.4	163.2	-55.8	-172.2	0	0	0	107.2	I43 G71 G72 N253 K254 M463	I43-L74 HydrophobicContact CB-CD1 3.85Å; I43-L74 HydrophobicContact CG1-CD1 4.42Å; I43-L74 HydrophobicContact CG2-CD1 4.34Å; G71-L74 CarbonylContact C-O 3.55Å; G71-L74 WeakPolarHBondContact O-CB 3.35Å; G71-L74 PolarHBondContact O-N 2.74Å; G72-L74 PolarHBondContact O-N 2.79Å; L74-N253 HydrophobicContact CD1-CB 4.26Å; L74-N253 HydrophobicContact CD2-CB 4.46Å; L74-K254 HydrophobicContact CB-CB 4.37Å; L74-K254 VanDerWaalsContact O-CB 3.23Å; L74-K254 WeakPolarHBondContact O-CB 3.36Å; L74-M463 HydrophobicContact CD1-CG 4.17Å; L74-M463 HydrophobicContact CD1-SD 3.82Å; L74-M463 HydrophobicContact CD2-CE 4.24Å; L74-M463 HydrophobicContact CD2-CG 3.78Å; L74-M463 HydrophobicContact CD2-SD 3.56Å; L74-M463 VanDerWaalsContact CD2-SD 3.56Å; L74-M463 HydrophobicContact CG-SD 4.36Å
75	A	96.1	Very high	95.8	Very high	21 Å²	21	48.9 Å²	48.9	17%	0.174	26%	0.26	C	S	.	.			trans	-141.1	153.2	-172.7	0	0	0	0	0	111.4	S86 G87 W429	A75-S86 PolarHBondContact O-N 2.85Å; A75-S86 PolarHBondContact O-OG 2.83Å; A75-S86 VanDerWaalsContact O-OG 3.12Å; A75-G87 PolarHBondContact O-N 2.92Å; A75-W429 HydrophobicContact CB-CH2 3.5Å; A75-W429 HydrophobicContact CB-CZ2 3.74Å
76	T	97.1	Very high	95.6	Very high	22 Å²	22	48.8 Å²	48.8	14%	0.135	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	155.7	178.9	56.5	0	0	0	0	110.5	E83 Y84 K254 V384	T76-E83 HydrophobicContact CG2-CB 4.5Å; T76-E83 PolarHBondContact OG1-OE1 2.81Å; T76-Y84 CarbonylContact C-O 3.52Å; T76-Y84 WeakPolarHBondContact CA-O 3.2Å; T76-Y84 WeakPolarHBondContact CB-O 3.41Å; T76-K254 HydrophobicContact CG2-CD 4.4Å; T76-K254 WeakPolarHBondContact OG1-CE 3.19Å; T76-K254 PolarHBondContact OG1-NZ 2.88Å; T76-V384 HydrophobicContact CG2-CG1 3.91Å
77	V	96.8	Very high	95.4	Very high	23 Å²	23	48.1 Å²	48.1	14%	0.139	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.9	169	-60.7	0	0	0	0	110	E83 Y84 I342 Q425	V77-E83 CarbonylContact O-C 3.58Å; V77-E83 WeakPolarHBondContact O-CA 3.48Å; V77-Y84 PolarHBondContact N-O 2.95Å; V77-Y84 PolarHBondContact O-N 2.91Å; V77-I342 HydrophobicContact CG2-CB 3.9Å; V77-I342 HydrophobicContact CG2-CG1 3.52Å; V77-I342 HydrophobicContact CG2-CG2 4.22Å; V77-Q425 VanDerWaalsContact CB-OE1 3.27Å; V77-Q425 HydrophobicContact CG2-CB 4.48Å; V77-Q425 VanDerWaalsContact CG2-OE1 3.26Å
78	T	96.6	Very high	95.1	Very high	81 Å²	81	43.9 Å²	43.9	50%	0.497	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.4	-175.7	-60.5	0	0	0	0	111.2	N82 Q425	T78-N82 CarbonylContact C-O 3.42Å; T78-N82 WeakPolarHBondContact CA-O 3.43Å; T78-Q425 PolarHBondContact O-NE2 3.1Å; T78-Q425 PolarHBondContact O-OE1 3.14Å
79	V	95.1	Very high	94.9	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127	175.4	179.6	0	0	0	0	108.2	H81 N82 Y84 I342 H344 V400 Q425	V79-H81 VanDerWaalsContact C-N 3.3Å; V79-H81 PolarHBondContact O-N 3.01Å; V79-N82 PolarHBondContact N-O 2.81Å; V79-N82 PolarHBondContact O-N 3.38Å; V79-N82 VanDerWaalsContact O-O 3.06Å; V79-Y84 HydrophobicContact CB-CD2 4.01Å; V79-Y84 HydrophobicContact CB-CE2 3.83Å; V79-Y84 HydrophobicContact CG2-CD2 4.26Å; V79-I342 HydrophobicContact CG2-CG2 3.72Å; V79-H344 HydrophobicContact CG1-CB 3.73Å; V79-V400 HydrophobicContact CG1-CG1 4.5Å; V79-V400 HydrophobicContact CG1-CG2 3.96Å; V79-Q425 VanDerWaalsContact CG2-OE1 3.25Å
80	N	89	Confident	94.6	Very high	85 Å²	85	41 Å²	41	46%	0.455	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	51	-179.2	-59.3	-22.8	0	0	0	113.1	N82 H344	N80-N82 PolarHBondContact O-N 2.82Å; N80-N82 PolarHBondContact O-ND2 3.06Å; N80-H344 PolarHBondContact ND2-CE1 3.23Å; N80-H344 PolarHBondContact ND2-ND1 3.43Å; N80-H344 PolarHBondContact ND2-NE2 3.25Å; N80-H344 VanDerWaalsContact ND2-NE2 3.17Å
81	H	91	Very high	94.4	Very high	190 Å²	190	39.6 Å²	39.6	88%	0.88	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	10.9	-179.7	-47.7	-70.9	0	0	0	115.8	V79	V79-H81 VanDerWaalsContact C-N 3.3Å; V79-H81 PolarHBondContact O-N 3.01Å
82	N	94.9	Very high	94.3	Very high	69 Å²	69	40.2 Å²	40.2	37%	0.369	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	145.2	173.7	-66.2	-75.6	0	0	0	110.2	T78 V79 N80 Y84 P383	T78-N82 CarbonylContact C-O 3.42Å; T78-N82 WeakPolarHBondContact CA-O 3.43Å; V79-N82 PolarHBondContact N-O 2.81Å; V79-N82 PolarHBondContact O-N 3.38Å; V79-N82 VanDerWaalsContact O-O 3.06Å; N80-N82 PolarHBondContact O-N 2.82Å; N80-N82 PolarHBondContact O-ND2 3.06Å; N82-Y84 HydrophobicContact CB-CE2 3.69Å; N82-Y84 WeakPolarHBondContact O-CD2 3.42Å; N82-Y84 WeakPolarHBondContact O-CE2 3.45Å; N82-P383 HydrophobicContact CB-CB 4.04Å
83	E	96.8	Very high	94.1	Very high	61 Å²	61	40.2 Å²	40.2	29%	0.285	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	143.4	174.8	-75.1	-174.5	100.9	0	0	111.7	T76 V77 K254 P383 V384	T76-E83 HydrophobicContact CG2-CB 4.5Å; T76-E83 PolarHBondContact OG1-OE1 2.81Å; V77-E83 CarbonylContact O-C 3.58Å; V77-E83 WeakPolarHBondContact O-CA 3.48Å; E83-K254 IonicContact OE1-NZ 2.91Å; E83-K254 PolarHBondContact OE1-NZ 2.78Å; E83-P383 CarbonylContact O-C 3.2Å; E83-P383 VanDerWaalsContact O-CA 3.27Å; E83-P383 WeakPolarHBondContact O-CA 3.44Å; E83-V384 HydrophobicContact CB-CG2 3.63Å; E83-V384 PolarHBondContact O-N 2.76Å
84	Y	97.2	Very high	93.9	Very high	17 Å²	17	40.1 Å²	40.1	7%	0.067	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141.9	179.6	-62.9	-95.8	0	0	0	110.3	T76 V77 V79 N82 S86 V381 C382 P383 V400	T76-Y84 CarbonylContact C-O 3.52Å; T76-Y84 WeakPolarHBondContact CA-O 3.2Å; T76-Y84 WeakPolarHBondContact CB-O 3.41Å; V77-Y84 PolarHBondContact N-O 2.95Å; V77-Y84 PolarHBondContact O-N 2.91Å; V79-Y84 HydrophobicContact CB-CD2 4.01Å; V79-Y84 HydrophobicContact CB-CE2 3.83Å; V79-Y84 HydrophobicContact CG2-CD2 4.26Å; N82-Y84 HydrophobicContact CB-CE2 3.69Å; N82-Y84 WeakPolarHBondContact O-CD2 3.42Å; N82-Y84 WeakPolarHBondContact O-CE2 3.45Å; Y84-S86 PolarHBondContact O-N 2.89Å; Y84-S86 VanDerWaalsContact O-N 3.17Å; Y84-V381 HydrophobicContact CD1-CB 4.32Å; Y84-V381 HydrophobicContact CD1-CG2 3.71Å; Y84-V381 HydrophobicContact CE1-CG2 4.31Å; Y84-V381 HydrophobicContact CG-CG2 4.46Å; Y84-C382 WeakPolarHBondContact CD1-O 3.26Å; Y84-P383 HydrophobicContact CD1-CB 4.5Å; Y84-P383 HydrophobicContact CE1-CB 4.01Å; Y84-P383 VanDerWaalsContact CE1-N 3.34Å; Y84-V400 HydrophobicContact CD1-CB 4.45Å; Y84-V400 HydrophobicContact CD1-CG1 4Å; Y84-V400 HydrophobicContact CD2-CG1 4.26Å; Y84-V400 HydrophobicContact CE1-CB 3.87Å; Y84-V400 HydrophobicContact CE1-CG1 3.88Å; Y84-V400 HydrophobicContact CE1-CG2 4.2Å; Y84-V400 HydrophobicContact CE2-CG1 4.18Å; Y84-V400 HydrophobicContact CE2-CG2 4.2Å; Y84-V400 HydrophobicContact CG-CG1 4.19Å
85	E	97.3	Very high	93.9	Very high	9 Å²	9	41.2 Å²	41.2	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	110.8	177.7	-67.1	-67.5	174.8	0	0	111.6	G252 N253 V384 K402	E85-G252 WeakPolarHBondContact OE1-CA 3.45Å; E85-N253 PolarHBondContact OE1-N 3.09Å; E85-V384 HydrophobicContact CG-CG1 3.97Å; E85-K402 PolarHBondContact O-NZ 3.35Å
86	S	95.3	Very high	93.9	Very high	1 Å²	1	43 Å²	43	1%	0.007	24%	0.237	C	C	.	.	S	Bend	trans	-88.2	-26.2	171.7	60.2	0	0	0	0	111.9	A75 Y84 A340 K402 W429	A75-S86 PolarHBondContact O-N 2.85Å; A75-S86 PolarHBondContact O-OG 2.83Å; A75-S86 VanDerWaalsContact O-OG 3.12Å; Y84-S86 PolarHBondContact O-N 2.89Å; Y84-S86 VanDerWaalsContact O-N 3.17Å; S86-A340 VanDerWaalsContact O-CB 3.24Å; S86-A340 WeakPolarHBondContact O-CB 3.43Å; S86-K402 VanDerWaalsContact C-NZ 3.3Å; S86-K402 WeakPolarHBondContact O-CE 3.32Å; S86-K402 PolarHBondContact O-NZ 2.84Å; S86-W429 PolarHBondContact O-NE1 2.72Å
87	G	92.8	Very high	94	Very high	10 Å²	10	43 Å²	43	10%	0.103	24%	0.235	C	C	.	.	S	Bend	trans	-101.8	-136.9	177.3	0	0	0	0	0	114.2	R73 A75 S89 K402	R73-G87 VanDerWaalsContact O-CA 3.24Å; R73-G87 WeakPolarHBondContact O-CA 3.39Å; A75-G87 PolarHBondContact O-N 2.92Å; G87-S89 PolarHBondContact O-N 2.56Å; G87-K402 PolarHBondContact O-NZ 3.03Å; G87-K402 VanDerWaalsContact O-NZ 3.13Å
88	G	90.3	Very high	94	Very high	26 Å²	26	41.9 Å²	41.9	27%	0.268	23%	0.229	S	C	.	.			trans	-64.2	111.9	180	0	0	0	0	0	112.9	R73 N253	R73-G88 PolarHBondContact O-N 3.23Å; G88-N253 PolarHBondContact O-ND2 3.48Å
89	S	88.9	Confident	94	Very high	39 Å²	39	40.6 Å²	40.6	27%	0.273	22%	0.217	S	C	.	.			trans	-109.8	-13.8	-163	54.9	0	0	0	0	116.4	G87	G87-S89 PolarHBondContact O-N 2.56Å
90	I	90.6	Very high	94.2	Very high	68 Å²	68	44 Å²	44	35%	0.349	23%	0.233	S	C	.	.			trans	-136.6	147.1	-173.9	52.9	165.5	0	0	0	111.1	G241 L246 M463	I90-G241 WeakPolarHBondContact CD1-O 3.48Å; I90-L246 HydrophobicContact CB-CB 4.45Å; I90-L246 HydrophobicContact CD1-CD1 3.72Å; I90-L246 HydrophobicContact CD1-CD2 4.29Å; I90-M463 WeakPolarHBondContact O-CE 3.4Å
91	I	93.6	Very high	94.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-129.5	135.4	-179.7	-55.9	164.1	0	0	0	107.5	N95 M98 L246 W247 V249 M463	I91-N95 HydrophobicContact CG2-CB 3.78Å; I91-M98 HydrophobicContact CD1-CE 3.63Å; I91-M98 HydrophobicContact CG1-CE 4.4Å; I91-M98 HydrophobicContact CG2-CB 3.74Å; I91-M98 HydrophobicContact CG2-CG 4.15Å; I91-L246 CarbonylContact O-C 3.17Å; I91-L246 WeakPolarHBondContact O-CA 3.33Å; I91-W247 HydrophobicContact CB-CD2 3.91Å; I91-W247 HydrophobicContact CB-CE3 4.14Å; I91-W247 HydrophobicContact CB-CH2 4.1Å; I91-W247 HydrophobicContact CB-CZ2 3.84Å; I91-W247 HydrophobicContact CB-CZ3 4.23Å; I91-W247 HydrophobicContact CD1-CE3 3.91Å; I91-W247 HydrophobicContact CD1-CH2 3.56Å; I91-W247 HydrophobicContact CD1-CZ2 4.21Å; I91-W247 HydrophobicContact CD1-CZ3 3.37Å; I91-W247 HydrophobicContact CG1-CH2 4.41Å; I91-W247 HydrophobicContact CG1-CZ3 4.37Å; I91-W247 HydrophobicContact CG2-CD2 4.23Å; I91-W247 VanDerWaalsContact CG2-CE2 3.49Å; I91-W247 HydrophobicContact CG2-CH2 3.76Å; I91-W247 HydrophobicContact CG2-CZ2 3.25Å; I91-W247 HydrophobicContact CG2-CZ3 4.39Å; I91-W247 PolarHBondContact N-O 2.87Å; I91-W247 PolarHBondContact O-N 3.23Å; I91-W247 PolarHBondContact O-NE1 3.36Å; I91-V249 HydrophobicContact CD1-CG2 4.3Å; I91-M463 HydrophobicContact CD1-CE 4.37Å; I91-M463 HydrophobicContact CD1-SD 4.18Å; I91-M463 HydrophobicContact CG1-CE 3.51Å; I91-M463 HydrophobicContact CG1-SD 3.86Å
92	H	93.2	Very high	94.9	Very high	14 Å²	14	31.1 Å²	31.1	7%	0.065	17%	0.171	C	C	.	.			trans	-84.3	154.6	179.2	-173.3	-95.4	0	0	0	111.1	L94 N95 A240 L246 W247	H92-L94 PolarHBondContact ND1-N 3.04Å; H92-L94 VanDerWaalsContact ND1-N 3.1Å; H92-L94 PolarHBondContact O-N 3.17Å; H92-N95 PolarHBondContact N-ND2 3.25Å; H92-N95 VanDerWaalsContact O-CB 3.28Å; H92-N95 WeakPolarHBondContact O-CB 3.42Å; H92-N95 PolarHBondContact O-N 3.46Å; H92-N95 VanDerWaalsContact O-N 3.17Å; H92-A240 PolarHBondContact CD2-O 3.14Å; H92-A240 VanDerWaalsContact CD2-O 3.29Å; H92-L246 HydrophobicContact CB-CD2 4.17Å; H92-W247 PolarHBondContact O-NE1 3.02Å; H92-W247 VanDerWaalsContact O-NE1 3.17Å
93	S	90.8	Very high	95.1	Very high	32 Å²	32	34.9 Å²	34.9	22%	0.224	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-14.6	-178.6	61.1	0	0	0	0	114.6	Q99 N245	S93-Q99 VanDerWaalsContact O-CD 3.24Å; S93-Q99 PolarHBondContact O-NE2 2.94Å; S93-Q99 PolarHBondContact O-OE1 3.38Å; S93-N245 PolarHBondContact N-O 2.97Å; S93-N245 WeakPolarHBondContact OG-CB 3.42Å
94	L	92.4	Very high	95.1	Very high	65 Å²	65	35.4 Å²	35.4	34%	0.34	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	8.3	173.8	-59.6	-175.1	0	0	0	113.4	H92 L96 M159 M163 Y166	H92-L94 PolarHBondContact ND1-N 3.04Å; H92-L94 VanDerWaalsContact ND1-N 3.1Å; H92-L94 PolarHBondContact O-N 3.17Å; L94-L96 VanDerWaalsContact C-N 3.31Å; L94-L96 PolarHBondContact O-N 3.31Å; L94-L96 VanDerWaalsContact O-N 3.09Å; L94-M159 HydrophobicContact CD1-CE 3.23Å; L94-M159 HydrophobicContact CG-CE 4.21Å; L94-M163 HydrophobicContact CB-SD 3.98Å; L94-M163 HydrophobicContact CD1-SD 4.43Å; L94-Y166 PolarHBondContact O-OH 3.37Å
95	N	95.4	Very high	95.2	Very high	31 Å²	31	36.5 Å²	36.5	17%	0.166	19%	0.193	C	C	.	.			trans	-82.3	79.8	171.8	-66.5	8.7	0	0	0	108.4	I91 H92 H97 M98 Q99 E464	I91-N95 HydrophobicContact CG2-CB 3.78Å; H92-N95 PolarHBondContact N-ND2 3.25Å; H92-N95 VanDerWaalsContact O-CB 3.28Å; H92-N95 WeakPolarHBondContact O-CB 3.42Å; H92-N95 PolarHBondContact O-N 3.46Å; H92-N95 VanDerWaalsContact O-N 3.17Å; N95-H97 PolarHBondContact O-N 3.3Å; N95-M98 HydrophobicContact CB-CB 4.14Å; N95-M98 HydrophobicContact CB-CG 4.42Å; N95-M98 PolarHBondContact O-N 3.31Å; N95-Q99 WeakPolarHBondContact O-CG 3.43Å; N95-Q99 PolarHBondContact O-N 2.87Å; N95-E464 VanDerWaalsContact C-OE2 3.28Å; N95-E464 VanDerWaalsContact CA-CD 3.46Å; N95-E464 WeakPolarHBondContact CA-OE2 3.25Å; N95-E464 HydrophobicContact CB-CB 3.89Å; N95-E464 HydrophobicContact CB-CG 3.91Å; N95-E464 VanDerWaalsContact CB-OE2 3.26Å; N95-E464 WeakPolarHBondContact CB-OE2 3.45Å
96	L	97.1	Very high	95.2	Very high	59 Å²	59	39.1 Å²	39.1	31%	0.309	22%	0.222	S	C	.	.	H	α-helix	trans	-70.6	-32.9	-166.4	-58.8	-168.3	0	0	0	112.5	L94 Q99 E100 M163 Y166 E464	L94-L96 VanDerWaalsContact C-N 3.31Å; L94-L96 PolarHBondContact O-N 3.31Å; L94-L96 VanDerWaalsContact O-N 3.09Å; L96-Q99 PolarHBondContact O-N 3.32Å; L96-E100 WeakPolarHBondContact O-CB 3.4Å; L96-E100 PolarHBondContact O-N 3.08Å; L96-M163 HydrophobicContact CD1-CE 3.54Å; L96-M163 HydrophobicContact CD2-CE 4.29Å; L96-M163 HydrophobicContact CG-CE 3.86Å; L96-Y166 HydrophobicContact CB-CD1 4Å; L96-Y166 HydrophobicContact CB-CD2 4.45Å; L96-Y166 HydrophobicContact CB-CE1 3.62Å; L96-Y166 HydrophobicContact CB-CE2 4.12Å; L96-Y166 HydrophobicContact CB-CG 4.38Å; L96-Y166 HydrophobicContact CD1-CD1 4.33Å; L96-Y166 HydrophobicContact CD1-CD2 3.64Å; L96-Y166 HydrophobicContact CD1-CE2 3.86Å; L96-Y166 HydrophobicContact CD1-CG 3.88Å; L96-Y166 HydrophobicContact CG-CD1 4.49Å; L96-Y166 HydrophobicContact CG-CD2 4.07Å; L96-Y166 HydrophobicContact CG-CE1 4.19Å; L96-Y166 HydrophobicContact CG-CE2 3.74Å; L96-Y166 HydrophobicContact CG-CG 4.42Å; L96-Y166 PolarHBondContact N-OH 3.18Å; L96-Y166 VanDerWaalsContact N-OH 3.13Å; L96-E464 PolarHBondContact N-OE1 3.44Å
97	H	98.3	Very high	95.3	Very high	21 Å²	21	40.9 Å²	40.9	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-47.1	173.9	-70.9	-57.6	0	0	0	110.4	F51 N95 Q99 E100 F101 Y166 Q169 E464	F51-H97 AromaticContact CZ-ND1 3.65Å; N95-H97 PolarHBondContact O-N 3.3Å; H97-Q99 VanDerWaalsContact C-N 3.32Å; H97-Q99 PolarHBondContact O-N 2.89Å; H97-E100 PolarHBondContact O-N 3.47Å; H97-F101 HydrophobicContact CB-CE2 3.94Å; H97-F101 HydrophobicContact CB-CZ 3.95Å; H97-F101 WeakPolarHBondContact O-CD1 3.29Å; H97-F101 WeakPolarHBondContact O-CD2 3.45Å; H97-F101 WeakPolarHBondContact O-CG 3.3Å; H97-F101 PolarHBondContact O-N 3.14Å; H97-Y166 AromaticContact CD2-CE1 3.62Å; H97-Y166 AromaticContact NE2-CD1 3.82Å; H97-Y166 AromaticContact NE2-CE1 3.8Å; H97-Q169 PolarHBondContact CE1-OE1 3.44Å; H97-Q169 PolarHBondContact NE2-OE1 3.16Å; H97-E464 VanDerWaalsContact CB-OE1 3.23Å; H97-E464 WeakPolarHBondContact CB-OE1 3.39Å; H97-E464 IonicContact CD2-OE1 3.79Å; H97-E464 PolarHBondContact CD2-OE1 3.38Å; H97-E464 IonicContact CG-OE1 2.64Å; H97-E464 PolarHBondContact N-OE1 3.39Å
98	M	97.9	Very high	95.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-39.5	176.9	-70.3	-59.4	-62.1	0	0	113	I43 I91 N95 F101 V102 W247 V256 M463 E464	I43-M98 HydrophobicContact CD1-CE 4.3Å; I43-M98 HydrophobicContact CD1-SD 3.71Å; I43-M98 HydrophobicContact CG1-SD 3.9Å; I91-M98 HydrophobicContact CD1-CE 3.63Å; I91-M98 HydrophobicContact CG1-CE 4.4Å; I91-M98 HydrophobicContact CG2-CB 3.74Å; I91-M98 HydrophobicContact CG2-CG 4.15Å; N95-M98 HydrophobicContact CB-CB 4.14Å; N95-M98 HydrophobicContact CB-CG 4.42Å; N95-M98 PolarHBondContact O-N 3.31Å; M98-F101 HydrophobicContact SD-CD2 4.09Å; M98-F101 HydrophobicContact SD-CE2 4.49Å; M98-V102 WeakPolarHBondContact O-CG2 3.34Å; M98-V102 PolarHBondContact O-N 3.36Å; M98-V102 VanDerWaalsContact O-N 3.14Å; M98-W247 HydrophobicContact CB-CH2 4.19Å; M98-W247 HydrophobicContact CB-CZ2 4.24Å; M98-V256 HydrophobicContact CE-CB 4.33Å; M98-V256 HydrophobicContact CE-CG1 4.13Å; M98-V256 HydrophobicContact CE-CG2 4.02Å; M98-M463 HydrophobicContact CE-SD 3.94Å; M98-M463 HydrophobicContact CG-CB 4.17Å; M98-M463 HydrophobicContact SD-CB 4.09Å; M98-E464 WeakPolarHBondContact CG-OE2 3.39Å; M98-E464 PolarHBondContact N-OE2 2.79Å; M98-E464 VanDerWaalsContact N-OE2 3.15Å
99	Q	97.1	Very high	95.8	Very high	54 Å²	54	51.7 Å²	51.7	25%	0.252	27%	0.266	S	S	.	.	H	α-helix	trans	-63.2	-46.4	174.7	-76.4	-173.4	-19.2	0	0	112.2	S93 N95 L96 H97 V102 K103 W247	S93-Q99 VanDerWaalsContact O-CD 3.24Å; S93-Q99 PolarHBondContact O-NE2 2.94Å; S93-Q99 PolarHBondContact O-OE1 3.38Å; N95-Q99 WeakPolarHBondContact O-CG 3.43Å; N95-Q99 PolarHBondContact O-N 2.87Å; L96-Q99 PolarHBondContact O-N 3.32Å; H97-Q99 VanDerWaalsContact C-N 3.32Å; H97-Q99 PolarHBondContact O-N 2.89Å; Q99-V102 PolarHBondContact O-N 3.37Å; Q99-K103 WeakPolarHBondContact O-CB 3.48Å; Q99-K103 PolarHBondContact O-N 2.88Å; Q99-W247 HydrophobicContact CG-CZ2 3.72Å
100	E	97.8	Very high	96.1	Very high	74 Å²	74	52.3 Å²	52.3	35%	0.346	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-39.8	-179.3	-175.8	57	-155	0	0	111.1	L96 H97 V102 K103 Q104	L96-E100 WeakPolarHBondContact O-CB 3.4Å; L96-E100 PolarHBondContact O-N 3.08Å; H97-E100 PolarHBondContact O-N 3.47Å; E100-V102 PolarHBondContact O-N 3.18Å; E100-K103 PolarHBondContact O-N 3.29Å; E100-K103 IonicContact OE2-NZ 2.66Å; E100-Q104 HydrophobicContact CG-CG 4.34Å; E100-Q104 VanDerWaalsContact CG-NE2 3.34Å; E100-Q104 WeakPolarHBondContact O-CB 3.47Å; E100-Q104 VanDerWaalsContact O-CG 3.31Å; E100-Q104 WeakPolarHBondContact O-CG 3.28Å; E100-Q104 PolarHBondContact O-N 3.3Å; E100-Q104 WeakPolarHBondContact OE1-CG 3.34Å; E100-Q104 PolarHBondContact OE1-NE2 2.83Å
101	F	98.5	Very high	96.1	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.009	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-47.1	174.9	-59.8	-29.3	0	0	0	112.4	A47 F51 H97 M98 K103 Q104 L105 V256 L260	A47-F101 HydrophobicContact CB-CE2 4.06Å; A47-F101 HydrophobicContact CB-CZ 3.89Å; F51-F101 AromaticContact CE1-CE1 3.99Å; F51-F101 HydrophobicContact CE1-CE1 3.99Å; F51-F101 HydrophobicContact CE1-CZ 4.36Å; F51-F101 HydrophobicContact CE2-CE1 4.14Å; F51-F101 AromaticContact CE2-CZ 3.69Å; F51-F101 HydrophobicContact CE2-CZ 3.69Å; F51-F101 AromaticContact CZ-CE1 3.5Å; F51-F101 HydrophobicContact CZ-CE1 3.5Å; F51-F101 VanDerWaalsContact CZ-CE1 3.5Å; F51-F101 AromaticContact CZ-CZ 3.45Å; F51-F101 HydrophobicContact CZ-CZ 3.45Å; F51-F101 VanDerWaalsContact CZ-CZ 3.45Å; H97-F101 HydrophobicContact CB-CE2 3.94Å; H97-F101 HydrophobicContact CB-CZ 3.95Å; H97-F101 WeakPolarHBondContact O-CD1 3.29Å; H97-F101 WeakPolarHBondContact O-CD2 3.45Å; H97-F101 WeakPolarHBondContact O-CG 3.3Å; H97-F101 PolarHBondContact O-N 3.14Å; M98-F101 HydrophobicContact SD-CD2 4.09Å; M98-F101 HydrophobicContact SD-CE2 4.49Å; F101-K103 VanDerWaalsContact C-N 3.28Å; F101-K103 PolarHBondContact O-N 2.75Å; F101-Q104 PolarHBondContact O-N 2.93Å; F101-L105 VanDerWaalsContact O-CB 3.28Å; F101-L105 WeakPolarHBondContact O-CB 3.44Å; F101-L105 WeakPolarHBondContact O-CD1 3.4Å; F101-L105 WeakPolarHBondContact O-CG 3.48Å; F101-L105 PolarHBondContact O-N 3.42Å; F101-V256 HydrophobicContact CB-CG1 3.79Å; F101-V256 HydrophobicContact CD2-CG1 4.01Å; F101-V256 HydrophobicContact CG-CG1 4.3Å; F101-L260 HydrophobicContact CB-CD2 4.16Å; F101-L260 HydrophobicContact CD1-CD1 4.34Å; F101-L260 HydrophobicContact CD1-CD2 3.61Å; F101-L260 HydrophobicContact CD2-CD1 3.83Å; F101-L260 HydrophobicContact CD2-CD2 4.5Å; F101-L260 HydrophobicContact CE1-CD1 4.47Å; F101-L260 HydrophobicContact CE1-CD2 4.07Å; F101-L260 HydrophobicContact CE2-CD1 3.98Å; F101-L260 HydrophobicContact CG-CD1 4.02Å; F101-L260 HydrophobicContact CG-CD2 3.85Å; F101-L260 HydrophobicContact CG-CG 4.41Å; F101-L260 HydrophobicContact CZ-CD1 4.3Å
102	V	97.6	Very high	95.8	Very high	2 Å²	2	62 Å²	62	1%	0.012	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-42.8	178.2	165.5	0	0	0	0	110.8	M98 Q99 E100 G106 L107 Y109 W247 V249 V256	M98-V102 WeakPolarHBondContact O-CG2 3.34Å; M98-V102 PolarHBondContact O-N 3.36Å; M98-V102 VanDerWaalsContact O-N 3.14Å; Q99-V102 PolarHBondContact O-N 3.37Å; E100-V102 PolarHBondContact O-N 3.18Å; V102-G106 PolarHBondContact O-N 2.84Å; V102-L107 HydrophobicContact CB-CB 4.47Å; V102-L107 HydrophobicContact CG1-CB 3.95Å; V102-L107 WeakPolarHBondContact CG1-O 3.41Å; V102-L107 PolarHBondContact O-N 2.94Å; V102-Y109 HydrophobicContact CG1-CD1 4.37Å; V102-Y109 HydrophobicContact CG1-CE1 3.96Å; V102-W247 HydrophobicContact CB-CH2 4.42Å; V102-W247 HydrophobicContact CG2-CH2 3.74Å; V102-W247 HydrophobicContact CG2-CZ3 3.81Å; V102-V249 HydrophobicContact CG2-CG2 3.69Å; V102-V256 HydrophobicContact CG2-CG2 4.06Å
103	K	97.8	Very high	95.6	Very high	148 Å²	148	62.7 Å²	62.7	64%	0.643	31%	0.309	S	S	*	.	H	α-helix	trans	-63.7	-49.1	177	-179	-174	168.9	-160.2	0	112.1	Q99 E100 F101 L105 G106	Q99-K103 WeakPolarHBondContact O-CB 3.48Å; Q99-K103 PolarHBondContact O-N 2.88Å; E100-K103 PolarHBondContact O-N 3.29Å; E100-K103 IonicContact OE2-NZ 2.66Å; F101-K103 VanDerWaalsContact C-N 3.28Å; F101-K103 PolarHBondContact O-N 2.75Å; K103-L105 VanDerWaalsContact C-N 3.29Å; K103-L105 PolarHBondContact O-N 2.93Å; K103-G106 PolarHBondContact O-N 2.79Å; K103-G106 VanDerWaalsContact O-N 3.16Å
104	Q	97.9	Very high	95.3	Very high	71 Å²	71	65.6 Å²	65.6	33%	0.332	34%	0.336	S	S	.	.	H	α-helix	trans	-62.9	-36.3	179.8	-73.5	-177.7	17.7	0	0	112.6	H50 E100 F101 G106 M263	H50-Q104 PolarHBondContact CE1-OE1 2.84Å; H50-Q104 PolarHBondContact NE2-OE1 3.37Å; E100-Q104 HydrophobicContact CG-CG 4.34Å; E100-Q104 VanDerWaalsContact CG-NE2 3.34Å; E100-Q104 WeakPolarHBondContact O-CB 3.47Å; E100-Q104 VanDerWaalsContact O-CG 3.31Å; E100-Q104 WeakPolarHBondContact O-CG 3.28Å; E100-Q104 PolarHBondContact O-N 3.3Å; E100-Q104 WeakPolarHBondContact OE1-CG 3.34Å; E100-Q104 PolarHBondContact OE1-NE2 2.83Å; F101-Q104 PolarHBondContact O-N 2.93Å; Q104-G106 VanDerWaalsContact C-N 3.26Å; Q104-G106 PolarHBondContact O-N 2.88Å; Q104-M263 HydrophobicContact CB-CE 3.97Å; Q104-M263 HydrophobicContact CB-SD 4.17Å
105	L	98.3	Very high	95.1	Very high	40 Å²	40	64.2 Å²	64.2	21%	0.209	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-6.8	178.7	-67.7	170.4	0	0	0	113.7	F101 K103 L107 V256 G259 L260 M263	F101-L105 VanDerWaalsContact O-CB 3.28Å; F101-L105 WeakPolarHBondContact O-CB 3.44Å; F101-L105 WeakPolarHBondContact O-CD1 3.4Å; F101-L105 WeakPolarHBondContact O-CG 3.48Å; F101-L105 PolarHBondContact O-N 3.42Å; K103-L105 VanDerWaalsContact C-N 3.29Å; K103-L105 PolarHBondContact O-N 2.93Å; L105-L107 HydrophobicContact CB-CD1 3.85Å; L105-L107 HydrophobicContact CB-CG 3.71Å; L105-L107 HydrophobicContact CD1-CD1 3.76Å; L105-L107 HydrophobicContact CG-CD1 4.47Å; L105-L107 PolarHBondContact O-N 3.44Å; L105-V256 HydrophobicContact CD1-CG1 4.35Å; L105-G259 VanDerWaalsContact CD2-CA 3.44Å; L105-G259 WeakPolarHBondContact CD2-O 3.46Å; L105-L260 HydrophobicContact CD1-CG 4.39Å; L105-M263 HydrophobicContact CD2-CG 3.64Å; L105-M263 HydrophobicContact CD2-SD 3.29Å; L105-M263 WeakPolarHBondContact CD2-SD 3.49Å; L105-M263 HydrophobicContact CG-SD 3.89Å
106	G	97.9	Very high	95	Very high	64 Å²	64	64.8 Å²	64.8	66%	0.66	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	24.6	-173.8	0	0	0	0	0	113.3	V102 K103 Q104	V102-G106 PolarHBondContact O-N 2.84Å; K103-G106 PolarHBondContact O-N 2.79Å; K103-G106 VanDerWaalsContact O-N 3.16Å; Q104-G106 VanDerWaalsContact C-N 3.26Å; Q104-G106 PolarHBondContact O-N 2.88Å
107	L	97.6	Very high	94.9	Very high	39 Å²	39	64.2 Å²	64.2	20%	0.204	34%	0.337	C	S	.	.			trans	-77.5	155.6	177.5	-65.8	173.6	0	0	0	110.4	V102 L105 V249 Q255 V256	V102-L107 HydrophobicContact CB-CB 4.47Å; V102-L107 HydrophobicContact CG1-CB 3.95Å; V102-L107 WeakPolarHBondContact CG1-O 3.41Å; V102-L107 PolarHBondContact O-N 2.94Å; L105-L107 HydrophobicContact CB-CD1 3.85Å; L105-L107 HydrophobicContact CB-CG 3.71Å; L105-L107 HydrophobicContact CD1-CD1 3.76Å; L105-L107 HydrophobicContact CG-CD1 4.47Å; L105-L107 PolarHBondContact O-N 3.44Å; L107-V249 HydrophobicContact CB-CG1 4.18Å; L107-V249 HydrophobicContact CD1-CG1 4.09Å; L107-Q255 HydrophobicContact CD1-CB 4.23Å; L107-Q255 HydrophobicContact CD2-CB 4.34Å; L107-V256 HydrophobicContact CD1-CG2 4.06Å
108	K	96.8	Very high	94.8	Very high	143 Å²	143	63.2 Å²	63.2	62%	0.622	33%	0.332	S	S	*	.			trans	-106	149	-178.1	-68.6	177	-177.5	174.9	0	111.3	R110 E250	K108-R110 PolarHBondContact O-N 3.04Å; K108-E250 HydrophobicContact CB-CB 4.1Å; K108-E250 VanDerWaalsContact CB-OE2 3.31Å; K108-E250 WeakPolarHBondContact CB-OE2 3.42Å; K108-E250 WeakPolarHBondContact CD-OE2 3.32Å; K108-E250 WeakPolarHBondContact O-CB 3.21Å; K108-E250 PolarHBondContact O-N 3.33Å
109	Y	95.8	Very high	94.7	Very high	120 Å²	120	63.8 Å²	63.8	47%	0.471	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-70.4	127.7	167.1	-60.4	-52.8	0	0	0	110	V102 R111 W247	V102-Y109 HydrophobicContact CG1-CD1 4.37Å; V102-Y109 HydrophobicContact CG1-CE1 3.96Å; Y109-R111 PolarHBondContact O-N 3.39Å; Y109-W247 HydrophobicContact CD1-CB 4.49Å; Y109-W247 AromaticContact CD1-CD2 3.77Å; Y109-W247 HydrophobicContact CD1-CD2 3.77Å; Y109-W247 AromaticContact CD1-CE3 3.35Å; Y109-W247 HydrophobicContact CD1-CE3 3.35Å; Y109-W247 HydrophobicContact CD1-CG 4.29Å; Y109-W247 AromaticContact CD1-CZ3 3.79Å; Y109-W247 HydrophobicContact CD1-CZ3 3.79Å; Y109-W247 AromaticContact CE1-CD2 3.66Å; Y109-W247 HydrophobicContact CE1-CD2 3.66Å; Y109-W247 AromaticContact CE1-CE2 3.97Å; Y109-W247 AromaticContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CE3 3.48Å; Y109-W247 VanDerWaalsContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CG 4.36Å; Y109-W247 AromaticContact CE1-CH2 3.91Å; Y109-W247 HydrophobicContact CE1-CH2 3.91Å; Y109-W247 HydrophobicContact CE1-CZ2 4.08Å; Y109-W247 AromaticContact CE1-CZ3 3.61Å; Y109-W247 HydrophobicContact CE1-CZ3 3.61Å
110	R	94.9	Very high	94.7	Very high	52 Å²	52	61.3 Å²	61.3	20%	0.196	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-59.8	135.4	170.4	-172.7	-178.8	69.1	176	-10.7	108.8	K108 N112 A248 E250 C382 P383 V384 I386	K108-R110 PolarHBondContact O-N 3.04Å; R110-N112 PolarHBondContact O-N 3.2Å; R110-A248 HydrophobicContact CB-CB 4.35Å; R110-A248 WeakPolarHBondContact CB-O 3.45Å; R110-A248 PolarHBondContact N-O 3.47Å; R110-E250 HydrophobicContact CB-CB 4.48Å; R110-C382 PolarHBondContact NH1-O 3.25Å; R110-P383 WeakPolarHBondContact CD-O 3.46Å; R110-P383 PolarHBondContact NH1-O 3.36Å; R110-V384 VanDerWaalsContact CD-O 3.27Å; R110-V384 WeakPolarHBondContact CD-O 3.29Å; R110-V384 WeakPolarHBondContact CG-O 3.33Å; R110-I386 HydrophobicContact CG-CD1 3.84Å; R110-I386 HydrophobicContact CG-CG1 4.04Å
111	R	91.8	Very high	94.6	Very high	137 Å²	137	59.8 Å²	59.8	52%	0.517	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-54.2	134.2	176	-172.2	175.1	-178.1	-169.1	3.6	111.4	Y109 I386 A388	Y109-R111 PolarHBondContact O-N 3.39Å; R111-I386 HydrophobicContact CB-CB 4.27Å; R111-I386 HydrophobicContact CB-CG2 4.25Å; R111-I386 WeakPolarHBondContact O-CD1 3.42Å; R111-A388 VanDerWaalsContact NH1-C 3.27Å; R111-A388 PolarHBondContact NH1-O 3.38Å
112	N	87.1	Confident	94.2	Very high	134 Å²	134	61.3 Å²	61.3	72%	0.717	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-76.4	140.4	174.4	-167.5	5.7	0	0	0	110.9	R110	R110-N112 PolarHBondContact O-N 3.2Å
113	V	88	Confident	93.9	Very high	28 Å²	28	69 Å²	69	17%	0.17	37%	0.365	C	S	.	.			trans	-125.1	108.8	174	-171.8	0	0	0	0	107.5	I386 F390 R392	V113-I386 HydrophobicContact CG2-CD1 3.78Å; V113-I386 HydrophobicContact CG2-CG2 4.19Å; V113-F390 HydrophobicContact CG1-CE1 4.39Å; V113-F390 HydrophobicContact CG2-CD1 4.01Å; V113-F390 HydrophobicContact CG2-CE1 4.22Å; V113-R392 HydrophobicContact CG1-CG 4.18Å; V113-R392 VanDerWaalsContact O-CZ 3.28Å; V113-R392 PolarHBondContact O-NH1 3.43Å; V113-R392 PolarHBondContact O-NH2 2.95Å
114	A	86.1	Confident	93.7	Very high	94 Å²	94	67.6 Å²	67.6	78%	0.777	36%	0.361	S	S	*	.			trans	-60.8	138.2	-178.4	0	0	0	0	0	111.7	R392	A114-R392 PolarHBondContact O-NH1 3.34Å
115	G	87.6	Confident	93.6	Very high	35 Å²	35	65.4 Å²	65.4	36%	0.361	35%	0.352	S	S	.	.			trans	-158.2	142.5	179.9	0	0	0	0	0	110.4
116	K	93	Very high	93.4	Very high	43 Å²	43	64.4 Å²	64.4	19%	0.187	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	148.6	-176.1	-62.1	169.7	-174.1	176.6	0	111.5	E129 D131 P361 F362 A363 S364	K116-E129 WeakPolarHBondContact CA-OE2 3.4Å; K116-E129 HydrophobicContact CB-CB 4.3Å; K116-D131 WeakPolarHBondContact CE-OD1 3.26Å; K116-D131 WeakPolarHBondContact CE-OD2 3.47Å; K116-D131 IonicContact NZ-OD1 2.87Å; K116-D131 PolarHBondContact NZ-OD1 3.05Å; K116-D131 VanDerWaalsContact NZ-OD1 3.09Å; K116-D131 IonicContact NZ-OD2 2.76Å; K116-D131 PolarHBondContact NZ-OD2 2.97Å; K116-P361 HydrophobicContact CD-CB 4.26Å; K116-F362 HydrophobicContact CB-CD1 4.02Å; K116-F362 CarbonylContact O-C 3.56Å; K116-F362 WeakPolarHBondContact O-CA 3.48Å; K116-A363 PolarHBondContact O-N 3.23Å; K116-S364 PolarHBondContact O-N 3.13Å; K116-S364 VanDerWaalsContact O-N 3.13Å
117	T	94.6	Very high	93.2	Very high	47 Å²	47	62.9 Å²	62.9	29%	0.288	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	146	175.9	-54	0	0	0	0	111.2	E129 S364 L366	T117-E129 PolarHBondContact N-OE2 2.93Å; T117-E129 VanDerWaalsContact O-CB 3.23Å; T117-E129 WeakPolarHBondContact O-CB 3.23Å; T117-E129 PolarHBondContact O-N 3.1Å; T117-E129 PolarHBondContact OG1-OE2 2.68Å; T117-S364 CarbonylContact C-O 3.56Å; T117-S364 WeakPolarHBondContact CA-O 3.37Å; T117-L366 HydrophobicContact CG2-CD1 3.99Å; T117-L366 HydrophobicContact CG2-CG 3.82Å
118	A	96.7	Very high	93	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	157.4	170.2	0	0	0	0	0	111	V125 L127 F362 S364 V365 L366	A118-V125 HydrophobicContact CB-CG1 3.79Å; A118-L127 CarbonylContact C-O 3.51Å; A118-L127 WeakPolarHBondContact CA-O 3.22Å; A118-F362 HydrophobicContact CB-CB 4.4Å; A118-F362 HydrophobicContact CB-CD1 3.69Å; A118-F362 HydrophobicContact CB-CD2 3.75Å; A118-F362 HydrophobicContact CB-CE1 3.85Å; A118-F362 HydrophobicContact CB-CE2 3.89Å; A118-F362 HydrophobicContact CB-CG 3.66Å; A118-F362 HydrophobicContact CB-CZ 3.96Å; A118-S364 PolarHBondContact N-O 2.87Å; A118-V365 WeakPolarHBondContact O-CA 3.43Å; A118-L366 PolarHBondContact O-N 2.97Å
119	V	97.1	Very high	92.7	Very high	12 Å²	12	62.2 Å²	62.2	7%	0.073	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	127.9	170.7	-176.3	0	0	0	0	109.4	V125 I126 L127 P218 L366 T368	V119-V125 CarbonylContact O-C 3.53Å; V119-V125 WeakPolarHBondContact O-CA 3.43Å; V119-I126 HydrophobicContact CB-CG1 4.05Å; V119-I126 HydrophobicContact CG1-CD1 3.95Å; V119-I126 HydrophobicContact CG1-CG1 3.92Å; V119-I126 WeakPolarHBondContact O-CG1 3.22Å; V119-I126 PolarHBondContact O-N 3.17Å; V119-L127 HydrophobicContact CB-CB 4.01Å; V119-L127 HydrophobicContact CB-CD1 4.48Å; V119-L127 HydrophobicContact CG2-CB 4.04Å; V119-L127 HydrophobicContact CG2-CD1 4.12Å; V119-L127 PolarHBondContact N-O 3.03Å; V119-P218 HydrophobicContact CG1-CB 4.2Å; V119-P218 HydrophobicContact CG1-CG 3.58Å; V119-P218 HydrophobicContact CG2-CB 4.44Å; V119-P218 HydrophobicContact CG2-CG 4.37Å; V119-L366 WeakPolarHBondContact CA-O 3.34Å; V119-T368 HydrophobicContact CG1-CG2 3.82Å
120	F	96.9	Very high	92.4	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.009	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.1	-177.6	179.1	-113.7	0	0	0	111	S122 E124 V125 F351 F352 V365 L366 T367 T368 L373	F120-S122 VanDerWaalsContact CZ-O 3.31Å; F120-S122 WeakPolarHBondContact CZ-O 3.45Å; F120-E124 VanDerWaalsContact CD2-O 3.24Å; F120-E124 WeakPolarHBondContact CD2-O 3.35Å; F120-V125 HydrophobicContact CD2-CG2 4.11Å; F120-F351 HydrophobicContact CD1-CE1 4.38Å; F120-F351 HydrophobicContact CE1-CD1 4.26Å; F120-F351 AromaticContact CE1-CE1 3.59Å; F120-F351 HydrophobicContact CE1-CE1 3.59Å; F120-F351 HydrophobicContact CE1-CZ 4.06Å; F120-F351 HydrophobicContact CZ-CE1 4.17Å; F120-F351 WeakPolarHBondContact CZ-O 3.31Å; F120-F352 HydrophobicContact CB-CD1 4.38Å; F120-F352 HydrophobicContact CD1-CD1 4.03Å; F120-F352 HydrophobicContact CD1-CE1 4.2Å; F120-F352 HydrophobicContact CD2-CD1 4.15Å; F120-F352 HydrophobicContact CE1-CD1 4.3Å; F120-F352 HydrophobicContact CE2-CD1 4.45Å; F120-F352 AromaticContact CG-CD1 3.94Å; F120-F352 HydrophobicContact CG-CD1 3.94Å; F120-F352 HydrophobicContact CG-CE1 4.46Å; F120-V365 HydrophobicContact CB-CG1 3.59Å; F120-L366 PolarHBondContact N-O 3.47Å; F120-T367 WeakPolarHBondContact O-CA 3.47Å; F120-T368 PolarHBondContact O-N 3.23Å; F120-L373 HydrophobicContact CD1-CD2 4.28Å; F120-L373 HydrophobicContact CE1-CD2 3.98Å
121	N	93.8	Very high	91.9	Very high	41 Å²	41	61.3 Å²	61.3	22%	0.219	33%	0.33	C	S	.	.			trans	-105.4	22.4	-175.5	76.8	-11.8	0	0	0	114.7	E123 E124 I126 T368	N121-E123 VanDerWaalsContact C-N 3.26Å; N121-E123 PolarHBondContact O-N 2.87Å; N121-E123 PolarHBondContact OD1-N 2.76Å; N121-E123 VanDerWaalsContact OD1-N 3.1Å; N121-E124 PolarHBondContact N-O 3.39Å; N121-E124 PolarHBondContact OD1-N 3.43Å; N121-E124 PolarHBondContact OD1-O 2.87Å; N121-I126 HydrophobicContact CB-CD1 4.29Å; N121-I126 HydrophobicContact CB-CG2 4.01Å; N121-I126 WeakPolarHBondContact ND2-CG2 3.37Å; N121-T368 VanDerWaalsContact CA-OG1 3.31Å; N121-T368 WeakPolarHBondContact CA-OG1 3.44Å; N121-T368 HydrophobicContact CB-CG2 4.3Å
122	S	91.4	Very high	91.6	Very high	35 Å²	35	63.8 Å²	63.8	25%	0.245	34%	0.339	C	S	.	.	S	Bend	trans	81.2	-21.5	-172	85.2	0	0	0	0	116.5	F120 S372	F120-S122 VanDerWaalsContact CZ-O 3.31Å; F120-S122 WeakPolarHBondContact CZ-O 3.45Å; S122-S372 VanDerWaalsContact CB-OG 3.31Å; S122-S372 WeakPolarHBondContact CB-OG 3.47Å; S122-S372 PolarHBondContact OG-OG 2.85Å
123	E	91.7	Very high	91.4	Very high	162 Å²	162	64.4 Å²	64.4	76%	0.757	33%	0.333	S	S	*	.	S	Bend	trans	-111.7	-48.5	179	-62.4	-175.9	173.8	0	0	111.3	N121	N121-E123 VanDerWaalsContact C-N 3.26Å; N121-E123 PolarHBondContact O-N 2.87Å; N121-E123 PolarHBondContact OD1-N 2.76Å; N121-E123 VanDerWaalsContact OD1-N 3.1Å
124	E	93.6	Very high	91.3	Very high	120 Å²	120	69.6 Å²	69.6	56%	0.561	36%	0.358	S	S	*	.	S	Bend	trans	-143	165.2	-176.5	65.4	178.2	179.6	0	0	112.6	F120 N121 I126	F120-E124 VanDerWaalsContact CD2-O 3.24Å; F120-E124 WeakPolarHBondContact CD2-O 3.35Å; N121-E124 PolarHBondContact N-O 3.39Å; N121-E124 PolarHBondContact OD1-N 3.43Å; N121-E124 PolarHBondContact OD1-O 2.87Å; E124-I126 HydrophobicContact CG-CG2 4.01Å; E124-I126 PolarHBondContact O-N 2.83Å
125	V	95.4	Very high	91.3	Very high	24 Å²	24	68.4 Å²	68.4	15%	0.145	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	115	169.3	173.9	0	0	0	0	108.4	A118 V119 F120 L127 E128 F354	A118-V125 HydrophobicContact CB-CG1 3.79Å; V119-V125 CarbonylContact O-C 3.53Å; V119-V125 WeakPolarHBondContact O-CA 3.43Å; F120-V125 HydrophobicContact CD2-CG2 4.11Å; V125-L127 VanDerWaalsContact CG1-O 3.31Å; V125-L127 WeakPolarHBondContact CG1-O 3.26Å; V125-E128 HydrophobicContact CG1-CG 3.52Å; V125-F354 HydrophobicContact CG2-CE2 3.99Å
126	I	94.6	Very high	91.3	Very high	19 Å²	19	68 Å²	68	10%	0.097	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-20.2	-173.8	57.5	165.3	0	0	0	113.2	V119 N121 E124 E214 T368	V119-I126 HydrophobicContact CB-CG1 4.05Å; V119-I126 HydrophobicContact CG1-CD1 3.95Å; V119-I126 HydrophobicContact CG1-CG1 3.92Å; V119-I126 WeakPolarHBondContact O-CG1 3.22Å; V119-I126 PolarHBondContact O-N 3.17Å; N121-I126 HydrophobicContact CB-CD1 4.29Å; N121-I126 HydrophobicContact CB-CG2 4.01Å; N121-I126 WeakPolarHBondContact ND2-CG2 3.37Å; E124-I126 HydrophobicContact CG-CG2 4.01Å; E124-I126 PolarHBondContact O-N 2.83Å; I126-E214 HydrophobicContact CD1-CB 3.81Å; I126-E214 HydrophobicContact CD1-CG 3.68Å; I126-T368 HydrophobicContact CD1-CG2 3.79Å
127	L	93.3	Very high	90.9	Very high	33 Å²	33	68.9 Å²	68.9	17%	0.173	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	139.7	176.5	-71.3	174.5	0	0	0	110.7	A118 V119 V125 Y144 E214 V215	A118-L127 CarbonylContact C-O 3.51Å; A118-L127 WeakPolarHBondContact CA-O 3.22Å; V119-L127 HydrophobicContact CB-CB 4.01Å; V119-L127 HydrophobicContact CB-CD1 4.48Å; V119-L127 HydrophobicContact CG2-CB 4.04Å; V119-L127 HydrophobicContact CG2-CD1 4.12Å; V119-L127 PolarHBondContact N-O 3.03Å; V125-L127 VanDerWaalsContact CG1-O 3.31Å; V125-L127 WeakPolarHBondContact CG1-O 3.26Å; L127-Y144 HydrophobicContact CD1-CE2 4.4Å; L127-Y144 WeakPolarHBondContact CD1-OH 3.19Å; L127-Y144 HydrophobicContact CD2-CE2 4Å; L127-Y144 VanDerWaalsContact CD2-OH 3.31Å; L127-Y144 WeakPolarHBondContact CD2-OH 3.48Å; L127-Y144 WeakPolarHBondContact CG-OH 3.36Å; L127-E214 HydrophobicContact CD1-CB 4.46Å; L127-E214 WeakPolarHBondContact CD1-O 3.36Å; L127-V215 HydrophobicContact CD1-CG2 3.54Å
128	E	93.6	Very high	90.6	Very high	81 Å²	81	72 Å²	72	38%	0.379	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	125.5	-178.7	-59.2	-177.1	169.5	0	0	109.4	V125 F362	V125-E128 HydrophobicContact CG1-CG 3.52Å; E128-F362 HydrophobicContact CB-CE1 3.91Å; E128-F362 HydrophobicContact CB-CZ 3.97Å; E128-F362 HydrophobicContact CG-CE1 4.05Å; E128-F362 HydrophobicContact CG-CZ 3.59Å
129	E	90.8	Very high	90.3	Very high	86 Å²	86	77.1 Å²	77.1	40%	0.402	36%	0.364	S	S	.	.			trans	-75	135.8	166.1	-171.7	-179.6	-175.8	0	0	109.9	K116 T117	K116-E129 WeakPolarHBondContact CA-OE2 3.4Å; K116-E129 HydrophobicContact CB-CB 4.3Å; T117-E129 PolarHBondContact N-OE2 2.93Å; T117-E129 VanDerWaalsContact O-CB 3.23Å; T117-E129 WeakPolarHBondContact O-CB 3.23Å; T117-E129 PolarHBondContact O-N 3.1Å; T117-E129 PolarHBondContact OG1-OE2 2.68Å
130	T	88.1	Confident	89.9	Confident	27 Å²	27	78.2 Å²	78.2	17%	0.166	37%	0.369	C	S	.	.			trans	-112	176.2	-179.5	70.8	0	0	0	0	111.3	W132 L135 D136 R139	T130-W132 PolarHBondContact O-N 3.25Å; T130-W132 PolarHBondContact OG1-N 3.04Å; T130-W132 PolarHBondContact OG1-O 3.06Å; T130-L135 HydrophobicContact CG2-CD2 4.39Å; T130-D136 WeakPolarHBondContact CB-OD1 3.43Å; T130-D136 VanDerWaalsContact CG2-OD1 3.31Å; T130-D136 WeakPolarHBondContact CG2-OD1 3.46Å; T130-D136 PolarHBondContact N-OD1 3.12Å; T130-D136 PolarHBondContact N-OD2 2.88Å; T130-D136 VanDerWaalsContact OG1-CG 3.28Å; T130-D136 PolarHBondContact OG1-OD1 3.45Å; T130-D136 PolarHBondContact OG1-OD2 3.3Å; T130-R139 VanDerWaalsContact CG2-NH1 3.26Å
131	D	85.2	Confident	89.7	Confident	126 Å²	126	84.8 Å²	84.8	67%	0.674	39%	0.394	S	S	*	.	S	Bend	trans	-74.3	-5.9	171.3	-60.2	-56	0	0	0	112.4	K116	K116-D131 WeakPolarHBondContact CE-OD1 3.26Å; K116-D131 WeakPolarHBondContact CE-OD2 3.47Å; K116-D131 IonicContact NZ-OD1 2.87Å; K116-D131 PolarHBondContact NZ-OD1 3.05Å; K116-D131 VanDerWaalsContact NZ-OD1 3.09Å; K116-D131 IonicContact NZ-OD2 2.76Å; K116-D131 PolarHBondContact NZ-OD2 2.97Å
132	W	85.5	Confident	89.6	Confident	189 Å²	189	92.3 Å²	92.3	72%	0.716	42%	0.419	S	S	*	.			trans	-113.8	90.1	-170.6	-62.2	85.6	0	0	0	110.3	T130 L134 L135 D136	T130-W132 PolarHBondContact O-N 3.25Å; T130-W132 PolarHBondContact OG1-N 3.04Å; T130-W132 PolarHBondContact OG1-O 3.06Å; W132-L134 PolarHBondContact O-N 3.23Å; W132-L134 VanDerWaalsContact O-N 3.08Å; W132-L135 HydrophobicContact CB-CB 3.74Å; W132-L135 HydrophobicContact CB-CD2 4.45Å; W132-L135 WeakPolarHBondContact O-CA 3.48Å; W132-L135 VanDerWaalsContact O-CB 3.29Å; W132-L135 WeakPolarHBondContact O-CB 3.29Å; W132-L135 PolarHBondContact O-N 2.89Å; W132-D136 PolarHBondContact O-N 2.82Å; W132-D136 VanDerWaalsContact O-N 3.1Å
133	Y	82.9	Confident	89.7	Confident	148 Å²	148	94.6 Å²	94.6	58%	0.58	42%	0.422	S	S	*	.	H	α-helix	trans	-47.7	-42.7	-179.5	175.6	-101	0	0	0	114.1	L135 D136 L137	Y133-L135 VanDerWaalsContact C-N 3.33Å; Y133-L135 PolarHBondContact O-N 2.78Å; Y133-D136 PolarHBondContact O-N 3.07Å; Y133-L137 PolarHBondContact O-N 3.41Å
134	L	84.9	Confident	89.8	Confident	136 Å²	136	87.3 Å²	87.3	71%	0.712	39%	0.388	S	S	*	.	H	α-helix	trans	-66.8	-32.7	178.5	-65.5	178.6	0	0	0	113	W132 F138	W132-L134 PolarHBondContact O-N 3.23Å; W132-L134 VanDerWaalsContact O-N 3.08Å; L134-F138 WeakPolarHBondContact O-CB 3.35Å; L134-F138 PolarHBondContact O-N 3.22Å
135	L	87.3	Confident	89.8	Confident	70 Å²	70	83.1 Å²	83.1	37%	0.366	38%	0.377	S	S	.	.	H	α-helix	trans	-69.3	-42.2	175.6	178.8	61.2	0	0	0	110.5	T130 W132 Y133 F138 R139	T130-L135 HydrophobicContact CG2-CD2 4.39Å; W132-L135 HydrophobicContact CB-CB 3.74Å; W132-L135 HydrophobicContact CB-CD2 4.45Å; W132-L135 WeakPolarHBondContact O-CA 3.48Å; W132-L135 VanDerWaalsContact O-CB 3.29Å; W132-L135 WeakPolarHBondContact O-CB 3.29Å; W132-L135 PolarHBondContact O-N 2.89Å; Y133-L135 VanDerWaalsContact C-N 3.33Å; Y133-L135 PolarHBondContact O-N 2.78Å; L135-F138 PolarHBondContact O-N 2.76Å; L135-R139 HydrophobicContact CD1-CG 4.48Å; L135-R139 WeakPolarHBondContact O-CB 3.35Å; L135-R139 WeakPolarHBondContact O-CG 3.46Å; L135-R139 PolarHBondContact O-N 2.65Å
136	D	86.5	Confident	89.7	Confident	25 Å²	25	85.7 Å²	85.7	13%	0.134	39%	0.389	C	S	.	.	H	α-helix	trans	-63.2	-44.2	176.7	-66	-16.9	0	0	0	110.6	T130 W132 Y133 F138 R139 L140	T130-D136 WeakPolarHBondContact CB-OD1 3.43Å; T130-D136 VanDerWaalsContact CG2-OD1 3.31Å; T130-D136 WeakPolarHBondContact CG2-OD1 3.46Å; T130-D136 PolarHBondContact N-OD1 3.12Å; T130-D136 PolarHBondContact N-OD2 2.88Å; T130-D136 VanDerWaalsContact OG1-CG 3.28Å; T130-D136 PolarHBondContact OG1-OD1 3.45Å; T130-D136 PolarHBondContact OG1-OD2 3.3Å; W132-D136 PolarHBondContact O-N 2.82Å; W132-D136 VanDerWaalsContact O-N 3.1Å; Y133-D136 PolarHBondContact O-N 3.07Å; D136-F138 VanDerWaalsContact C-N 3.35Å; D136-F138 PolarHBondContact O-N 3.46Å; D136-R139 PolarHBondContact O-N 3.45Å; D136-L140 WeakPolarHBondContact O-CB 3.44Å; D136-L140 VanDerWaalsContact O-CG 3.31Å; D136-L140 WeakPolarHBondContact O-CG 3.27Å; D136-L140 PolarHBondContact O-N 3.48Å
137	L	84.8	Confident	89.7	Confident	62 Å²	62	85 Å²	85	33%	0.325	39%	0.386	S	S	.	.	H	α-helix	trans	-61	-42.5	175.1	-173	63.2	0	0	0	112.1	Y133 L140 W141 F148	Y133-L137 PolarHBondContact O-N 3.41Å; L137-L140 PolarHBondContact O-N 2.88Å; L137-W141 WeakPolarHBondContact O-CB 3.41Å; L137-W141 PolarHBondContact O-N 3.37Å; L137-F148 HydrophobicContact CD1-CD1 3.92Å; L137-F148 HydrophobicContact CD1-CE1 3.82Å
138	F	88.1	Confident	89.6	Confident	113 Å²	113	85.8 Å²	85.8	50%	0.496	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-43.7	175.2	176.6	-98.3	0	0	0	111.9	L134 L135 D136 W141 W142	L134-F138 WeakPolarHBondContact O-CB 3.35Å; L134-F138 PolarHBondContact O-N 3.22Å; L135-F138 PolarHBondContact O-N 2.76Å; D136-F138 VanDerWaalsContact C-N 3.35Å; D136-F138 PolarHBondContact O-N 3.46Å; F138-W141 HydrophobicContact CE2-CE3 4.48Å; F138-W141 PolarHBondContact O-N 3.48Å; F138-W142 HydrophobicContact CZ-CE3 4.34Å; F138-W142 VanDerWaalsContact O-CB 3.3Å; F138-W142 WeakPolarHBondContact O-CB 3.48Å; F138-W142 PolarHBondContact O-N 3.37Å
139	R	89.9	Confident	89.5	Confident	108 Å²	108	86 Å²	86	41%	0.408	39%	0.391	S	S	.	.	H	α-helix	trans	-61.2	-44.3	176.5	-76	173.3	172.3	-170.3	-4.3	111.6	T130 L135 D136 W142 R143	T130-R139 VanDerWaalsContact CG2-NH1 3.26Å; L135-R139 HydrophobicContact CD1-CG 4.48Å; L135-R139 WeakPolarHBondContact O-CB 3.35Å; L135-R139 WeakPolarHBondContact O-CG 3.46Å; L135-R139 PolarHBondContact O-N 2.65Å; D136-R139 PolarHBondContact O-N 3.45Å; R139-W142 PolarHBondContact O-N 3.13Å; R139-R143 VanDerWaalsContact O-CB 3.28Å; R139-R143 WeakPolarHBondContact O-CB 3.4Å; R139-R143 PolarHBondContact O-N 3.33Å
140	L	90.8	Very high	89.7	Confident	36 Å²	36	86.8 Å²	86.8	19%	0.188	39%	0.39	C	S	.	.	H	α-helix	trans	-61	-47.3	175.7	-71.5	176.4	0	0	0	110.9	D136 L137 R143 Y144 F148	D136-L140 WeakPolarHBondContact O-CB 3.44Å; D136-L140 VanDerWaalsContact O-CG 3.31Å; D136-L140 WeakPolarHBondContact O-CG 3.27Å; D136-L140 PolarHBondContact O-N 3.48Å; L137-L140 PolarHBondContact O-N 2.88Å; L140-R143 PolarHBondContact O-N 3.24Å; L140-Y144 HydrophobicContact CB-CD2 4.45Å; L140-Y144 HydrophobicContact CD2-CD2 3.83Å; L140-Y144 HydrophobicContact CD2-CE2 3.74Å; L140-Y144 WeakPolarHBondContact O-CA 3.45Å; L140-Y144 VanDerWaalsContact O-CB 3.31Å; L140-Y144 WeakPolarHBondContact O-CB 3.12Å; L140-Y144 WeakPolarHBondContact O-CD2 3.23Å; L140-Y144 PolarHBondContact O-N 3.25Å; L140-F148 HydrophobicContact CD1-CD2 4.06Å; L140-F148 HydrophobicContact CD1-CE2 4.28Å; L140-F148 HydrophobicContact CD1-CG 4.32Å
141	W	90.8	Very high	90	Very high	139 Å²	139	86 Å²	86	53%	0.527	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-42.8	178.9	-177.2	78.1	0	0	0	112.6	L137 F138 G145	L137-W141 WeakPolarHBondContact O-CB 3.41Å; L137-W141 PolarHBondContact O-N 3.37Å; F138-W141 HydrophobicContact CE2-CE3 4.48Å; F138-W141 PolarHBondContact O-N 3.48Å; W141-G145 WeakPolarHBondContact O-CA 3.38Å; W141-G145 PolarHBondContact O-N 3.23Å
142	W	92	Very high	90.3	Very high	199 Å²	199	82.2 Å²	82.2	75%	0.754	36%	0.363	S	S	*	.	H	α-helix	trans	-64.5	-41.7	178.2	-177	-99.5	0	0	0	112.3	F138 R139	F138-W142 HydrophobicContact CZ-CE3 4.34Å; F138-W142 VanDerWaalsContact O-CB 3.3Å; F138-W142 WeakPolarHBondContact O-CB 3.48Å; F138-W142 PolarHBondContact O-N 3.37Å; R139-W142 PolarHBondContact O-N 3.13Å
143	R	94	Very high	90.7	Very high	83 Å²	83	79 Å²	79	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-82.7	-32.6	-176	-170.4	172.1	176.9	119	-2.8	113.5	R139 L140 E214	R139-R143 VanDerWaalsContact O-CB 3.28Å; R139-R143 WeakPolarHBondContact O-CB 3.4Å; R139-R143 PolarHBondContact O-N 3.33Å; L140-R143 PolarHBondContact O-N 3.24Å; R143-E214 IonicContact CZ-OE1 3.9Å; R143-E214 IonicContact CZ-OE2 2.84Å; R143-E214 VanDerWaalsContact CZ-OE2 3.24Å; R143-E214 IonicContact NE-OE1 3.48Å; R143-E214 IonicContact NE-OE2 3.22Å; R143-E214 PolarHBondContact NE-OE2 2.79Å; R143-E214 IonicContact NH2-OE1 3.81Å; R143-E214 PolarHBondContact NH2-OE1 3.45Å; R143-E214 IonicContact NH2-OE2 3.42Å; R143-E214 PolarHBondContact NH2-OE2 2.9Å
144	Y	94.1	Very high	91.4	Very high	10 Å²	10	73 Å²	73	4%	0.039	33%	0.334	C	S	.	.	H	α-helix	trans	-125	1.4	-169.7	-51.2	-67.6	0	0	0	114.6	L127 L140 S147 R210 F211 E214 V215	L127-Y144 HydrophobicContact CD1-CE2 4.4Å; L127-Y144 WeakPolarHBondContact CD1-OH 3.19Å; L127-Y144 HydrophobicContact CD2-CE2 4Å; L127-Y144 VanDerWaalsContact CD2-OH 3.31Å; L127-Y144 WeakPolarHBondContact CD2-OH 3.48Å; L127-Y144 WeakPolarHBondContact CG-OH 3.36Å; L140-Y144 HydrophobicContact CB-CD2 4.45Å; L140-Y144 HydrophobicContact CD2-CD2 3.83Å; L140-Y144 HydrophobicContact CD2-CE2 3.74Å; L140-Y144 WeakPolarHBondContact O-CA 3.45Å; L140-Y144 VanDerWaalsContact O-CB 3.31Å; L140-Y144 WeakPolarHBondContact O-CB 3.12Å; L140-Y144 WeakPolarHBondContact O-CD2 3.23Å; L140-Y144 PolarHBondContact O-N 3.25Å; Y144-S147 VanDerWaalsContact O-CB 3.29Å; Y144-S147 WeakPolarHBondContact O-CB 3.49Å; Y144-S147 PolarHBondContact O-N 2.99Å; Y144-S147 PolarHBondContact O-OG 2.91Å; Y144-R210 HydrophobicContact CD1-CG 4.4Å; Y144-R210 HydrophobicContact CE1-CG 4.01Å; Y144-F211 HydrophobicContact CD1-CB 3.8Å; Y144-F211 AromaticContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CG 4.32Å; Y144-F211 AromaticContact CD2-CD2 3.6Å; Y144-F211 HydrophobicContact CD2-CD2 3.6Å; Y144-F211 HydrophobicContact CD2-CE2 4.08Å; Y144-F211 HydrophobicContact CE1-CB 4.44Å; Y144-F211 HydrophobicContact CE1-CD2 4.34Å; Y144-F211 HydrophobicContact CE2-CD2 4.14Å; Y144-F211 HydrophobicContact CG-CB 4.13Å; Y144-F211 AromaticContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CD2 3.43Å; Y144-F211 VanDerWaalsContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CE2 4.29Å; Y144-F211 HydrophobicContact CG-CG 4.23Å; Y144-E214 HydrophobicContact CE1-CB 4.24Å; Y144-E214 VanDerWaalsContact CE1-OE2 3.26Å; Y144-E214 WeakPolarHBondContact CE1-OE2 3.43Å; Y144-E214 VanDerWaalsContact CZ-OE2 3.28Å; Y144-E214 WeakPolarHBondContact OH-CB 3.48Å; Y144-E214 PolarHBondContact OH-OE2 3.12Å; Y144-V215 HydrophobicContact CE2-CG2 4.05Å
145	G	92.8	Very high	91.8	Very high	32 Å²	32	66.7 Å²	66.7	33%	0.33	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	-136.4	-175.6	0	0	0	0	0	111.8	W141 S147	W141-G145 WeakPolarHBondContact O-CA 3.38Å; W141-G145 PolarHBondContact O-N 3.23Å; G145-S147 VanDerWaalsContact C-N 3.27Å; G145-S147 PolarHBondContact O-N 3.3Å
146	I	93.4	Very high	92.1	Very high	77 Å²	77	68.7 Å²	68.7	40%	0.395	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	10.5	-179.9	62.3	171.5	0	0	0	113.8	F148 I149 R150	I146-F148 VanDerWaalsContact C-N 3.28Å; I146-F148 PolarHBondContact O-N 2.88Å; I146-I149 PolarHBondContact O-N 3.32Å; I146-I149 VanDerWaalsContact O-N 3.15Å; I146-R150 PolarHBondContact O-N 3.27Å
147	S	95.1	Very high	92.5	Very high	4 Å²	4	72.1 Å²	72.1	3%	0.028	32%	0.324	C	S	.	.	H	α-helix	trans	-56.8	-40.9	-179.8	-61.1	0	0	0	0	112.3	Y144 G145 I149 R150 L151 S208	Y144-S147 VanDerWaalsContact O-CB 3.29Å; Y144-S147 WeakPolarHBondContact O-CB 3.49Å; Y144-S147 PolarHBondContact O-N 2.99Å; Y144-S147 PolarHBondContact O-OG 2.91Å; G145-S147 VanDerWaalsContact C-N 3.27Å; G145-S147 PolarHBondContact O-N 3.3Å; S147-I149 PolarHBondContact O-N 3.28Å; S147-R150 PolarHBondContact O-N 2.71Å; S147-L151 WeakPolarHBondContact O-CB 3.42Å; S147-L151 PolarHBondContact O-N 3.13Å; S147-S208 PolarHBondContact OG-N 3.34Å; S147-S208 PolarHBondContact OG-OG 3.46Å
148	F	91.2	Very high	93	Very high	51 Å²	51	69.8 Å²	69.8	22%	0.224	31%	0.311	C	S	.	.	H	α-helix	trans	-62.2	-42.9	177.2	175.9	-103.3	0	0	0	112.3	L137 L140 I146 L151 Q152 F211	L137-F148 HydrophobicContact CD1-CD1 3.92Å; L137-F148 HydrophobicContact CD1-CE1 3.82Å; L140-F148 HydrophobicContact CD1-CD2 4.06Å; L140-F148 HydrophobicContact CD1-CE2 4.28Å; L140-F148 HydrophobicContact CD1-CG 4.32Å; I146-F148 VanDerWaalsContact C-N 3.28Å; I146-F148 PolarHBondContact O-N 2.88Å; F148-L151 WeakPolarHBondContact O-CB 3.12Å; F148-L151 PolarHBondContact O-N 3.2Å; F148-Q152 HydrophobicContact CD1-CG 4.45Å; F148-Q152 HydrophobicContact CE1-CG 4.01Å; F148-Q152 HydrophobicContact CE2-CG 4.16Å; F148-Q152 HydrophobicContact CZ-CG 3.85Å; F148-Q152 WeakPolarHBondContact O-CG 3.33Å; F148-Q152 PolarHBondContact O-N 3.29Å; F148-F211 HydrophobicContact CB-CE2 4.19Å; F148-F211 HydrophobicContact CB-CZ 4.01Å; F148-F211 HydrophobicContact CD2-CZ 4.1Å
149	I	91.4	Very high	93.2	Very high	86 Å²	86	65.8 Å²	65.8	44%	0.441	30%	0.295	S	S	.	.	H	α-helix	trans	-66.3	-45	179.2	-60.3	174.4	0	0	0	110.2	I146 S147 L151 Q152 M153	I146-I149 PolarHBondContact O-N 3.32Å; I146-I149 VanDerWaalsContact O-N 3.15Å; S147-I149 PolarHBondContact O-N 3.28Å; I149-L151 VanDerWaalsContact C-N 3.29Å; I149-L151 PolarHBondContact O-N 2.81Å; I149-Q152 PolarHBondContact O-N 3.22Å; I149-M153 HydrophobicContact CG2-CG 4.39Å; I149-M153 HydrophobicContact CG2-SD 4.03Å; I149-M153 WeakPolarHBondContact O-CG 3.36Å; I149-M153 PolarHBondContact O-N 3.3Å
150	R	94.9	Very high	93.4	Very high	102 Å²	102	67.4 Å²	67.4	39%	0.385	31%	0.307	S	S	.	.	H	α-helix	trans	-57.1	-43.2	175.9	-73.4	170.8	166.1	169	-2	111.7	I146 S147 W154 L205 G206 V207	I146-R150 PolarHBondContact O-N 3.27Å; S147-R150 PolarHBondContact O-N 2.71Å; R150-W154 WeakPolarHBondContact O-CB 3.43Å; R150-W154 PolarHBondContact O-N 3.15Å; R150-L205 VanDerWaalsContact CD-O 3.28Å; R150-L205 WeakPolarHBondContact CD-O 3.44Å; R150-L205 PolarHBondContact NE-O 3.4Å; R150-G206 PolarHBondContact NH1-O 3.13Å; R150-V207 HydrophobicContact CB-CG2 4.16Å
151	L	94.6	Very high	93.6	Very high	9 Å²	9	68.2 Å²	68.2	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-49.3	175.7	-177.3	71.4	0	0	0	111.7	S147 F148 I149 M153 W154 V155 L202 F211 I216 L239	S147-L151 WeakPolarHBondContact O-CB 3.42Å; S147-L151 PolarHBondContact O-N 3.13Å; F148-L151 WeakPolarHBondContact O-CB 3.12Å; F148-L151 PolarHBondContact O-N 3.2Å; I149-L151 VanDerWaalsContact C-N 3.29Å; I149-L151 PolarHBondContact O-N 2.81Å; L151-M153 PolarHBondContact O-N 2.89Å; L151-W154 HydrophobicContact CD1-CE3 4.27Å; L151-W154 PolarHBondContact O-N 3.3Å; L151-V155 HydrophobicContact CD1-CG2 4.36Å; L151-V155 HydrophobicContact CG-CG2 4.46Å; L151-V155 WeakPolarHBondContact O-CG2 3.4Å; L151-V155 PolarHBondContact O-N 3.11Å; L151-L202 HydrophobicContact CD1-CD2 3.84Å; L151-F211 HydrophobicContact CB-CE1 4.11Å; L151-F211 HydrophobicContact CD2-CE1 3.66Å; L151-F211 HydrophobicContact CD2-CZ 4.06Å; L151-F211 HydrophobicContact CG-CE1 4.42Å; L151-I216 HydrophobicContact CD1-CD1 3.87Å; L151-I216 HydrophobicContact CD2-CD1 4.19Å; L151-I216 HydrophobicContact CD2-CG1 4.32Å; L151-L239 HydrophobicContact CD1-CD1 3.73Å; L151-L239 HydrophobicContact CD2-CD2 4.2Å
152	Q	91.7	Very high	93.8	Very high	47 Å²	47	62.9 Å²	62.9	22%	0.22	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-49.1	-179.9	-70	-57.6	-46.8	0	0	111.2	F148 I149 W154 V155 E156	F148-Q152 HydrophobicContact CD1-CG 4.45Å; F148-Q152 HydrophobicContact CE1-CG 4.01Å; F148-Q152 HydrophobicContact CE2-CG 4.16Å; F148-Q152 HydrophobicContact CZ-CG 3.85Å; F148-Q152 WeakPolarHBondContact O-CG 3.33Å; F148-Q152 PolarHBondContact O-N 3.29Å; I149-Q152 PolarHBondContact O-N 3.22Å; Q152-W154 VanDerWaalsContact C-N 3.29Å; Q152-W154 PolarHBondContact O-N 2.81Å; Q152-V155 PolarHBondContact O-N 2.84Å; Q152-E156 WeakPolarHBondContact O-CB 3.44Å; Q152-E156 VanDerWaalsContact O-CG 3.28Å; Q152-E156 WeakPolarHBondContact O-CG 3.47Å; Q152-E156 PolarHBondContact O-N 3.35Å
153	M	94.5	Very high	93.9	Very high	121 Å²	121	56 Å²	56	60%	0.596	27%	0.266	S	S	*	.	H	α-helix	trans	-58.1	-41.7	177.8	-69.1	177	66.8	0	0	112.3	I149 L151 E157	I149-M153 HydrophobicContact CG2-CG 4.39Å; I149-M153 HydrophobicContact CG2-SD 4.03Å; I149-M153 WeakPolarHBondContact O-CG 3.36Å; I149-M153 PolarHBondContact O-N 3.3Å; L151-M153 PolarHBondContact O-N 2.89Å; M153-E157 WeakPolarHBondContact O-CB 3.5Å; M153-E157 PolarHBondContact O-N 3.08Å
154	W	96.1	Very high	94	Very high	24 Å²	24	55.5 Å²	55.5	9%	0.091	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-45.5	179.1	178.8	70.9	0	0	0	112.5	R150 L151 Q152 E157 I158 M193 L198 L202 L205 A232 A236 L239	R150-W154 WeakPolarHBondContact O-CB 3.43Å; R150-W154 PolarHBondContact O-N 3.15Å; L151-W154 HydrophobicContact CD1-CE3 4.27Å; L151-W154 PolarHBondContact O-N 3.3Å; Q152-W154 VanDerWaalsContact C-N 3.29Å; Q152-W154 PolarHBondContact O-N 2.81Å; W154-E157 PolarHBondContact O-N 2.85Å; W154-I158 HydrophobicContact CD2-CD1 3.69Å; W154-I158 VanDerWaalsContact CE2-CD1 3.42Å; W154-I158 HydrophobicContact CE3-CD1 4.07Å; W154-I158 HydrophobicContact CG-CD1 4.21Å; W154-I158 HydrophobicContact CH2-CD1 4.02Å; W154-I158 HydrophobicContact CZ2-CD1 3.65Å; W154-I158 HydrophobicContact CZ3-CD1 4.2Å; W154-I158 WeakPolarHBondContact O-CD1 3.42Å; W154-I158 WeakPolarHBondContact O-CG1 3.25Å; W154-I158 PolarHBondContact O-N 3.44Å; W154-M193 HydrophobicContact CH2-CE 4.17Å; W154-M193 HydrophobicContact CZ2-CE 3.55Å; W154-L198 HydrophobicContact CH2-CD1 3.56Å; W154-L198 HydrophobicContact CZ3-CD1 4Å; W154-L202 HydrophobicContact CD2-CD2 4.36Å; W154-L202 HydrophobicContact CE3-CD2 3.95Å; W154-L202 HydrophobicContact CH2-CD2 4.41Å; W154-L202 HydrophobicContact CZ3-CD2 4.01Å; W154-L205 HydrophobicContact CB-CD1 4.04Å; W154-L205 HydrophobicContact CD2-CD1 3.94Å; W154-L205 HydrophobicContact CG-CD1 3.47Å; W154-L205 VanDerWaalsContact CG-CD1 3.47Å; W154-A232 WeakPolarHBondContact CH2-O 3.42Å; W154-A232 HydrophobicContact CZ2-CB 4.3Å; W154-A236 HydrophobicContact CH2-CB 3.81Å; W154-A236 HydrophobicContact CZ3-CB 3.94Å; W154-L239 HydrophobicContact CZ3-CD1 3.85Å
155	V	94.5	Very high	94.1	Very high	2 Å²	2	55 Å²	55	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-43.4	177.1	173.8	0	0	0	0	111	L151 Q152 E157 I158 M159 L239 A240	L151-V155 HydrophobicContact CD1-CG2 4.36Å; L151-V155 HydrophobicContact CG-CG2 4.46Å; L151-V155 WeakPolarHBondContact O-CG2 3.4Å; L151-V155 PolarHBondContact O-N 3.11Å; Q152-V155 PolarHBondContact O-N 2.84Å; V155-E157 PolarHBondContact O-N 3.03Å; V155-I158 PolarHBondContact O-N 2.91Å; V155-M159 HydrophobicContact CG1-CG 4.3Å; V155-M159 HydrophobicContact CG1-SD 3.56Å; V155-M159 VanDerWaalsContact CG1-SD 3.56Å; V155-M159 WeakPolarHBondContact O-CB 3.34Å; V155-M159 VanDerWaalsContact O-CG 3.3Å; V155-M159 WeakPolarHBondContact O-CG 3.39Å; V155-M159 PolarHBondContact O-N 3.05Å; V155-L239 HydrophobicContact CG2-CB 3.87Å; V155-L239 HydrophobicContact CG2-CD1 4.22Å; V155-A240 HydrophobicContact CG1-CB 4.26Å
156	E	92.6	Very high	94.3	Very high	112 Å²	112	55 Å²	55	52%	0.523	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-43.1	177.5	-75.5	175.4	179.6	0	0	112.2	Q152 I158 M159 E160	Q152-E156 WeakPolarHBondContact O-CB 3.44Å; Q152-E156 VanDerWaalsContact O-CG 3.28Å; Q152-E156 WeakPolarHBondContact O-CG 3.47Å; Q152-E156 PolarHBondContact O-N 3.35Å; E156-I158 VanDerWaalsContact C-N 3.33Å; E156-I158 PolarHBondContact O-N 3.3Å; E156-M159 PolarHBondContact O-N 3.33Å; E156-E160 WeakPolarHBondContact O-CB 3.12Å; E156-E160 PolarHBondContact O-N 3.45Å
157	E	95.1	Very high	94.4	Very high	97 Å²	97	54.5 Å²	54.5	45%	0.453	25%	0.248	S	C	.	.	H	α-helix	trans	-60.5	-43.1	176.8	-172.9	-167.9	151.7	0	0	111.8	M153 W154 V155 K161	M153-E157 WeakPolarHBondContact O-CB 3.5Å; M153-E157 PolarHBondContact O-N 3.08Å; W154-E157 PolarHBondContact O-N 2.85Å; V155-E157 PolarHBondContact O-N 3.03Å; E157-K161 HydrophobicContact CG-CD 4.49Å; E157-K161 WeakPolarHBondContact O-CG 3.23Å; E157-K161 PolarHBondContact O-N 3.44Å; E157-K161 VanDerWaalsContact O-N 3.12Å; E157-K161 IonicContact OE1-NZ 3.2Å; E157-K161 PolarHBondContact OE1-NZ 2.87Å
158	I	95.6	Very high	94.5	Very high	13 Å²	13	54.5 Å²	54.5	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-65.8	-45	177.6	-66.5	159.1	0	0	0	110.1	W154 V155 E156 K161 F162 F190 M193 F233 A236	W154-I158 HydrophobicContact CD2-CD1 3.69Å; W154-I158 VanDerWaalsContact CE2-CD1 3.42Å; W154-I158 HydrophobicContact CE3-CD1 4.07Å; W154-I158 HydrophobicContact CG-CD1 4.21Å; W154-I158 HydrophobicContact CH2-CD1 4.02Å; W154-I158 HydrophobicContact CZ2-CD1 3.65Å; W154-I158 HydrophobicContact CZ3-CD1 4.2Å; W154-I158 WeakPolarHBondContact O-CD1 3.42Å; W154-I158 WeakPolarHBondContact O-CG1 3.25Å; W154-I158 PolarHBondContact O-N 3.44Å; V155-I158 PolarHBondContact O-N 2.91Å; E156-I158 VanDerWaalsContact C-N 3.33Å; E156-I158 PolarHBondContact O-N 3.3Å; I158-K161 PolarHBondContact O-N 3.15Å; I158-F162 WeakPolarHBondContact O-CB 3.34Å; I158-F162 PolarHBondContact O-N 2.87Å; I158-F190 HydrophobicContact CB-CE1 4.33Å; I158-F190 HydrophobicContact CG1-CE1 4.22Å; I158-F190 HydrophobicContact CG2-CE1 3.95Å; I158-F190 HydrophobicContact CG2-CZ 3.9Å; I158-M193 HydrophobicContact CD1-CE 3.29Å; I158-M193 HydrophobicContact CD1-SD 4.23Å; I158-M193 HydrophobicContact CG1-CE 3.94Å; I158-M193 HydrophobicContact CG1-SD 4.36Å; I158-F233 HydrophobicContact CG2-CE2 4.11Å; I158-A236 HydrophobicContact CD1-CB 3.62Å; I158-A236 HydrophobicContact CG2-CB 4.14Å
159	M	92.1	Very high	94.7	Very high	30 Å²	30	52.4 Å²	52.4	15%	0.148	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-47	177.7	-74	170.4	59.6	0	0	111.1	L94 V155 E156 K161 F162 M163 A240 Q243	L94-M159 HydrophobicContact CD1-CE 3.23Å; L94-M159 HydrophobicContact CG-CE 4.21Å; V155-M159 HydrophobicContact CG1-CG 4.3Å; V155-M159 HydrophobicContact CG1-SD 3.56Å; V155-M159 VanDerWaalsContact CG1-SD 3.56Å; V155-M159 WeakPolarHBondContact O-CB 3.34Å; V155-M159 VanDerWaalsContact O-CG 3.3Å; V155-M159 WeakPolarHBondContact O-CG 3.39Å; V155-M159 PolarHBondContact O-N 3.05Å; E156-M159 PolarHBondContact O-N 3.33Å; M159-K161 VanDerWaalsContact C-N 3.31Å; M159-K161 PolarHBondContact O-N 2.82Å; M159-F162 PolarHBondContact O-N 2.72Å; M159-F162 VanDerWaalsContact O-N 3.09Å; M159-M163 VanDerWaalsContact O-CG 3.25Å; M159-M163 WeakPolarHBondContact O-CG 3.43Å; M159-M163 PolarHBondContact O-N 3.48Å; M159-A240 HydrophobicContact CG-CB 4.34Å; M159-A240 HydrophobicContact SD-CB 3.73Å; M159-Q243 PolarHBondContact SD-OE1 2.93Å; M159-Q243 VanDerWaalsContact SD-OE1 3.41Å
160	E	93.6	Very high	94.9	Very high	142 Å²	142	52.3 Å²	52.3	66%	0.664	25%	0.25	S	C	*	.	H	α-helix	trans	-56.6	-44.6	177.7	-171.4	-170.4	156.1	0	0	111.9	E156	E156-E160 WeakPolarHBondContact O-CB 3.12Å; E156-E160 PolarHBondContact O-N 3.45Å
161	K	95.6	Very high	94.9	Very high	52 Å²	52	51 Å²	51	23%	0.226	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-43.1	174.9	-74.2	170.5	176.7	172.2	0	111.8	E157 I158 M159 M163 R164 F190	E157-K161 HydrophobicContact CG-CD 4.49Å; E157-K161 WeakPolarHBondContact O-CG 3.23Å; E157-K161 PolarHBondContact O-N 3.44Å; E157-K161 VanDerWaalsContact O-N 3.12Å; E157-K161 IonicContact OE1-NZ 3.2Å; E157-K161 PolarHBondContact OE1-NZ 2.87Å; I158-K161 PolarHBondContact O-N 3.15Å; M159-K161 VanDerWaalsContact C-N 3.31Å; M159-K161 PolarHBondContact O-N 2.82Å; K161-M163 VanDerWaalsContact C-N 3.33Å; K161-M163 PolarHBondContact O-N 2.82Å; K161-R164 VanDerWaalsContact O-CB 3.3Å; K161-R164 WeakPolarHBondContact O-CB 3.39Å; K161-R164 VanDerWaalsContact O-CD 3.29Å; K161-R164 WeakPolarHBondContact O-CD 3.35Å; K161-R164 WeakPolarHBondContact O-CG 3.21Å; K161-R164 PolarHBondContact O-N 2.86Å; K161-F190 HydrophobicContact CB-CE1 4.16Å; K161-F190 HydrophobicContact CB-CE2 4.25Å; K161-F190 HydrophobicContact CB-CZ 3.55Å; K161-F190 HydrophobicContact CD-CE1 4.08Å; K161-F190 HydrophobicContact CD-CZ 4.32Å
162	F	95.4	Very high	95	Very high	27 Å²	27	51.1 Å²	51.1	12%	0.118	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-38.1	180	-170.1	-93.3	0	0	0	112.1	I158 M159 R164 I165 L185 F233 M465 V468	I158-F162 WeakPolarHBondContact O-CB 3.34Å; I158-F162 PolarHBondContact O-N 2.87Å; M159-F162 PolarHBondContact O-N 2.72Å; M159-F162 VanDerWaalsContact O-N 3.09Å; F162-R164 PolarHBondContact O-N 3.3Å; F162-I165 HydrophobicContact CD1-CG2 4.34Å; F162-I165 HydrophobicContact CE1-CG2 4.08Å; F162-I165 WeakPolarHBondContact O-CB 3.44Å; F162-I165 WeakPolarHBondContact O-CG2 3.29Å; F162-I165 PolarHBondContact O-N 2.66Å; F162-L185 HydrophobicContact CD2-CD1 3.86Å; F162-L185 HydrophobicContact CE2-CD1 4.08Å; F162-F233 HydrophobicContact CD2-CZ 4.01Å; F162-F233 HydrophobicContact CE2-CZ 4.32Å; F162-M465 HydrophobicContact CE1-SD 4.3Å; F162-M465 HydrophobicContact CE2-CE 4.2Å; F162-M465 HydrophobicContact CE2-SD 3.73Å; F162-M465 HydrophobicContact CZ-CE 4.37Å; F162-M465 HydrophobicContact CZ-SD 3.37Å; F162-M465 WeakPolarHBondContact CZ-SD 3.46Å; F162-V468 HydrophobicContact CE1-CG2 4.46Å; F162-V468 HydrophobicContact CZ-CG2 4.39Å
163	M	94.6	Very high	95.3	Very high	54 Å²	54	49.5 Å²	49.5	27%	0.266	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-18.5	178.3	-69.9	-61.5	-64.2	0	0	114	L94 L96 M159 K161 I165 Y166	L94-M163 HydrophobicContact CB-SD 3.98Å; L94-M163 HydrophobicContact CD1-SD 4.43Å; L96-M163 HydrophobicContact CD1-CE 3.54Å; L96-M163 HydrophobicContact CD2-CE 4.29Å; L96-M163 HydrophobicContact CG-CE 3.86Å; M159-M163 VanDerWaalsContact O-CG 3.25Å; M159-M163 WeakPolarHBondContact O-CG 3.43Å; M159-M163 PolarHBondContact O-N 3.48Å; K161-M163 VanDerWaalsContact C-N 3.33Å; K161-M163 PolarHBondContact O-N 2.82Å; M163-I165 PolarHBondContact O-N 3.33Å; M163-Y166 HydrophobicContact CE-CD2 3.79Å; M163-Y166 HydrophobicContact CE-CE2 3.68Å; M163-Y166 WeakPolarHBondContact O-CD2 3.3Å; M163-Y166 PolarHBondContact O-N 3.11Å; M163-Y166 HydrophobicContact SD-CD2 4.1Å; M163-Y166 HydrophobicContact SD-CE2 3.54Å; M163-Y166 VanDerWaalsContact SD-CE2 3.54Å
164	R	95.4	Very high	95.4	Very high	74 Å²	74	43.8 Å²	43.8	28%	0.279	22%	0.216	S	C	.	.	H	α-helix	trans	-58.7	-26.7	174.2	-62.2	169.9	-172.8	178.7	-3.2	112.4	K161 F162 Y166 K167 Y168 L185 M494	K161-R164 VanDerWaalsContact O-CB 3.3Å; K161-R164 WeakPolarHBondContact O-CB 3.39Å; K161-R164 VanDerWaalsContact O-CD 3.29Å; K161-R164 WeakPolarHBondContact O-CD 3.35Å; K161-R164 WeakPolarHBondContact O-CG 3.21Å; K161-R164 PolarHBondContact O-N 2.86Å; F162-R164 PolarHBondContact O-N 3.3Å; R164-Y166 VanDerWaalsContact C-N 3.26Å; R164-Y166 PolarHBondContact O-N 3.37Å; R164-K167 WeakPolarHBondContact O-CB 3.39Å; R164-K167 PolarHBondContact O-N 2.87Å; R164-Y168 HydrophobicContact CB-CE1 4.22Å; R164-Y168 HydrophobicContact CB-CE2 4.18Å; R164-Y168 WeakPolarHBondContact O-CD1 3.4Å; R164-Y168 PolarHBondContact O-N 2.81Å; R164-L185 HydrophobicContact CB-CD2 3.83Å; R164-L185 PolarHBondContact NH1-O 3.35Å; R164-M494 HydrophobicContact CB-SD 4.41Å; R164-M494 HydrophobicContact CG-SD 3.89Å
165	I	96.7	Very high	95.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.1	-39.4	-178.2	-167.5	53.5	0	0	0	112.5	F162 M163 K167 Y168 Q169 F175 L181 L185 V468	F162-I165 HydrophobicContact CD1-CG2 4.34Å; F162-I165 HydrophobicContact CE1-CG2 4.08Å; F162-I165 WeakPolarHBondContact O-CB 3.44Å; F162-I165 WeakPolarHBondContact O-CG2 3.29Å; F162-I165 PolarHBondContact O-N 2.66Å; M163-I165 PolarHBondContact O-N 3.33Å; I165-K167 VanDerWaalsContact C-N 3.31Å; I165-K167 PolarHBondContact O-N 3.32Å; I165-Y168 PolarHBondContact O-N 3.47Å; I165-Q169 HydrophobicContact CD1-CG 4.15Å; I165-Q169 HydrophobicContact CG1-CG 4.3Å; I165-Q169 WeakPolarHBondContact O-CB 3.41Å; I165-Q169 WeakPolarHBondContact O-CG 3.47Å; I165-Q169 PolarHBondContact O-N 2.83Å; I165-F175 HydrophobicContact CD1-CD2 4.36Å; I165-F175 HydrophobicContact CD1-CE2 3.76Å; I165-L181 HydrophobicContact CD1-CD1 4.21Å; I165-L181 HydrophobicContact CD1-CG 4.17Å; I165-L185 HydrophobicContact CB-CD1 4.12Å; I165-L185 HydrophobicContact CB-CD2 3.71Å; I165-L185 HydrophobicContact CD1-CD2 4.27Å; I165-L185 VanDerWaalsContact N-CD2 3.3Å; I165-V468 HydrophobicContact CD1-CG1 4.37Å; I165-V468 HydrophobicContact CG1-CG1 3.64Å; I165-V468 HydrophobicContact CG2-CG2 4.33Å
166	Y	96.9	Very high	95.3	Very high	30 Å²	30	43.9 Å²	43.9	12%	0.118	22%	0.22	C	C	.	.	H	α-helix	trans	-66.5	-37.6	179.7	-55.7	-69.3	0	0	0	111.5	L94 L96 H97 M163 R164 A170 E464	L94-Y166 PolarHBondContact O-OH 3.37Å; L96-Y166 HydrophobicContact CB-CD1 4Å; L96-Y166 HydrophobicContact CB-CD2 4.45Å; L96-Y166 HydrophobicContact CB-CE1 3.62Å; L96-Y166 HydrophobicContact CB-CE2 4.12Å; L96-Y166 HydrophobicContact CB-CG 4.38Å; L96-Y166 HydrophobicContact CD1-CD1 4.33Å; L96-Y166 HydrophobicContact CD1-CD2 3.64Å; L96-Y166 HydrophobicContact CD1-CE2 3.86Å; L96-Y166 HydrophobicContact CD1-CG 3.88Å; L96-Y166 HydrophobicContact CG-CD1 4.49Å; L96-Y166 HydrophobicContact CG-CD2 4.07Å; L96-Y166 HydrophobicContact CG-CE1 4.19Å; L96-Y166 HydrophobicContact CG-CE2 3.74Å; L96-Y166 HydrophobicContact CG-CG 4.42Å; L96-Y166 PolarHBondContact N-OH 3.18Å; L96-Y166 VanDerWaalsContact N-OH 3.13Å; H97-Y166 AromaticContact CD2-CE1 3.62Å; H97-Y166 AromaticContact NE2-CD1 3.82Å; H97-Y166 AromaticContact NE2-CE1 3.8Å; M163-Y166 HydrophobicContact CE-CD2 3.79Å; M163-Y166 HydrophobicContact CE-CE2 3.68Å; M163-Y166 WeakPolarHBondContact O-CD2 3.3Å; M163-Y166 PolarHBondContact O-N 3.11Å; M163-Y166 HydrophobicContact SD-CD2 4.1Å; M163-Y166 HydrophobicContact SD-CE2 3.54Å; M163-Y166 VanDerWaalsContact SD-CE2 3.54Å; R164-Y166 VanDerWaalsContact C-N 3.26Å; R164-Y166 PolarHBondContact O-N 3.37Å; Y166-A170 WeakPolarHBondContact O-CB 3.27Å; Y166-A170 PolarHBondContact O-N 3.21Å; Y166-E464 VanDerWaalsContact CE1-OE1 3.24Å; Y166-E464 WeakPolarHBondContact CE1-OE1 3.3Å; Y166-E464 WeakPolarHBondContact OH-CG 3.44Å; Y166-E464 PolarHBondContact OH-OE1 2.79Å
167	K	95.2	Very high	95.4	Very high	68 Å²	68	39.7 Å²	39.7	30%	0.296	20%	0.203	S	C	.	.	H	α-helix	trans	-65	-45.4	174.6	-169	179.9	-172	-163.6	0	110.2	R164 I165 A170 H171 I497	R164-K167 WeakPolarHBondContact O-CB 3.39Å; R164-K167 PolarHBondContact O-N 2.87Å; I165-K167 VanDerWaalsContact C-N 3.31Å; I165-K167 PolarHBondContact O-N 3.32Å; K167-A170 PolarHBondContact O-N 3.28Å; K167-H171 PolarHBondContact O-N 2.78Å; K167-H171 PolarHBondContact O-ND1 2.88Å; K167-I497 HydrophobicContact CD-CG2 4.24Å; K167-I497 HydrophobicContact CG-CD1 4.43Å
168	Y	96.4	Very high	95.5	Very high	3 Å²	3	35.1 Å²	35.1	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-48.6	179.5	-61	-13.2	0	0	0	111.7	R164 I165 A170 H171 G172 Y173 F175 S184 L185 L493 M494 I497	R164-Y168 HydrophobicContact CB-CE1 4.22Å; R164-Y168 HydrophobicContact CB-CE2 4.18Å; R164-Y168 WeakPolarHBondContact O-CD1 3.4Å; R164-Y168 PolarHBondContact O-N 2.81Å; I165-Y168 PolarHBondContact O-N 3.47Å; Y168-A170 VanDerWaalsContact C-N 3.31Å; Y168-A170 PolarHBondContact O-N 3.41Å; Y168-H171 CarbonylContact O-C 3.24Å; Y168-H171 PolarHBondContact O-N 3.01Å; Y168-H171 VanDerWaalsContact O-N 3.13Å; Y168-G172 PolarHBondContact O-N 3.27Å; Y168-Y173 PolarHBondContact O-N 2.92Å; Y168-F175 HydrophobicContact CD2-CE2 4.35Å; Y168-F175 AromaticContact CD2-CZ 3.81Å; Y168-F175 HydrophobicContact CD2-CZ 3.81Å; Y168-F175 HydrophobicContact CE2-CZ 4.48Å; Y168-S184 WeakPolarHBondContact CE2-O 3.34Å; Y168-S184 PolarHBondContact OH-O 2.85Å; Y168-L185 HydrophobicContact CD2-CD2 3.88Å; Y168-L185 HydrophobicContact CE2-CD2 3.67Å; Y168-L493 HydrophobicContact CD1-CB 4.14Å; Y168-L493 HydrophobicContact CD1-CD1 4.26Å; Y168-L493 HydrophobicContact CD2-CD1 3.89Å; Y168-L493 HydrophobicContact CE1-CB 3.66Å; Y168-L493 HydrophobicContact CE1-CD1 4.4Å; Y168-L493 HydrophobicContact CE2-CB 4.34Å; Y168-L493 HydrophobicContact CE2-CD1 4.01Å; Y168-L493 HydrophobicContact CG-CD1 4.01Å; Y168-M494 HydrophobicContact CE1-CG 4.41Å; Y168-M494 HydrophobicContact CE1-SD 3.98Å; Y168-M494 VanDerWaalsContact OH-CG 3.28Å; Y168-M494 WeakPolarHBondContact OH-CG 3.49Å; Y168-I497 HydrophobicContact CD1-CD1 3.51Å; Y168-I497 HydrophobicContact CE1-CD1 3.82Å
169	Q	96.9	Very high	95.4	Very high	7 Å²	7	37.6 Å²	37.6	3%	0.033	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-32.3	178.8	-70.2	-177.8	-25.4	0	0	112.8	H97 I165 H171 G172 V468 K471 L475	H97-Q169 PolarHBondContact CE1-OE1 3.44Å; H97-Q169 PolarHBondContact NE2-OE1 3.16Å; I165-Q169 HydrophobicContact CD1-CG 4.15Å; I165-Q169 HydrophobicContact CG1-CG 4.3Å; I165-Q169 WeakPolarHBondContact O-CB 3.41Å; I165-Q169 WeakPolarHBondContact O-CG 3.47Å; I165-Q169 PolarHBondContact O-N 2.83Å; Q169-H171 VanDerWaalsContact C-N 3.31Å; Q169-G172 PolarHBondContact O-N 3.03Å; Q169-G172 VanDerWaalsContact O-N 3.16Å; Q169-V468 PolarHBondContact NE2-O 2.68Å; Q169-K471 HydrophobicContact CB-CG 4Å; Q169-K471 HydrophobicContact CG-CG 4.11Å; Q169-L475 HydrophobicContact CB-CD1 4.09Å; Q169-L475 HydrophobicContact CG-CD1 4.17Å
170	A	95.7	Very high	95.6	Very high	84 Å²	84	39.8 Å²	39.8	69%	0.694	20%	0.203	S	C	*	.	H	α-helix	trans	-67.8	-30.3	174.4	0	0	0	0	0	112.9	Y166 K167 Y168 G172	Y166-A170 WeakPolarHBondContact O-CB 3.27Å; Y166-A170 PolarHBondContact O-N 3.21Å; K167-A170 PolarHBondContact O-N 3.28Å; Y168-A170 VanDerWaalsContact C-N 3.31Å; Y168-A170 PolarHBondContact O-N 3.41Å; A170-G172 VanDerWaalsContact C-N 3.25Å
171	H	94.9	Very high	95.7	Very high	74 Å²	74	33.2 Å²	33.2	34%	0.343	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	3.1	173.3	-66	71.5	0	0	0	112.4	K167 Y168 Q169 Y173 M487 I497	K167-H171 PolarHBondContact O-N 2.78Å; K167-H171 PolarHBondContact O-ND1 2.88Å; Y168-H171 CarbonylContact O-C 3.24Å; Y168-H171 PolarHBondContact O-N 3.01Å; Y168-H171 VanDerWaalsContact O-N 3.13Å; Q169-H171 VanDerWaalsContact C-N 3.31Å; H171-Y173 HydrophobicContact CB-CD2 3.86Å; H171-Y173 HydrophobicContact CB-CE2 3.73Å; H171-M487 WeakPolarHBondContact O-CE 3.27Å; H171-I497 WeakPolarHBondContact NE2-CG2 3.31Å
172	G	96	Very high	95.7	Very high	13 Å²	13	30.7 Å²	30.7	13%	0.134	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	13.7	177.8	0	0	0	0	0	114.8	Y168 Q169 A170 H479 M487	Y168-G172 PolarHBondContact O-N 3.27Å; Q169-G172 PolarHBondContact O-N 3.03Å; Q169-G172 VanDerWaalsContact O-N 3.16Å; A170-G172 VanDerWaalsContact C-N 3.25Å; G172-H479 PolarHBondContact O-CE1 2.98Å; G172-H479 PolarHBondContact O-NE2 3.26Å; G172-M487 WeakPolarHBondContact O-CE 3.28Å
173	Y	97.1	Very high	95.7	Very high	13 Å²	13	32.9 Å²	32.9	5%	0.051	17%	0.174	C	C	.	.			trans	-74.8	141.3	175.9	-63.7	-68.5	0	0	0	112.1	Y168 H171 L475 M487 Q490 L493 I497	Y168-Y173 PolarHBondContact O-N 2.92Å; H171-Y173 HydrophobicContact CB-CD2 3.86Å; H171-Y173 HydrophobicContact CB-CE2 3.73Å; Y173-L475 WeakPolarHBondContact O-CD1 3.31Å; Y173-M487 WeakPolarHBondContact CA-O 3.29Å; Y173-M487 HydrophobicContact CD1-CE 3.9Å; Y173-M487 HydrophobicContact CE1-CE 3.94Å; Y173-M487 HydrophobicContact CE1-SD 4.31Å; Y173-M487 HydrophobicContact CG-CE 4.38Å; Y173-Q490 HydrophobicContact CD1-CB 4.34Å; Y173-Q490 HydrophobicContact CD1-CG 4.14Å; Y173-Q490 HydrophobicContact CE1-CB 4.34Å; Y173-Q490 HydrophobicContact CE1-CG 4.07Å; Y173-L493 HydrophobicContact CD1-CD2 3.57Å; Y173-L493 HydrophobicContact CD2-CD1 4.38Å; Y173-L493 HydrophobicContact CD2-CD2 3.66Å; Y173-L493 HydrophobicContact CE1-CD2 3.48Å; Y173-L493 VanDerWaalsContact CE1-CD2 3.48Å; Y173-L493 HydrophobicContact CE2-CD2 3.55Å; Y173-L493 HydrophobicContact CG-CD1 4.15Å; Y173-L493 HydrophobicContact CG-CD2 3.64Å; Y173-L493 VanDerWaalsContact CZ-CD2 3.45Å; Y173-I497 HydrophobicContact CD2-CD1 4.29Å; Y173-I497 HydrophobicContact CE2-CD1 3.91Å; Y173-I497 HydrophobicContact CE2-CG1 3.88Å
174	A	96.9	Very high	95.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-132.1	160.3	178.1	0	0	0	0	0	112.3	N472 L475 L476 M487 V488 D489	A174-N472 WeakPolarHBondContact CA-OD1 3.31Å; A174-L475 HydrophobicContact CB-CB 3.79Å; A174-L476 HydrophobicContact CB-CB 3.99Å; A174-L476 HydrophobicContact CB-CD1 4.42Å; A174-M487 PolarHBondContact N-O 3.16Å; A174-V488 WeakPolarHBondContact O-CA 3.49Å; A174-D489 PolarHBondContact O-N 3.25Å
175	F	95.8	Very high	95.7	Very high	1 Å²	1	27.9 Å²	27.9	0%	0.004	16%	0.156	C	C	.	.			trans	-127.6	132.5	-175.1	-53.6	-77.8	0	0	0	111	I165 Y168 S177 L181 S184 N472 D489 L493	I165-F175 HydrophobicContact CD1-CD2 4.36Å; I165-F175 HydrophobicContact CD1-CE2 3.76Å; Y168-F175 HydrophobicContact CD2-CE2 4.35Å; Y168-F175 AromaticContact CD2-CZ 3.81Å; Y168-F175 HydrophobicContact CD2-CZ 3.81Å; Y168-F175 HydrophobicContact CE2-CZ 4.48Å; F175-S177 VanDerWaalsContact C-N 3.34Å; F175-L181 HydrophobicContact CB-CB 3.83Å; F175-L181 HydrophobicContact CD2-CB 3.94Å; F175-L181 HydrophobicContact CD2-CD1 4.02Å; F175-L181 HydrophobicContact CD2-CG 3.84Å; F175-L181 HydrophobicContact CE2-CG 4.38Å; F175-L181 HydrophobicContact CG-CB 3.83Å; F175-L181 HydrophobicContact CG-CG 4.27Å; F175-S184 WeakPolarHBondContact CE1-OG 3.16Å; F175-S184 WeakPolarHBondContact CZ-OG 3.28Å; F175-N472 WeakPolarHBondContact CD2-OD1 3.42Å; F175-N472 PolarHBondContact N-OD1 3.28Å; F175-N472 PolarHBondContact O-ND2 3.5Å; F175-D489 VanDerWaalsContact CA-OD1 3.27Å; F175-D489 WeakPolarHBondContact CA-OD1 3.48Å; F175-L493 HydrophobicContact CE1-CD1 4Å; F175-L493 HydrophobicContact CZ-CD1 3.84Å
176	S	93.8	Very high	95.6	Very high	28 Å²	28	28.6 Å²	28.6	20%	0.196	16%	0.163	C	C	.	.	S	Bend	trans	-78.9	-16.5	-178.5	64.8	0	0	0	0	113.9	V444 D489	S176-V444 WeakPolarHBondContact O-CB 3.2Å; S176-V444 PolarHBondContact O-N 2.68Å; S176-D489 WeakPolarHBondContact CB-OD2 3.38Å; S176-D489 PolarHBondContact N-OD1 2.97Å; S176-D489 VanDerWaalsContact OG-CG 3.27Å; S176-D489 PolarHBondContact OG-OD1 3.43Å; S176-D489 PolarHBondContact OG-OD2 2.97Å
177	S	94.8	Very high	95.5	Very high	23 Å²	23	28.3 Å²	28.3	16%	0.161	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-142.4	161.7	176.3	76.8	0	0	0	0	111.9	F175 E179 E180 L181	F175-S177 VanDerWaalsContact C-N 3.34Å; S177-E179 VanDerWaalsContact C-N 3.28Å; S177-E179 PolarHBondContact OG-N 3.35Å; S177-E180 WeakPolarHBondContact OG-CG 3.44Å; S177-E180 PolarHBondContact OG-N 2.9Å; S177-L181 PolarHBondContact O-N 3.03Å; S177-L181 VanDerWaalsContact O-N 3.09Å
178	V	95.4	Very high	95.4	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-67.7	-32.7	173.8	-173.8	0	0	0	0	110.9	L181 L182 L441 V444 I456 A459	V178-L181 PolarHBondContact O-N 3.39Å; V178-L182 HydrophobicContact CG1-CD1 4.25Å; V178-L182 HydrophobicContact CG1-CG 4.31Å; V178-L182 WeakPolarHBondContact O-CB 3.37Å; V178-L182 WeakPolarHBondContact O-CG 3.48Å; V178-L182 PolarHBondContact O-N 3.34Å; V178-L441 HydrophobicContact CB-CB 4.16Å; V178-L441 HydrophobicContact CB-CD1 4.02Å; V178-L441 HydrophobicContact CG1-CD1 3.71Å; V178-V444 HydrophobicContact CG2-CG2 3.93Å; V178-I456 HydrophobicContact CG1-CD1 3.64Å; V178-I456 HydrophobicContact CG2-CD1 4.24Å; V178-A459 HydrophobicContact CG1-CB 3.78Å
179	E	94.8	Very high	95.3	Very high	65 Å²	65	31.1 Å²	31.1	30%	0.304	20%	0.204	S	C	.	.	H	α-helix	trans	-63.6	-49	175.2	-68.8	-168.5	137.3	0	0	111	S177 L181 L182 D183 I191 R195 L441	S177-E179 VanDerWaalsContact C-N 3.28Å; S177-E179 PolarHBondContact OG-N 3.35Å; E179-L181 VanDerWaalsContact C-N 3.29Å; E179-L181 PolarHBondContact O-N 2.95Å; E179-L182 PolarHBondContact O-N 3.45Å; E179-D183 WeakPolarHBondContact O-CB 3.27Å; E179-D183 PolarHBondContact O-N 3.14Å; E179-I191 HydrophobicContact CB-CD1 4.19Å; E179-I191 WeakPolarHBondContact O-CD1 3.16Å; E179-R195 IonicContact OE1-CZ 2.67Å; E179-R195 IonicContact OE1-NH2 3.47Å; E179-R195 PolarHBondContact OE1-NH2 3.43Å; E179-L441 HydrophobicContact CG-CB 4.17Å; E179-L441 HydrophobicContact CG-CD1 3.89Å; E179-L441 HydrophobicContact CG-CG 4.27Å
180	E	95	Very high	95.3	Very high	75 Å²	75	31 Å²	31	35%	0.35	20%	0.203	S	C	.	.	H	α-helix	trans	-60.3	-39.9	176.4	-70.5	-63.6	158.4	0	0	111.7	S177 S184	S177-E180 WeakPolarHBondContact OG-CG 3.44Å; S177-E180 PolarHBondContact OG-N 2.9Å; E180-S184 WeakPolarHBondContact O-CB 3.32Å; E180-S184 PolarHBondContact O-N 3.16Å
181	L	96.1	Very high	95.3	Very high	4 Å²	4	28 Å²	28	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-52.1	173.9	-175.3	155.4	0	0	0	110.9	I165 F175 S177 V178 E179 S184 L185 V468	I165-L181 HydrophobicContact CD1-CD1 4.21Å; I165-L181 HydrophobicContact CD1-CG 4.17Å; F175-L181 HydrophobicContact CB-CB 3.83Å; F175-L181 HydrophobicContact CD2-CB 3.94Å; F175-L181 HydrophobicContact CD2-CD1 4.02Å; F175-L181 HydrophobicContact CD2-CG 3.84Å; F175-L181 HydrophobicContact CE2-CG 4.38Å; F175-L181 HydrophobicContact CG-CB 3.83Å; F175-L181 HydrophobicContact CG-CG 4.27Å; S177-L181 PolarHBondContact O-N 3.03Å; S177-L181 VanDerWaalsContact O-N 3.09Å; V178-L181 PolarHBondContact O-N 3.39Å; E179-L181 VanDerWaalsContact C-N 3.29Å; E179-L181 PolarHBondContact O-N 2.95Å; L181-S184 PolarHBondContact O-N 3.44Å; L181-S184 PolarHBondContact O-OG 3.4Å; L181-L185 HydrophobicContact CD2-CD1 3.58Å; L181-L185 HydrophobicContact CD2-CG 4.46Å; L181-L185 VanDerWaalsContact O-CG 3.32Å; L181-L185 WeakPolarHBondContact O-CG 3.31Å; L181-L185 PolarHBondContact O-N 2.94Å; L181-V468 HydrophobicContact CD1-CG1 4.3Å
182	L	96.1	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.7	-39	-177.6	-70.5	-179.5	0	0	0	112.6	V178 E179 S184 L185 G186 F190 I191 T194 F233 L441 A459	V178-L182 HydrophobicContact CG1-CD1 4.25Å; V178-L182 HydrophobicContact CG1-CG 4.31Å; V178-L182 WeakPolarHBondContact O-CB 3.37Å; V178-L182 WeakPolarHBondContact O-CG 3.48Å; V178-L182 PolarHBondContact O-N 3.34Å; E179-L182 PolarHBondContact O-N 3.45Å; L182-S184 VanDerWaalsContact C-N 3.35Å; L182-L185 PolarHBondContact O-N 3.34Å; L182-G186 PolarHBondContact O-N 3.32Å; L182-F190 HydrophobicContact CB-CB 4.15Å; L182-F190 HydrophobicContact CD2-CD2 4.22Å; L182-F190 WeakPolarHBondContact O-CD2 3.45Å; L182-I191 HydrophobicContact CB-CD1 3.85Å; L182-T194 HydrophobicContact CD1-CG2 3.68Å; L182-F233 HydrophobicContact CD2-CD1 4.42Å; L182-F233 HydrophobicContact CD2-CE1 3.69Å; L182-F233 HydrophobicContact CD2-CE2 4.11Å; L182-F233 HydrophobicContact CD2-CZ 3.51Å; L182-L441 HydrophobicContact CD1-CD1 3.75Å; L182-A459 HydrophobicContact CD1-CB 3.92Å
183	D	95.4	Very high	95.3	Very high	72 Å²	72	28.9 Å²	28.9	39%	0.385	18%	0.179	S	C	.	.	H	α-helix	trans	-63.1	-41.7	175.9	-168.9	69.1	0	0	0	111	E179 L185 G187 S188 I191	E179-D183 WeakPolarHBondContact O-CB 3.27Å; E179-D183 PolarHBondContact O-N 3.14Å; D183-L185 PolarHBondContact O-N 2.84Å; D183-L185 VanDerWaalsContact O-N 3.17Å; D183-G187 WeakPolarHBondContact O-CA 3.46Å; D183-G187 PolarHBondContact O-N 2.95Å; D183-G187 WeakPolarHBondContact OD1-CA 3.18Å; D183-S188 PolarHBondContact OD1-N 3.2Å; D183-I191 HydrophobicContact CB-CD1 4.22Å; D183-I191 HydrophobicContact CB-CG1 4.12Å
184	S	94.8	Very high	95.2	Very high	23 Å²	23	28.7 Å²	28.7	16%	0.161	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-26.4	176.8	81.1	0	0	0	0	114.1	Y168 F175 E180 L181 L182	Y168-S184 WeakPolarHBondContact CE2-O 3.34Å; Y168-S184 PolarHBondContact OH-O 2.85Å; F175-S184 WeakPolarHBondContact CE1-OG 3.16Å; F175-S184 WeakPolarHBondContact CZ-OG 3.28Å; E180-S184 WeakPolarHBondContact O-CB 3.32Å; E180-S184 PolarHBondContact O-N 3.16Å; L181-S184 PolarHBondContact O-N 3.44Å; L181-S184 PolarHBondContact O-OG 3.4Å; L182-S184 VanDerWaalsContact C-N 3.35Å
185	L	95.1	Very high	95.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-88.3	-49.6	-177.7	-64	175.7	0	0	0	111.9	F162 R164 I165 Y168 L181 L182 D183 F190	F162-L185 HydrophobicContact CD2-CD1 3.86Å; F162-L185 HydrophobicContact CE2-CD1 4.08Å; R164-L185 HydrophobicContact CB-CD2 3.83Å; R164-L185 PolarHBondContact NH1-O 3.35Å; I165-L185 HydrophobicContact CB-CD1 4.12Å; I165-L185 HydrophobicContact CB-CD2 3.71Å; I165-L185 HydrophobicContact CD1-CD2 4.27Å; I165-L185 VanDerWaalsContact N-CD2 3.3Å; Y168-L185 HydrophobicContact CD2-CD2 3.88Å; Y168-L185 HydrophobicContact CE2-CD2 3.67Å; L181-L185 HydrophobicContact CD2-CD1 3.58Å; L181-L185 HydrophobicContact CD2-CG 4.46Å; L181-L185 VanDerWaalsContact O-CG 3.32Å; L181-L185 WeakPolarHBondContact O-CG 3.31Å; L181-L185 PolarHBondContact O-N 2.94Å; L182-L185 PolarHBondContact O-N 3.34Å; D183-L185 PolarHBondContact O-N 2.84Å; D183-L185 VanDerWaalsContact O-N 3.17Å; L185-F190 HydrophobicContact CB-CD2 4.01Å; L185-F190 HydrophobicContact CB-CE2 3.8Å
186	G	94.3	Very high	95.1	Very high	14 Å²	14	38.2 Å²	38.2	14%	0.144	22%	0.215	C	C	.	.	H	α-helix	trans	-128.7	4.9	-170.5	0	0	0	0	0	115.2	L182	L182-G186 PolarHBondContact O-N 3.32Å
187	G	94.1	Very high	95.2	Very high	25 Å²	25	38.3 Å²	38.3	26%	0.258	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	-156.6	-175.9	0	0	0	0	0	113	D183 G189 F190 I191	D183-G187 WeakPolarHBondContact O-CA 3.46Å; D183-G187 PolarHBondContact O-N 2.95Å; D183-G187 WeakPolarHBondContact OD1-CA 3.18Å; G187-G189 PolarHBondContact O-N 3.17Å; G187-F190 PolarHBondContact O-N 3.48Å; G187-I191 PolarHBondContact O-N 3.01Å
188	S	93.8	Very high	95.3	Very high	94 Å²	94	37.2 Å²	37.2	66%	0.657	21%	0.207	S	C	*	.	H	α-helix	trans	-55.1	-21.4	175.1	63.3	0	0	0	0	113.8	D183 I191 N192	D183-S188 PolarHBondContact OD1-N 3.2Å; S188-I191 PolarHBondContact O-N 3.48Å; S188-N192 VanDerWaalsContact O-CB 3.25Å; S188-N192 WeakPolarHBondContact O-CB 3.38Å; S188-N192 PolarHBondContact O-N 2.97Å
189	G	95.3	Very high	95.4	Very high	35 Å²	35	38.2 Å²	38.2	36%	0.361	21%	0.214	S	C	.	.	H	α-helix	trans	-59.9	-49.6	173.7	0	0	0	0	0	112.5	G187 N192 M193	G187-G189 PolarHBondContact O-N 3.17Å; G189-N192 PolarHBondContact O-N 2.98Å; G189-M193 VanDerWaalsContact O-CG 3.25Å; G189-M193 WeakPolarHBondContact O-CG 3.38Å; G189-M193 PolarHBondContact O-N 3.21Å; G189-M193 VanDerWaalsContact O-N 3.1Å
190	F	96.4	Very high	95.5	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-67.6	-38.9	177.9	-80.3	9.5	0	0	0	111.7	I158 K161 L182 L185 G187 N192 M193 T194 F233	I158-F190 HydrophobicContact CB-CE1 4.33Å; I158-F190 HydrophobicContact CG1-CE1 4.22Å; I158-F190 HydrophobicContact CG2-CE1 3.95Å; I158-F190 HydrophobicContact CG2-CZ 3.9Å; K161-F190 HydrophobicContact CB-CE1 4.16Å; K161-F190 HydrophobicContact CB-CE2 4.25Å; K161-F190 HydrophobicContact CB-CZ 3.55Å; K161-F190 HydrophobicContact CD-CE1 4.08Å; K161-F190 HydrophobicContact CD-CZ 4.32Å; L182-F190 HydrophobicContact CB-CB 4.15Å; L182-F190 HydrophobicContact CD2-CD2 4.22Å; L182-F190 WeakPolarHBondContact O-CD2 3.45Å; L185-F190 HydrophobicContact CB-CD2 4.01Å; L185-F190 HydrophobicContact CB-CE2 3.8Å; G187-F190 PolarHBondContact O-N 3.48Å; F190-N192 PolarHBondContact O-N 2.88Å; F190-M193 HydrophobicContact CD1-SD 4.1Å; F190-M193 WeakPolarHBondContact O-CB 3.4Å; F190-M193 PolarHBondContact O-N 2.9Å; F190-T194 PolarHBondContact O-N 3.14Å; F190-F233 HydrophobicContact CB-CD2 4.36Å; F190-F233 HydrophobicContact CB-CE2 4.33Å; F190-F233 HydrophobicContact CD1-CD2 4.18Å; F190-F233 AromaticContact CD1-CE2 3.96Å; F190-F233 HydrophobicContact CD1-CE2 3.96Å; F190-F233 HydrophobicContact CD2-CD2 4.33Å; F190-F233 AromaticContact CD2-CE2 3.52Å; F190-F233 HydrophobicContact CD2-CE2 3.52Å; F190-F233 HydrophobicContact CD2-CZ 4.17Å; F190-F233 HydrophobicContact CE1-CE2 4.06Å; F190-F233 AromaticContact CE2-CE2 3.63Å; F190-F233 HydrophobicContact CE2-CE2 3.63Å; F190-F233 HydrophobicContact CE2-CZ 4.2Å; F190-F233 HydrophobicContact CG-CD2 4.05Å; F190-F233 AromaticContact CG-CE2 3.68Å; F190-F233 HydrophobicContact CG-CE2 3.68Å; F190-F233 AromaticContact CZ-CE2 3.9Å; F190-F233 HydrophobicContact CZ-CE2 3.9Å
191	I	95.3	Very high	95.6	Very high	22 Å²	22	35.4 Å²	35.4	11%	0.113	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-41.7	175.9	-54.7	-56.2	0	0	0	111.6	E179 L182 D183 G187 S188 M193 T194	E179-I191 HydrophobicContact CB-CD1 4.19Å; E179-I191 WeakPolarHBondContact O-CD1 3.16Å; L182-I191 HydrophobicContact CB-CD1 3.85Å; D183-I191 HydrophobicContact CB-CD1 4.22Å; D183-I191 HydrophobicContact CB-CG1 4.12Å; G187-I191 PolarHBondContact O-N 3.01Å; S188-I191 PolarHBondContact O-N 3.48Å; I191-M193 VanDerWaalsContact C-N 3.26Å; I191-M193 PolarHBondContact O-N 2.81Å; I191-T194 PolarHBondContact O-N 2.77Å; I191-T194 PolarHBondContact O-OG1 2.93Å
192	N	95.4	Very high	95.6	Very high	83 Å²	83	35.2 Å²	35.2	44%	0.444	20%	0.204	S	C	.	.	H	α-helix	trans	-64.1	-36.3	176.7	-169.3	32.1	0	0	0	111.3	S188 G189 F190 T194 R195 R196	S188-N192 VanDerWaalsContact O-CB 3.25Å; S188-N192 WeakPolarHBondContact O-CB 3.38Å; S188-N192 PolarHBondContact O-N 2.97Å; G189-N192 PolarHBondContact O-N 2.98Å; F190-N192 PolarHBondContact O-N 2.88Å; N192-T194 VanDerWaalsContact C-N 3.28Å; N192-T194 PolarHBondContact O-N 2.93Å; N192-R195 PolarHBondContact O-N 2.8Å; N192-R195 VanDerWaalsContact O-N 3.07Å; N192-R196 WeakPolarHBondContact O-CG 3.38Å; N192-R196 PolarHBondContact O-N 3.17Å; N192-R196 WeakPolarHBondContact OD1-CD 3.19Å
193	M	96.1	Very high	95.7	Very high	23 Å²	23	38.8 Å²	38.8	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-67	-23.5	177.3	-72.6	171.1	68.2	0	0	114.1	W154 I158 G189 F190 I191 R195 A232 F233 A236	W154-M193 HydrophobicContact CH2-CE 4.17Å; W154-M193 HydrophobicContact CZ2-CE 3.55Å; I158-M193 HydrophobicContact CD1-CE 3.29Å; I158-M193 HydrophobicContact CD1-SD 4.23Å; I158-M193 HydrophobicContact CG1-CE 3.94Å; I158-M193 HydrophobicContact CG1-SD 4.36Å; G189-M193 VanDerWaalsContact O-CG 3.25Å; G189-M193 WeakPolarHBondContact O-CG 3.38Å; G189-M193 PolarHBondContact O-N 3.21Å; G189-M193 VanDerWaalsContact O-N 3.1Å; F190-M193 HydrophobicContact CD1-SD 4.1Å; F190-M193 WeakPolarHBondContact O-CB 3.4Å; F190-M193 PolarHBondContact O-N 2.9Å; I191-M193 VanDerWaalsContact C-N 3.26Å; I191-M193 PolarHBondContact O-N 2.81Å; M193-R195 VanDerWaalsContact C-N 3.26Å; M193-A232 HydrophobicContact CB-CB 4.08Å; M193-A232 HydrophobicContact CE-CB 4.41Å; M193-A232 HydrophobicContact CG-CB 4.23Å; M193-A232 PolarHBondContact O-N 3.43Å; M193-F233 HydrophobicContact CB-CB 3.86Å; M193-F233 HydrophobicContact CE-CB 4.28Å; M193-F233 HydrophobicContact CE-CD2 4.05Å; M193-F233 PolarHBondContact O-N 3.28Å; M193-F233 VanDerWaalsContact O-N 3.13Å; M193-F233 HydrophobicContact SD-CD2 4.44Å; M193-A236 HydrophobicContact CE-CB 4.27Å
194	T	95.6	Very high	95.7	Very high	9 Å²	9	41.5 Å²	41.5	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-78.1	-14.6	172.9	65.1	0	0	0	0	112.6	L182 F190 I191 N192 P231 F233 L441	L182-T194 HydrophobicContact CD1-CG2 3.68Å; F190-T194 PolarHBondContact O-N 3.14Å; I191-T194 PolarHBondContact O-N 2.77Å; I191-T194 PolarHBondContact O-OG1 2.93Å; N192-T194 VanDerWaalsContact C-N 3.28Å; N192-T194 PolarHBondContact O-N 2.93Å; T194-P231 WeakPolarHBondContact O-CB 3.46Å; T194-F233 HydrophobicContact CG2-CB 4.03Å; T194-F233 HydrophobicContact CG2-CG 4.46Å; T194-L441 HydrophobicContact CG2-CD1 4.24Å
195	R	94.6	Very high	95.7	Very high	135 Å²	135	43.9 Å²	43.9	51%	0.509	24%	0.244	S	C	.	.	S	Bend	trans	-110.7	4.1	-175.1	-60.1	177.4	-176.5	-177.6	1	113.7	E179 N192 M193 S437	E179-R195 IonicContact OE1-CZ 2.67Å; E179-R195 IonicContact OE1-NH2 3.47Å; E179-R195 PolarHBondContact OE1-NH2 3.43Å; N192-R195 PolarHBondContact O-N 2.8Å; N192-R195 VanDerWaalsContact O-N 3.07Å; M193-R195 VanDerWaalsContact C-N 3.26Å; R195-S437 WeakPolarHBondContact CA-O 3.48Å; R195-S437 WeakPolarHBondContact O-CB 3.22Å
196	R	94.9	Very high	95.8	Very high	65 Å²	65	45.2 Å²	45.2	25%	0.245	26%	0.258	C	S	.	.	S	Bend	trans	-129.2	139.5	-178.4	-66.7	-169	72.6	-169.2	4.2	111.5	N192 E204 P231 A232	N192-R196 WeakPolarHBondContact O-CG 3.38Å; N192-R196 PolarHBondContact O-N 3.17Å; N192-R196 WeakPolarHBondContact OD1-CD 3.19Å; R196-E204 IonicContact CZ-OE1 3.09Å; R196-E204 IonicContact CZ-OE2 3.24Å; R196-E204 IonicContact NH1-OE1 3.81Å; R196-E204 PolarHBondContact NH1-OE1 2.98Å; R196-E204 IonicContact NH1-OE2 3.9Å; R196-E204 PolarHBondContact NH1-OE2 2.78Å; R196-E204 VanDerWaalsContact NH2-CD 3.27Å; R196-E204 IonicContact NH2-OE1 2.68Å; R196-E204 PolarHBondContact NH2-OE1 3.33Å; R196-E204 IonicContact NH2-OE2 3.48Å; R196-E204 PolarHBondContact NH2-OE2 2.8Å; R196-P231 CarbonylContact O-C 3.16Å; R196-P231 VanDerWaalsContact O-CA 3.31Å; R196-P231 WeakPolarHBondContact O-CA 3.47Å; R196-A232 PolarHBondContact O-N 3.47Å
197	P	96.7	Very high	95.9	Very high	30 Å²	30	44.7 Å²	44.7	20%	0.195	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-56.5	147.1	173.2	-23.5	34	0	0	0	112.5	S199 D200 S201 I230	P197-S199 VanDerWaalsContact C-N 3.33Å; P197-D200 HydrophobicContact CB-CB 4.48Å; P197-D200 PolarHBondContact O-N 3.19Å; P197-S201 PolarHBondContact O-N 2.77Å; P197-S201 PolarHBondContact O-OG 3.14Å; P197-I230 CarbonylContact C-O 3.55Å; P197-I230 WeakPolarHBondContact CA-O 3.27Å
198	L	97.4	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-43.9	174.1	175.3	66.1	0	0	0	110.8	W154 D200 S201 L202 I216 M220 V228 I230 A232	W154-L198 HydrophobicContact CH2-CD1 3.56Å; W154-L198 HydrophobicContact CZ3-CD1 4Å; L198-D200 VanDerWaalsContact C-N 3.33Å; L198-D200 PolarHBondContact O-N 2.86Å; L198-S201 PolarHBondContact O-N 3.04Å; L198-L202 HydrophobicContact CD1-CD1 3.69Å; L198-L202 HydrophobicContact CD1-CD2 4.34Å; L198-L202 HydrophobicContact CD1-CG 3.84Å; L198-L202 HydrophobicContact CD2-CD1 4.3Å; L198-L202 HydrophobicContact CG-CD1 3.66Å; L198-L202 HydrophobicContact CG-CG 4.21Å; L198-L202 WeakPolarHBondContact O-CB 3.3Å; L198-L202 VanDerWaalsContact O-CG 3.24Å; L198-L202 WeakPolarHBondContact O-CG 3.48Å; L198-L202 PolarHBondContact O-N 3.13Å; L198-I216 HydrophobicContact CD2-CG2 3.83Å; L198-M220 HydrophobicContact CD2-CE 4.31Å; L198-M220 HydrophobicContact CD2-CG 4.05Å; L198-M220 HydrophobicContact CD2-SD 3.88Å; L198-V228 WeakPolarHBondContact CB-O 3.07Å; L198-V228 HydrophobicContact CD2-CG1 4.46Å; L198-V228 PolarHBondContact N-O 2.99Å; L198-I230 HydrophobicContact CB-CG1 4.38Å; L198-I230 WeakPolarHBondContact CB-O 3.49Å; L198-I230 PolarHBondContact N-O 3.14Å; L198-A232 HydrophobicContact CD1-CB 4.49Å
199	S	96.8	Very high	96.1	Very high	23 Å²	23	45.1 Å²	45.1	16%	0.161	24%	0.241	C	C	.	.	H	α-helix	trans	-51.4	-51	177.6	53.9	0	0	0	0	112.4	P197 S201 L202 L203 V228	P197-S199 VanDerWaalsContact C-N 3.33Å; S199-S201 PolarHBondContact O-N 2.95Å; S199-L202 PolarHBondContact O-N 3.03Å; S199-L203 WeakPolarHBondContact O-CB 3.38Å; S199-L203 VanDerWaalsContact O-CG 3.28Å; S199-L203 WeakPolarHBondContact O-CG 3.24Å; S199-L203 PolarHBondContact O-N 3.08Å; S199-V228 PolarHBondContact N-O 2.97Å; S199-V228 VanDerWaalsContact N-O 3.1Å
200	D	96.9	Very high	96.2	Very high	68 Å²	68	48.9 Å²	48.9	36%	0.364	24%	0.244	S	C	.	.	H	α-helix	trans	-66.7	-43.2	-174.7	-61	0	0	0	0	110.6	P197 L198 L202 L203 E204	P197-D200 HydrophobicContact CB-CB 4.48Å; P197-D200 PolarHBondContact O-N 3.19Å; L198-D200 VanDerWaalsContact C-N 3.33Å; L198-D200 PolarHBondContact O-N 2.86Å; D200-L202 VanDerWaalsContact C-N 3.31Å; D200-L202 PolarHBondContact O-N 3.03Å; D200-L203 PolarHBondContact O-N 3.48Å; D200-E204 WeakPolarHBondContact O-CG 3.32Å; D200-E204 PolarHBondContact O-N 3.26Å
201	S	96.4	Very high	96.2	Very high	14 Å²	14	48.7 Å²	48.7	10%	0.098	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-40.3	178.3	-54.6	0	0	0	0	111.6	P197 L198 S199 L205 A232	P197-S201 PolarHBondContact O-N 2.77Å; P197-S201 PolarHBondContact O-OG 3.14Å; L198-S201 PolarHBondContact O-N 3.04Å; S199-S201 PolarHBondContact O-N 2.95Å; S201-L205 WeakPolarHBondContact O-CD1 3.19Å; S201-L205 VanDerWaalsContact O-CG 3.27Å; S201-L205 WeakPolarHBondContact O-CG 3.45Å; S201-L205 PolarHBondContact O-N 3.22Å; S201-A232 VanDerWaalsContact OG-CB 3.29Å; S201-A232 WeakPolarHBondContact OG-CB 3.43Å
202	L	97.3	Very high	96.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-73.5	-39.3	179	-68.2	175	0	0	0	112.5	L151 W154 L198 S199 D200 E204 L205 G206 V207 I212 I216	L151-L202 HydrophobicContact CD1-CD2 3.84Å; W154-L202 HydrophobicContact CD2-CD2 4.36Å; W154-L202 HydrophobicContact CE3-CD2 3.95Å; W154-L202 HydrophobicContact CH2-CD2 4.41Å; W154-L202 HydrophobicContact CZ3-CD2 4.01Å; L198-L202 HydrophobicContact CD1-CD1 3.69Å; L198-L202 HydrophobicContact CD1-CD2 4.34Å; L198-L202 HydrophobicContact CD1-CG 3.84Å; L198-L202 HydrophobicContact CD2-CD1 4.3Å; L198-L202 HydrophobicContact CG-CD1 3.66Å; L198-L202 HydrophobicContact CG-CG 4.21Å; L198-L202 WeakPolarHBondContact O-CB 3.3Å; L198-L202 VanDerWaalsContact O-CG 3.24Å; L198-L202 WeakPolarHBondContact O-CG 3.48Å; L198-L202 PolarHBondContact O-N 3.13Å; S199-L202 PolarHBondContact O-N 3.03Å; D200-L202 VanDerWaalsContact C-N 3.31Å; D200-L202 PolarHBondContact O-N 3.03Å; L202-E204 VanDerWaalsContact C-N 3.32Å; L202-E204 PolarHBondContact O-N 3.24Å; L202-L205 HydrophobicContact CD2-CD1 4.41Å; L202-L205 WeakPolarHBondContact O-CB 3.24Å; L202-L205 PolarHBondContact O-N 3.48Å; L202-G206 PolarHBondContact O-N 3.5Å; L202-V207 HydrophobicContact CB-CB 4.01Å; L202-V207 HydrophobicContact CB-CG1 4.45Å; L202-V207 HydrophobicContact CB-CG2 4.23Å; L202-V207 HydrophobicContact CD2-CG2 4.2Å; L202-V207 VanDerWaalsContact O-CB 3.24Å; L202-V207 WeakPolarHBondContact O-CB 3.23Å; L202-V207 WeakPolarHBondContact O-CG2 3.41Å; L202-V207 PolarHBondContact O-N 2.83Å; L202-I212 HydrophobicContact CB-CD1 3.88Å; L202-I212 HydrophobicContact CB-CG1 4.3Å; L202-I212 HydrophobicContact CD1-CG1 4.24Å; L202-I216 HydrophobicContact CD1-CD1 3.41Å; L202-I216 VanDerWaalsContact CD1-CD1 3.41Å; L202-I216 HydrophobicContact CD1-CG2 4.11Å
203	L	97.4	Very high	96.2	Very high	74 Å²	74	47 Å²	47	39%	0.387	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-41.2	174.9	-73.3	170.1	0	0	0	111.3	S199 D200 L205 G206 Q209 I212	S199-L203 WeakPolarHBondContact O-CB 3.38Å; S199-L203 VanDerWaalsContact O-CG 3.28Å; S199-L203 WeakPolarHBondContact O-CG 3.24Å; S199-L203 PolarHBondContact O-N 3.08Å; D200-L203 PolarHBondContact O-N 3.48Å; L203-L205 VanDerWaalsContact C-N 3.29Å; L203-L205 PolarHBondContact O-N 3.33Å; L203-G206 WeakPolarHBondContact O-CA 3.47Å; L203-G206 PolarHBondContact O-N 3.11Å; L203-Q209 HydrophobicContact CD2-CB 4.39Å; L203-I212 HydrophobicContact CD2-CD1 3.87Å; L203-I212 HydrophobicContact CG-CD1 3.78Å
204	E	96.1	Very high	96.2	Very high	129 Å²	129	47.3 Å²	47.3	60%	0.603	24%	0.236	S	C	*	.	H	α-helix	trans	-63.5	-33	175	-76.8	-179.8	178.1	0	0	113.1	R196 D200 L202 G206	R196-E204 IonicContact CZ-OE1 3.09Å; R196-E204 IonicContact CZ-OE2 3.24Å; R196-E204 IonicContact NH1-OE1 3.81Å; R196-E204 PolarHBondContact NH1-OE1 2.98Å; R196-E204 IonicContact NH1-OE2 3.9Å; R196-E204 PolarHBondContact NH1-OE2 2.78Å; R196-E204 VanDerWaalsContact NH2-CD 3.27Å; R196-E204 IonicContact NH2-OE1 2.68Å; R196-E204 PolarHBondContact NH2-OE1 3.33Å; R196-E204 IonicContact NH2-OE2 3.48Å; R196-E204 PolarHBondContact NH2-OE2 2.8Å; D200-E204 WeakPolarHBondContact O-CG 3.32Å; D200-E204 PolarHBondContact O-N 3.26Å; L202-E204 VanDerWaalsContact C-N 3.32Å; L202-E204 PolarHBondContact O-N 3.24Å; E204-G206 PolarHBondContact O-N 3.49Å
205	L	94.8	Very high	96.1	Very high	74 Å²	74	48.4 Å²	48.4	39%	0.387	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-4.4	172	-66.8	164.6	0	0	0	112.9	R150 W154 S201 L202 L203 V207	R150-L205 VanDerWaalsContact CD-O 3.28Å; R150-L205 WeakPolarHBondContact CD-O 3.44Å; R150-L205 PolarHBondContact NE-O 3.4Å; W154-L205 HydrophobicContact CB-CD1 4.04Å; W154-L205 HydrophobicContact CD2-CD1 3.94Å; W154-L205 HydrophobicContact CG-CD1 3.47Å; W154-L205 VanDerWaalsContact CG-CD1 3.47Å; S201-L205 WeakPolarHBondContact O-CD1 3.19Å; S201-L205 VanDerWaalsContact O-CG 3.27Å; S201-L205 WeakPolarHBondContact O-CG 3.45Å; S201-L205 PolarHBondContact O-N 3.22Å; L202-L205 HydrophobicContact CD2-CD1 4.41Å; L202-L205 WeakPolarHBondContact O-CB 3.24Å; L202-L205 PolarHBondContact O-N 3.48Å; L203-L205 VanDerWaalsContact C-N 3.29Å; L203-L205 PolarHBondContact O-N 3.33Å; L205-V207 HydrophobicContact CB-CG2 4.45Å
206	G	95.6	Very high	96.2	Very high	29 Å²	29	42 Å²	42	30%	0.299	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	19.9	-177.6	0	0	0	0	0	113.6	R150 L202 L203 E204	R150-G206 PolarHBondContact NH1-O 3.13Å; L202-G206 PolarHBondContact O-N 3.5Å; L203-G206 WeakPolarHBondContact O-CA 3.47Å; L203-G206 PolarHBondContact O-N 3.11Å; E204-G206 PolarHBondContact O-N 3.49Å
207	V	97	Very high	96.3	Very high	2 Å²	2	39 Å²	39	1%	0.012	21%	0.207	C	C	.	.			trans	-71.1	127.7	168.5	-179.3	0	0	0	0	108	R150 L202 L205 F211 I212 I216	R150-V207 HydrophobicContact CB-CG2 4.16Å; L202-V207 HydrophobicContact CB-CB 4.01Å; L202-V207 HydrophobicContact CB-CG1 4.45Å; L202-V207 HydrophobicContact CB-CG2 4.23Å; L202-V207 HydrophobicContact CD2-CG2 4.2Å; L202-V207 VanDerWaalsContact O-CB 3.24Å; L202-V207 WeakPolarHBondContact O-CB 3.23Å; L202-V207 WeakPolarHBondContact O-CG2 3.41Å; L202-V207 PolarHBondContact O-N 2.83Å; L205-V207 HydrophobicContact CB-CG2 4.45Å; V207-F211 HydrophobicContact CG1-CB 4.26Å; V207-F211 HydrophobicContact CG1-CD1 3.52Å; V207-F211 HydrophobicContact CG1-CE1 4.34Å; V207-F211 HydrophobicContact CG1-CG 4.33Å; V207-I212 HydrophobicContact CG1-CD1 4.48Å; V207-I212 HydrophobicContact CG1-CG1 3.9Å; V207-I216 HydrophobicContact CG1-CD1 4.22Å
208	S	96.9	Very high	96.3	Very high	41 Å²	41	37.6 Å²	37.6	29%	0.287	20%	0.198	S	C	.	.			trans	-67.5	144.8	-177.4	66.8	0	0	0	0	112.4	S147 R210 F211 I212	S147-S208 PolarHBondContact OG-N 3.34Å; S147-S208 PolarHBondContact OG-OG 3.46Å; S208-R210 PolarHBondContact O-N 3.46Å; S208-F211 WeakPolarHBondContact O-CB 3.46Å; S208-F211 PolarHBondContact O-N 2.97Å; S208-F211 WeakPolarHBondContact OG-CB 3.35Å; S208-F211 PolarHBondContact OG-N 2.86Å; S208-I212 PolarHBondContact O-N 2.66Å
209	Q	96.5	Very high	96.2	Very high	87 Å²	87	38.4 Å²	38.4	41%	0.407	20%	0.203	S	C	.	.	H	α-helix	trans	-51.3	-42.7	174.1	-174.2	62.5	47	0	0	111.8	L203 F211 I212 D213	L203-Q209 HydrophobicContact CD2-CB 4.39Å; Q209-F211 VanDerWaalsContact C-N 3.31Å; Q209-F211 PolarHBondContact O-N 3Å; Q209-I212 WeakPolarHBondContact O-CA 3.48Å; Q209-I212 WeakPolarHBondContact O-CB 3.48Å; Q209-I212 PolarHBondContact O-N 2.7Å; Q209-D213 PolarHBondContact NE2-OD1 3.49Å; Q209-D213 PolarHBondContact NE2-OD2 3.09Å; Q209-D213 VanDerWaalsContact O-CG 3.28Å; Q209-D213 PolarHBondContact O-N 3.22Å
210	R	95.7	Very high	96.2	Very high	114 Å²	114	37.3 Å²	37.3	43%	0.43	20%	0.196	S	C	.	.	H	α-helix	trans	-58	-41.4	177.6	-166.1	-169.1	-174.3	166.2	9.5	112.9	Y144 S208 I212 D213 E214	Y144-R210 HydrophobicContact CD1-CG 4.4Å; Y144-R210 HydrophobicContact CE1-CG 4.01Å; S208-R210 PolarHBondContact O-N 3.46Å; R210-I212 VanDerWaalsContact C-N 3.35Å; R210-D213 PolarHBondContact O-N 2.91Å; R210-E214 HydrophobicContact CG-CG 4.16Å; R210-E214 WeakPolarHBondContact CG-OE1 3.41Å; R210-E214 IonicContact CZ-OE1 3.79Å; R210-E214 IonicContact NE-OE1 2.91Å; R210-E214 PolarHBondContact NE-OE1 3.3Å; R210-E214 IonicContact NE-OE2 3.44Å; R210-E214 PolarHBondContact NE-OE2 2.91Å; R210-E214 IonicContact NH2-OE1 2.95Å; R210-E214 VanDerWaalsContact O-CB 3.25Å; R210-E214 WeakPolarHBondContact O-CB 3.41Å; R210-E214 VanDerWaalsContact O-CG 3.3Å; R210-E214 WeakPolarHBondContact O-CG 3.49Å; R210-E214 PolarHBondContact O-N 3Å
211	F	96.2	Very high	96.1	Very high	1 Å²	1	35 Å²	35	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-70.3	-35.1	176.9	-173.3	-104	0	0	0	111.6	Y144 F148 L151 V207 S208 Q209 V215 I216	Y144-F211 HydrophobicContact CD1-CB 3.8Å; Y144-F211 AromaticContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CG 4.32Å; Y144-F211 AromaticContact CD2-CD2 3.6Å; Y144-F211 HydrophobicContact CD2-CD2 3.6Å; Y144-F211 HydrophobicContact CD2-CE2 4.08Å; Y144-F211 HydrophobicContact CE1-CB 4.44Å; Y144-F211 HydrophobicContact CE1-CD2 4.34Å; Y144-F211 HydrophobicContact CE2-CD2 4.14Å; Y144-F211 HydrophobicContact CG-CB 4.13Å; Y144-F211 AromaticContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CD2 3.43Å; Y144-F211 VanDerWaalsContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CE2 4.29Å; Y144-F211 HydrophobicContact CG-CG 4.23Å; F148-F211 HydrophobicContact CB-CE2 4.19Å; F148-F211 HydrophobicContact CB-CZ 4.01Å; F148-F211 HydrophobicContact CD2-CZ 4.1Å; L151-F211 HydrophobicContact CB-CE1 4.11Å; L151-F211 HydrophobicContact CD2-CE1 3.66Å; L151-F211 HydrophobicContact CD2-CZ 4.06Å; L151-F211 HydrophobicContact CG-CE1 4.42Å; V207-F211 HydrophobicContact CG1-CB 4.26Å; V207-F211 HydrophobicContact CG1-CD1 3.52Å; V207-F211 HydrophobicContact CG1-CE1 4.34Å; V207-F211 HydrophobicContact CG1-CG 4.33Å; S208-F211 WeakPolarHBondContact O-CB 3.46Å; S208-F211 PolarHBondContact O-N 2.97Å; S208-F211 WeakPolarHBondContact OG-CB 3.35Å; S208-F211 PolarHBondContact OG-N 2.86Å; Q209-F211 VanDerWaalsContact C-N 3.31Å; Q209-F211 PolarHBondContact O-N 3Å; F211-V215 HydrophobicContact CD2-CB 3.99Å; F211-V215 HydrophobicContact CD2-CG2 3.63Å; F211-V215 HydrophobicContact CE2-CB 3.88Å; F211-V215 HydrophobicContact CE2-CG1 3.95Å; F211-V215 HydrophobicContact CE2-CG2 3.62Å; F211-V215 HydrophobicContact CG-CB 4.42Å; F211-V215 HydrophobicContact CG-CG2 4.43Å; F211-V215 HydrophobicContact CZ-CB 4.18Å; F211-V215 HydrophobicContact CZ-CG1 3.93Å; F211-V215 HydrophobicContact CZ-CG2 4.4Å; F211-V215 VanDerWaalsContact O-CB 3.31Å; F211-V215 WeakPolarHBondContact O-CB 3.28Å; F211-V215 PolarHBondContact O-N 2.94Å; F211-I216 HydrophobicContact CD1-CD1 3.87Å; F211-I216 HydrophobicContact CD1-CG1 4.18Å; F211-I216 HydrophobicContact CE1-CD1 3.97Å; F211-I216 HydrophobicContact CE1-CG1 4.15Å; F211-I216 PolarHBondContact O-N 2.83Å
212	I	97	Very high	96	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-60.1	-49.5	173.3	-63.8	171.9	0	0	0	109.9	L202 L203 V207 S208 Q209 R210 I216 A217 V228	L202-I212 HydrophobicContact CB-CD1 3.88Å; L202-I212 HydrophobicContact CB-CG1 4.3Å; L202-I212 HydrophobicContact CD1-CG1 4.24Å; L203-I212 HydrophobicContact CD2-CD1 3.87Å; L203-I212 HydrophobicContact CG-CD1 3.78Å; V207-I212 HydrophobicContact CG1-CD1 4.48Å; V207-I212 HydrophobicContact CG1-CG1 3.9Å; S208-I212 PolarHBondContact O-N 2.66Å; Q209-I212 WeakPolarHBondContact O-CA 3.48Å; Q209-I212 WeakPolarHBondContact O-CB 3.48Å; Q209-I212 PolarHBondContact O-N 2.7Å; R210-I212 VanDerWaalsContact C-N 3.35Å; I212-I216 HydrophobicContact CG1-CD1 4.26Å; I212-I216 CarbonylContact O-C 3.59Å; I212-I216 WeakPolarHBondContact O-CB 3.27Å; I212-I216 PolarHBondContact O-N 3.01Å; I212-I216 VanDerWaalsContact O-N 3.15Å; I212-A217 PolarHBondContact O-N 2.75Å; I212-V228 HydrophobicContact CG2-CB 4.12Å; I212-V228 HydrophobicContact CG2-CG1 3.86Å; I212-V228 HydrophobicContact CG2-CG2 3.9Å
213	D	95.5	Very high	95.8	Very high	70 Å²	70	37.6 Å²	37.6	37%	0.374	20%	0.196	S	C	.	.	I	π-helix	trans	-72.7	-41.8	-175.4	-59.8	-22.6	0	0	0	113	Q209 R210 P218	Q209-D213 PolarHBondContact NE2-OD1 3.49Å; Q209-D213 PolarHBondContact NE2-OD2 3.09Å; Q209-D213 VanDerWaalsContact O-CG 3.28Å; Q209-D213 PolarHBondContact O-N 3.22Å; R210-D213 PolarHBondContact O-N 2.91Å; D213-P218 WeakPolarHBondContact O-CD 3.29Å
214	E	94.9	Very high	95.7	Very high	28 Å²	28	34.4 Å²	34.4	13%	0.131	18%	0.179	C	C	.	.	I	π-helix	trans	-89.3	-19.8	-172.3	-61.4	-176.6	179.8	0	0	113.5	I126 L127 R143 Y144 R210	I126-E214 HydrophobicContact CD1-CB 3.81Å; I126-E214 HydrophobicContact CD1-CG 3.68Å; L127-E214 HydrophobicContact CD1-CB 4.46Å; L127-E214 WeakPolarHBondContact CD1-O 3.36Å; R143-E214 IonicContact CZ-OE1 3.9Å; R143-E214 IonicContact CZ-OE2 2.84Å; R143-E214 VanDerWaalsContact CZ-OE2 3.24Å; R143-E214 IonicContact NE-OE1 3.48Å; R143-E214 IonicContact NE-OE2 3.22Å; R143-E214 PolarHBondContact NE-OE2 2.79Å; R143-E214 IonicContact NH2-OE1 3.81Å; R143-E214 PolarHBondContact NH2-OE1 3.45Å; R143-E214 IonicContact NH2-OE2 3.42Å; R143-E214 PolarHBondContact NH2-OE2 2.9Å; Y144-E214 HydrophobicContact CE1-CB 4.24Å; Y144-E214 VanDerWaalsContact CE1-OE2 3.26Å; Y144-E214 WeakPolarHBondContact CE1-OE2 3.43Å; Y144-E214 VanDerWaalsContact CZ-OE2 3.28Å; Y144-E214 WeakPolarHBondContact OH-CB 3.48Å; Y144-E214 PolarHBondContact OH-OE2 3.12Å; R210-E214 HydrophobicContact CG-CG 4.16Å; R210-E214 WeakPolarHBondContact CG-OE1 3.41Å; R210-E214 IonicContact CZ-OE1 3.79Å; R210-E214 IonicContact NE-OE1 2.91Å; R210-E214 PolarHBondContact NE-OE1 3.3Å; R210-E214 IonicContact NE-OE2 3.44Å; R210-E214 PolarHBondContact NE-OE2 2.91Å; R210-E214 IonicContact NH2-OE1 2.95Å; R210-E214 VanDerWaalsContact O-CB 3.25Å; R210-E214 WeakPolarHBondContact O-CB 3.41Å; R210-E214 VanDerWaalsContact O-CG 3.3Å; R210-E214 WeakPolarHBondContact O-CG 3.49Å; R210-E214 PolarHBondContact O-N 3Å
215	V	94.4	Very high	95.6	Very high	33 Å²	33	28.8 Å²	28.8	20%	0.2	16%	0.155	C	C	.	.	I	π-helix	trans	-122.3	-49.8	-177.2	-178.3	0	0	0	0	112.4	L127 Y144 F211 V219	L127-V215 HydrophobicContact CD1-CG2 3.54Å; Y144-V215 HydrophobicContact CE2-CG2 4.05Å; F211-V215 HydrophobicContact CD2-CB 3.99Å; F211-V215 HydrophobicContact CD2-CG2 3.63Å; F211-V215 HydrophobicContact CE2-CB 3.88Å; F211-V215 HydrophobicContact CE2-CG1 3.95Å; F211-V215 HydrophobicContact CE2-CG2 3.62Å; F211-V215 HydrophobicContact CG-CB 4.42Å; F211-V215 HydrophobicContact CG-CG2 4.43Å; F211-V215 HydrophobicContact CZ-CB 4.18Å; F211-V215 HydrophobicContact CZ-CG1 3.93Å; F211-V215 HydrophobicContact CZ-CG2 4.4Å; F211-V215 VanDerWaalsContact O-CB 3.31Å; F211-V215 WeakPolarHBondContact O-CB 3.28Å; F211-V215 PolarHBondContact O-N 2.94Å; V215-V219 WeakPolarHBondContact O-CG2 3.5Å
216	I	96.6	Very high	95.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-79.6	-43.4	-170.8	-59.9	178.9	0	0	0	111.5	L151 L198 L202 V207 F211 I212 V219 M220 V228 L239	L151-I216 HydrophobicContact CD1-CD1 3.87Å; L151-I216 HydrophobicContact CD2-CD1 4.19Å; L151-I216 HydrophobicContact CD2-CG1 4.32Å; L198-I216 HydrophobicContact CD2-CG2 3.83Å; L202-I216 HydrophobicContact CD1-CD1 3.41Å; L202-I216 VanDerWaalsContact CD1-CD1 3.41Å; L202-I216 HydrophobicContact CD1-CG2 4.11Å; V207-I216 HydrophobicContact CG1-CD1 4.22Å; F211-I216 HydrophobicContact CD1-CD1 3.87Å; F211-I216 HydrophobicContact CD1-CG1 4.18Å; F211-I216 HydrophobicContact CE1-CD1 3.97Å; F211-I216 HydrophobicContact CE1-CG1 4.15Å; F211-I216 PolarHBondContact O-N 2.83Å; I212-I216 HydrophobicContact CG1-CD1 4.26Å; I212-I216 CarbonylContact O-C 3.59Å; I212-I216 WeakPolarHBondContact O-CB 3.27Å; I212-I216 PolarHBondContact O-N 3.01Å; I212-I216 VanDerWaalsContact O-N 3.15Å; I216-V219 WeakPolarHBondContact O-CB 3.46Å; I216-V219 PolarHBondContact O-N 2.83Å; I216-V219 VanDerWaalsContact O-N 3.12Å; I216-M220 HydrophobicContact CG2-CE 4.21Å; I216-M220 HydrophobicContact CG2-CG 4.44Å; I216-M220 WeakPolarHBondContact O-CG 3.34Å; I216-M220 PolarHBondContact O-N 2.59Å; I216-V228 HydrophobicContact CG2-CG1 4.02Å; I216-L239 HydrophobicContact CG1-CD2 4.47Å; I216-L239 HydrophobicContact CG2-CD2 4.27Å
217	A	96.4	Very high	95.4	Very high	2 Å²	2	26 Å²	26	2%	0.017	13%	0.133	C	C	.	.	H	α-helix	trans	-59.1	-45.4	177.6	0	0	0	0	0	112.6	I212 V219 M220 R221 V228	I212-A217 PolarHBondContact O-N 2.75Å; A217-V219 VanDerWaalsContact C-N 3.28Å; A217-V219 PolarHBondContact O-N 3.34Å; A217-M220 PolarHBondContact O-N 3.06Å; A217-M220 VanDerWaalsContact O-N 3.15Å; A217-R221 WeakPolarHBondContact O-CB 3.38Å; A217-R221 VanDerWaalsContact O-CG 3.23Å; A217-R221 WeakPolarHBondContact O-CG 3.5Å; A217-R221 PolarHBondContact O-N 2.73Å; A217-V228 HydrophobicContact CB-CG1 3.88Å
218	P	96.6	Very high	95.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-56.1	-38.3	172.5	-25.8	32	0	0	0	114.2	V119 D213 R221 V222 L366 T367 T368	V119-P218 HydrophobicContact CG1-CB 4.2Å; V119-P218 HydrophobicContact CG1-CG 3.58Å; V119-P218 HydrophobicContact CG2-CB 4.44Å; V119-P218 HydrophobicContact CG2-CG 4.37Å; D213-P218 WeakPolarHBondContact O-CD 3.29Å; P218-R221 PolarHBondContact O-N 3.37Å; P218-V222 WeakPolarHBondContact O-CG1 3.37Å; P218-V222 PolarHBondContact O-N 3.47Å; P218-L366 HydrophobicContact CB-CB 3.77Å; P218-L366 HydrophobicContact CB-CD1 4.23Å; P218-T367 WeakPolarHBondContact CA-O 3.35Å; P218-T368 HydrophobicContact CG-CG2 4.17Å
219	V	95.9	Very high	95.2	Very high	18 Å²	18	28.3 Å²	28.3	11%	0.109	15%	0.149	C	C	.	.	H	α-helix	trans	-66.2	-43.5	175.8	176.1	0	0	0	0	111.2	V215 I216 A217 R221 V222 N223 L239 A242	V215-V219 WeakPolarHBondContact O-CG2 3.5Å; I216-V219 WeakPolarHBondContact O-CB 3.46Å; I216-V219 PolarHBondContact O-N 2.83Å; I216-V219 VanDerWaalsContact O-N 3.12Å; A217-V219 VanDerWaalsContact C-N 3.28Å; A217-V219 PolarHBondContact O-N 3.34Å; V219-R221 VanDerWaalsContact C-N 3.31Å; V219-R221 PolarHBondContact O-N 3.29Å; V219-V222 VanDerWaalsContact O-CG1 3.3Å; V219-V222 WeakPolarHBondContact O-CG1 3.32Å; V219-V222 PolarHBondContact O-N 3.38Å; V219-N223 WeakPolarHBondContact O-CB 3.45Å; V219-N223 PolarHBondContact O-N 3.24Å; V219-N223 VanDerWaalsContact O-N 3.09Å; V219-L239 HydrophobicContact CG1-CD2 4.28Å; V219-A242 HydrophobicContact CG1-CB 3.56Å; V219-A242 HydrophobicContact CG2-CB 4.19Å
220	M	96.1	Very high	95.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.6	-41.1	176.7	-63.1	-48.9	108.8	0	0	111.5	L198 I216 A217 N223 Y224 G225 Q226 V228 I230 S238 L239	L198-M220 HydrophobicContact CD2-CE 4.31Å; L198-M220 HydrophobicContact CD2-CG 4.05Å; L198-M220 HydrophobicContact CD2-SD 3.88Å; I216-M220 HydrophobicContact CG2-CE 4.21Å; I216-M220 HydrophobicContact CG2-CG 4.44Å; I216-M220 WeakPolarHBondContact O-CG 3.34Å; I216-M220 PolarHBondContact O-N 2.59Å; A217-M220 PolarHBondContact O-N 3.06Å; A217-M220 VanDerWaalsContact O-N 3.15Å; M220-N223 PolarHBondContact O-N 3.44Å; M220-Y224 WeakPolarHBondContact O-CA 3.14Å; M220-Y224 PolarHBondContact O-N 3.23Å; M220-G225 PolarHBondContact O-N 3.3Å; M220-Q226 CarbonylContact C-O 3.56Å; M220-Q226 WeakPolarHBondContact CB-O 3.31Å; M220-V228 HydrophobicContact CG-CG1 4.19Å; M220-I230 HydrophobicContact CG-CD1 4.11Å; M220-I230 HydrophobicContact SD-CD1 3.47Å; M220-I230 WeakPolarHBondContact SD-CD1 3.26Å; M220-S238 WeakPolarHBondContact CE-OG 3.37Å; M220-L239 HydrophobicContact CE-CD1 4.43Å; M220-L239 HydrophobicContact CE-CD2 3.86Å; M220-L239 HydrophobicContact CE-CG 3.67Å
221	R	95.1	Very high	95.3	Very high	20 Å²	20	18.9 Å²	18.9	8%	0.075	11%	0.11	C	C	.	.	H	α-helix	trans	-66.9	-40	-179	-70.3	171.1	59.8	67.9	4.2	112.7	A217 P218 V219 G225 Q226 N227 T367 T368 F375 N376	A217-R221 WeakPolarHBondContact O-CB 3.38Å; A217-R221 VanDerWaalsContact O-CG 3.23Å; A217-R221 WeakPolarHBondContact O-CG 3.5Å; A217-R221 PolarHBondContact O-N 2.73Å; P218-R221 PolarHBondContact O-N 3.37Å; V219-R221 VanDerWaalsContact C-N 3.31Å; V219-R221 PolarHBondContact O-N 3.29Å; R221-G225 VanDerWaalsContact O-CA 3.24Å; R221-G225 WeakPolarHBondContact O-CA 3.27Å; R221-G225 PolarHBondContact O-N 3.02Å; R221-Q226 PolarHBondContact N-O 2.65Å; R221-N227 WeakPolarHBondContact CG-OD1 3.31Å; R221-N227 PolarHBondContact NH1-OD1 3.3Å; R221-T367 WeakPolarHBondContact CD-O 3.43Å; R221-T367 PolarHBondContact NE-O 3.5Å; R221-T367 PolarHBondContact NE-OG1 3.5Å; R221-T367 PolarHBondContact NH2-OG1 3.21Å; R221-T368 PolarHBondContact NE-O 2.75Å; R221-F375 PolarHBondContact NH2-O 3.23Å; R221-N376 HydrophobicContact CB-CB 4.33Å; R221-N376 PolarHBondContact NH2-OD1 2.68Å; R221-N376 VanDerWaalsContact NH2-OD1 3.15Å; R221-N376 WeakPolarHBondContact O-CB 3.25Å
222	V	93.9	Very high	95.3	Very high	31 Å²	31	18.9 Å²	18.9	19%	0.188	11%	0.11	C	C	.	.	H	α-helix	trans	-73.5	-36.1	177.3	65.2	0	0	0	0	112.7	P218 V219 L366 S377 F404	P218-V222 WeakPolarHBondContact O-CG1 3.37Å; P218-V222 PolarHBondContact O-N 3.47Å; V219-V222 VanDerWaalsContact O-CG1 3.3Å; V219-V222 WeakPolarHBondContact O-CG1 3.32Å; V219-V222 PolarHBondContact O-N 3.38Å; V222-L366 HydrophobicContact CB-CD2 3.99Å; V222-L366 HydrophobicContact CG1-CD1 4.37Å; V222-L366 HydrophobicContact CG1-CD2 4.09Å; V222-L366 HydrophobicContact CG2-CD2 4.04Å; V222-S377 WeakPolarHBondContact CG2-OG 3.41Å; V222-F404 HydrophobicContact CG2-CD2 4.24Å
223	N	93.9	Very high	95.3	Very high	37 Å²	37	18.9 Å²	18.9	20%	0.198	11%	0.11	C	C	.	.	H	α-helix	trans	-86.4	-33.4	-175.7	-73.7	-15.6	0	0	0	113.7	V219 M220 S238 Y432	V219-N223 WeakPolarHBondContact O-CB 3.45Å; V219-N223 PolarHBondContact O-N 3.24Å; V219-N223 VanDerWaalsContact O-N 3.09Å; M220-N223 PolarHBondContact O-N 3.44Å; N223-S238 WeakPolarHBondContact CB-OG 3.36Å; N223-S238 PolarHBondContact ND2-O 3.39Å; N223-S238 VanDerWaalsContact ND2-O 3.12Å; N223-S238 PolarHBondContact ND2-OG 2.74Å; N223-Y432 VanDerWaalsContact O-CE2 3.29Å; N223-Y432 WeakPolarHBondContact O-CE2 3.41Å; N223-Y432 PolarHBondContact O-OH 3.32Å
224	Y	94	Very high	95.4	Very high	7 Å²	7	15.6 Å²	15.6	3%	0.027	9%	0.093	C	C	.	.	H	α-helix	trans	-128.7	-6	-174.4	-67.4	-47.9	0	0	0	115.1	M220 Q226 I230 V234 V237 H336 Y432 Y435 S461	M220-Y224 WeakPolarHBondContact O-CA 3.14Å; M220-Y224 PolarHBondContact O-N 3.23Å; Y224-Q226 PolarHBondContact O-N 3.14Å; Y224-Q226 VanDerWaalsContact O-N 3.15Å; Y224-I230 HydrophobicContact CD2-CD1 4.08Å; Y224-V234 HydrophobicContact CD2-CG1 4.02Å; Y224-V234 HydrophobicContact CE2-CG1 3.46Å; Y224-V234 VanDerWaalsContact CE2-CG1 3.46Å; Y224-V234 WeakPolarHBondContact CE2-O 3.33Å; Y224-V237 WeakPolarHBondContact OH-CG1 3.42Å; Y224-H336 PolarHBondContact O-CD2 3.18Å; Y224-Y432 AromaticContact CD1-CD1 3.44Å; Y224-Y432 HydrophobicContact CD1-CD1 3.44Å; Y224-Y432 VanDerWaalsContact CD1-CD1 3.44Å; Y224-Y432 HydrophobicContact CD1-CD2 4.04Å; Y224-Y432 AromaticContact CD1-CE1 3.55Å; Y224-Y432 HydrophobicContact CD1-CE1 3.55Å; Y224-Y432 HydrophobicContact CD1-CE2 4.15Å; Y224-Y432 AromaticContact CD1-CG 3.69Å; Y224-Y432 HydrophobicContact CD1-CG 3.69Å; Y224-Y432 AromaticContact CD1-CZ 3.93Å; Y224-Y432 AromaticContact CE1-CD1 3.76Å; Y224-Y432 HydrophobicContact CE1-CD1 3.76Å; Y224-Y432 AromaticContact CE1-CE1 3.77Å; Y224-Y432 HydrophobicContact CE1-CE1 3.77Å; Y224-Y432 HydrophobicContact CE1-CG 4.42Å; Y224-Y432 WeakPolarHBondContact O-CD2 3.47Å; Y224-Y435 HydrophobicContact CD1-CE2 4.16Å; Y224-Y435 HydrophobicContact CE1-CE2 4.4Å; Y224-Y435 HydrophobicContact CG-CE2 4.24Å; Y224-S461 PolarHBondContact OH-O 3.23Å
225	G	93.8	Very high	95.5	Very high	11 Å²	11	14.3 Å²	14.3	11%	0.113	9%	0.086	C	C	.	.	S	Bend	trans	67.2	8	-174.3	0	0	0	0	0	114.4	M220 R221 H336	M220-G225 PolarHBondContact O-N 3.3Å; R221-G225 VanDerWaalsContact O-CA 3.24Å; R221-G225 WeakPolarHBondContact O-CA 3.27Å; R221-G225 PolarHBondContact O-N 3.02Å; G225-H336 PolarHBondContact O-NE2 3.43Å
226	Q	94	Very high	95.6	Very high	12 Å²	12	12.9 Å²	12.9	6%	0.056	8%	0.078	C	C	.	.			trans	-122.2	164.3	-174.1	-66.9	175	80.2	0	0	110.1	M220 R221 Y224 I230 P433	M220-Q226 CarbonylContact C-O 3.56Å; M220-Q226 WeakPolarHBondContact CB-O 3.31Å; R221-Q226 PolarHBondContact N-O 2.65Å; Y224-Q226 PolarHBondContact O-N 3.14Å; Y224-Q226 VanDerWaalsContact O-N 3.15Å; Q226-I230 HydrophobicContact CB-CG2 3.8Å; Q226-P433 PolarHBondContact NE2-O 2.98Å
227	N	92.9	Very high	95.5	Very high	32 Å²	32	14.3 Å²	14.3	17%	0.171	9%	0.087	C	C	.	.			trans	-98.3	-170.1	-174.1	-58.2	-39.6	0	0	0	112	R221 S229 I230 E369	R221-N227 WeakPolarHBondContact CG-OD1 3.31Å; R221-N227 PolarHBondContact NH1-OD1 3.3Å; N227-S229 PolarHBondContact O-N 2.83Å; N227-S229 VanDerWaalsContact O-N 3.1Å; N227-I230 WeakPolarHBondContact O-CG2 3.33Å; N227-I230 PolarHBondContact O-N 2.82Å; N227-E369 VanDerWaalsContact CB-OE2 3.24Å; N227-E369 WeakPolarHBondContact CB-OE2 3.34Å; N227-E369 PolarHBondContact ND2-OE1 3.3Å; N227-E369 PolarHBondContact ND2-OE2 2.68Å
228	V	95.6	Very high	95.4	Very high	14 Å²	14	14.4 Å²	14.4	9%	0.085	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	3.9	-174.5	-61.7	0	0	0	0	114.6	L198 S199 I212 I216 A217 M220	L198-V228 WeakPolarHBondContact CB-O 3.07Å; L198-V228 HydrophobicContact CD2-CG1 4.46Å; L198-V228 PolarHBondContact N-O 2.99Å; S199-V228 PolarHBondContact N-O 2.97Å; S199-V228 VanDerWaalsContact N-O 3.1Å; I212-V228 HydrophobicContact CG2-CB 4.12Å; I212-V228 HydrophobicContact CG2-CG1 3.86Å; I212-V228 HydrophobicContact CG2-CG2 3.9Å; I216-V228 HydrophobicContact CG2-CG1 4.02Å; A217-V228 HydrophobicContact CB-CG1 3.88Å; M220-V228 HydrophobicContact CG-CG1 4.19Å
229	S	94.9	Very high	95.3	Very high	77 Å²	77	14.9 Å²	14.9	54%	0.538	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-10	172.2	60.8	0	0	0	0	113.5	N227	N227-S229 PolarHBondContact O-N 2.83Å; N227-S229 VanDerWaalsContact O-N 3.1Å
230	I	95.7	Very high	94.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-60.9	157.7	174.1	64.7	177	0	0	0	111.3	P197 L198 M220 Y224 Q226 N227 V234 Y435	P197-I230 CarbonylContact C-O 3.55Å; P197-I230 WeakPolarHBondContact CA-O 3.27Å; L198-I230 HydrophobicContact CB-CG1 4.38Å; L198-I230 WeakPolarHBondContact CB-O 3.49Å; L198-I230 PolarHBondContact N-O 3.14Å; M220-I230 HydrophobicContact CG-CD1 4.11Å; M220-I230 HydrophobicContact SD-CD1 3.47Å; M220-I230 WeakPolarHBondContact SD-CD1 3.26Å; Y224-I230 HydrophobicContact CD2-CD1 4.08Å; Q226-I230 HydrophobicContact CB-CG2 3.8Å; N227-I230 WeakPolarHBondContact O-CG2 3.33Å; N227-I230 PolarHBondContact O-N 2.82Å; I230-V234 HydrophobicContact CD1-CB 4.35Å; I230-V234 HydrophobicContact CD1-CG1 3.98Å; I230-Y435 HydrophobicContact CG2-CD2 4.13Å; I230-Y435 HydrophobicContact CG2-CG 4.33Å
231	P	97.1	Very high	94.2	Very high	4 Å²	4	15.8 Å²	15.8	3%	0.026	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-55.7	143.1	174.2	-26.3	35.5	0	0	0	112.8	T194 R196 F233 V234 G235	T194-P231 WeakPolarHBondContact O-CB 3.46Å; R196-P231 CarbonylContact O-C 3.16Å; R196-P231 VanDerWaalsContact O-CA 3.31Å; R196-P231 WeakPolarHBondContact O-CA 3.47Å; P231-F233 VanDerWaalsContact C-N 3.26Å; P231-F233 PolarHBondContact O-N 2.77Å; P231-V234 HydrophobicContact CB-CG2 4.03Å; P231-V234 HydrophobicContact CG-CG2 4.22Å; P231-V234 WeakPolarHBondContact O-CB 3.47Å; P231-V234 PolarHBondContact O-N 2.7Å; P231-V234 VanDerWaalsContact O-N 3.11Å; P231-G235 PolarHBondContact O-N 3.01Å
232	A	97.2	Very high	93.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-58.1	-36.2	-176.8	0	0	0	0	0	113.1	W154 M193 R196 L198 S201 G235 A236	W154-A232 WeakPolarHBondContact CH2-O 3.42Å; W154-A232 HydrophobicContact CZ2-CB 4.3Å; M193-A232 HydrophobicContact CB-CB 4.08Å; M193-A232 HydrophobicContact CE-CB 4.41Å; M193-A232 HydrophobicContact CG-CB 4.23Å; M193-A232 PolarHBondContact O-N 3.43Å; R196-A232 PolarHBondContact O-N 3.47Å; L198-A232 HydrophobicContact CD1-CB 4.49Å; S201-A232 VanDerWaalsContact OG-CB 3.29Å; S201-A232 WeakPolarHBondContact OG-CB 3.43Å; A232-G235 PolarHBondContact O-N 3.46Å; A232-A236 PolarHBondContact O-N 2.56Å
233	F	97.2	Very high	92.7	Very high	1 Å²	1	17.4 Å²	17.4	0%	0.004	12%	0.117	C	C	.	.	H	α-helix	trans	-66.4	-42.5	177.8	-165.7	-93.4	0	0	0	111.7	I158 F162 L182 F190 M193 T194 P231 G235 A236 V237 A459 M465	I158-F233 HydrophobicContact CG2-CE2 4.11Å; F162-F233 HydrophobicContact CD2-CZ 4.01Å; F162-F233 HydrophobicContact CE2-CZ 4.32Å; L182-F233 HydrophobicContact CD2-CD1 4.42Å; L182-F233 HydrophobicContact CD2-CE1 3.69Å; L182-F233 HydrophobicContact CD2-CE2 4.11Å; L182-F233 HydrophobicContact CD2-CZ 3.51Å; F190-F233 HydrophobicContact CB-CD2 4.36Å; F190-F233 HydrophobicContact CB-CE2 4.33Å; F190-F233 HydrophobicContact CD1-CD2 4.18Å; F190-F233 AromaticContact CD1-CE2 3.96Å; F190-F233 HydrophobicContact CD1-CE2 3.96Å; F190-F233 HydrophobicContact CD2-CD2 4.33Å; F190-F233 AromaticContact CD2-CE2 3.52Å; F190-F233 HydrophobicContact CD2-CE2 3.52Å; F190-F233 HydrophobicContact CD2-CZ 4.17Å; F190-F233 HydrophobicContact CE1-CE2 4.06Å; F190-F233 AromaticContact CE2-CE2 3.63Å; F190-F233 HydrophobicContact CE2-CE2 3.63Å; F190-F233 HydrophobicContact CE2-CZ 4.2Å; F190-F233 HydrophobicContact CG-CD2 4.05Å; F190-F233 AromaticContact CG-CE2 3.68Å; F190-F233 HydrophobicContact CG-CE2 3.68Å; F190-F233 AromaticContact CZ-CE2 3.9Å; F190-F233 HydrophobicContact CZ-CE2 3.9Å; M193-F233 HydrophobicContact CB-CB 3.86Å; M193-F233 HydrophobicContact CE-CB 4.28Å; M193-F233 HydrophobicContact CE-CD2 4.05Å; M193-F233 PolarHBondContact O-N 3.28Å; M193-F233 VanDerWaalsContact O-N 3.13Å; M193-F233 HydrophobicContact SD-CD2 4.44Å; T194-F233 HydrophobicContact CG2-CB 4.03Å; T194-F233 HydrophobicContact CG2-CG 4.46Å; P231-F233 VanDerWaalsContact C-N 3.26Å; P231-F233 PolarHBondContact O-N 2.77Å; F233-G235 VanDerWaalsContact C-N 3.29Å; F233-G235 PolarHBondContact O-N 2.92Å; F233-A236 WeakPolarHBondContact O-CB 3.33Å; F233-A236 PolarHBondContact O-N 3.12Å; F233-V237 HydrophobicContact CD1-CG2 4.32Å; F233-V237 HydrophobicContact CE1-CG2 4.08Å; F233-V237 WeakPolarHBondContact O-CG2 3.45Å; F233-V237 PolarHBondContact O-N 3.32Å; F233-A459 HydrophobicContact CD1-CB 4.43Å; F233-A459 VanDerWaalsContact CD1-O 3.3Å; F233-A459 WeakPolarHBondContact CD1-O 3.41Å; F233-M465 HydrophobicContact CE1-CE 4.22Å
234	V	96.6	Very high	91.6	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-44	173.7	-178.9	0	0	0	0	110.1	Y224 I230 P231 A236 V237 S238 Y435 A459	Y224-V234 HydrophobicContact CD2-CG1 4.02Å; Y224-V234 HydrophobicContact CE2-CG1 3.46Å; Y224-V234 VanDerWaalsContact CE2-CG1 3.46Å; Y224-V234 WeakPolarHBondContact CE2-O 3.33Å; I230-V234 HydrophobicContact CD1-CB 4.35Å; I230-V234 HydrophobicContact CD1-CG1 3.98Å; P231-V234 HydrophobicContact CB-CG2 4.03Å; P231-V234 HydrophobicContact CG-CG2 4.22Å; P231-V234 WeakPolarHBondContact O-CB 3.47Å; P231-V234 PolarHBondContact O-N 2.7Å; P231-V234 VanDerWaalsContact O-N 3.11Å; V234-A236 PolarHBondContact O-N 3.24Å; V234-V237 PolarHBondContact O-N 2.79Å; V234-S238 PolarHBondContact O-N 2.78Å; V234-Y435 HydrophobicContact CB-CD1 4.42Å; V234-Y435 HydrophobicContact CB-CE1 4.35Å; V234-Y435 HydrophobicContact CG1-CD1 4.04Å; V234-Y435 HydrophobicContact CG1-CD2 3.78Å; V234-Y435 HydrophobicContact CG1-CE1 3.77Å; V234-Y435 HydrophobicContact CG1-CE2 3.51Å; V234-Y435 HydrophobicContact CG1-CG 4.05Å; V234-Y435 HydrophobicContact CG2-CD1 3.62Å; V234-Y435 HydrophobicContact CG2-CE1 3.57Å; V234-Y435 HydrophobicContact CG2-CG 4.27Å; V234-A459 WeakPolarHBondContact CG2-O 3.41Å
235	G	96.8	Very high	91	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-57.7	-44.1	174.6	0	0	0	0	0	113.3	P231 A232 F233 V237 S238 L239	P231-G235 PolarHBondContact O-N 3.01Å; A232-G235 PolarHBondContact O-N 3.46Å; F233-G235 VanDerWaalsContact C-N 3.29Å; F233-G235 PolarHBondContact O-N 2.92Å; G235-V237 PolarHBondContact O-N 2.85Å; G235-S238 PolarHBondContact O-N 3.44Å; G235-L239 WeakPolarHBondContact O-CB 3.36Å; G235-L239 WeakPolarHBondContact O-CD1 3.27Å; G235-L239 VanDerWaalsContact O-CG 3.28Å; G235-L239 WeakPolarHBondContact O-CG 3.35Å; G235-L239 PolarHBondContact O-N 3.37Å
236	A	96.4	Very high	90.8	Very high	3 Å²	3	28.8 Å²	28.8	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-42.5	176	0	0	0	0	0	112.2	W154 I158 M193 A232 F233 V234 S238 L239 A240	W154-A236 HydrophobicContact CH2-CB 3.81Å; W154-A236 HydrophobicContact CZ3-CB 3.94Å; I158-A236 HydrophobicContact CD1-CB 3.62Å; I158-A236 HydrophobicContact CG2-CB 4.14Å; M193-A236 HydrophobicContact CE-CB 4.27Å; A232-A236 PolarHBondContact O-N 2.56Å; F233-A236 WeakPolarHBondContact O-CB 3.33Å; F233-A236 PolarHBondContact O-N 3.12Å; V234-A236 PolarHBondContact O-N 3.24Å; A236-S238 VanDerWaalsContact C-N 3.33Å; A236-S238 PolarHBondContact O-N 3.03Å; A236-L239 PolarHBondContact O-N 2.97Å; A236-A240 PolarHBondContact O-N 3.39Å
237	V	94.9	Very high	90.8	Very high	31 Å²	31	29.8 Å²	29.8	19%	0.188	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-42.6	174.9	175.5	0	0	0	0	111.3	Y224 F233 V234 G235 G241 A462 M465	Y224-V237 WeakPolarHBondContact OH-CG1 3.42Å; F233-V237 HydrophobicContact CD1-CG2 4.32Å; F233-V237 HydrophobicContact CE1-CG2 4.08Å; F233-V237 WeakPolarHBondContact O-CG2 3.45Å; F233-V237 PolarHBondContact O-N 3.32Å; V234-V237 PolarHBondContact O-N 2.79Å; G235-V237 PolarHBondContact O-N 2.85Å; V237-G241 PolarHBondContact O-N 3.48Å; V237-A462 HydrophobicContact CG1-CB 4.21Å; V237-M465 HydrophobicContact CG1-CG 4.48Å
238	S	94.9	Very high	90.9	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-65.9	-43.4	176.2	174.1	0	0	0	0	112.9	M220 N223 V234 G235 A236 A240 G241 A242	M220-S238 WeakPolarHBondContact CE-OG 3.37Å; N223-S238 WeakPolarHBondContact CB-OG 3.36Å; N223-S238 PolarHBondContact ND2-O 3.39Å; N223-S238 VanDerWaalsContact ND2-O 3.12Å; N223-S238 PolarHBondContact ND2-OG 2.74Å; V234-S238 PolarHBondContact O-N 2.78Å; G235-S238 PolarHBondContact O-N 3.44Å; A236-S238 VanDerWaalsContact C-N 3.33Å; A236-S238 PolarHBondContact O-N 3.03Å; S238-A240 VanDerWaalsContact C-N 3.35Å; S238-A240 PolarHBondContact O-N 3.28Å; S238-G241 CarbonylContact O-C 3.53Å; S238-G241 WeakPolarHBondContact O-CA 3.45Å; S238-G241 PolarHBondContact O-N 3.15Å; S238-A242 PolarHBondContact O-N 3.33Å
239	L	94.1	Very high	91	Very high	11 Å²	11	27.7 Å²	27.7	6%	0.058	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-38	-179.8	-72.5	163.2	0	0	0	112.1	L151 W154 V155 I216 V219 M220 G235 A236 G241 A242 Q243	L151-L239 HydrophobicContact CD1-CD1 3.73Å; L151-L239 HydrophobicContact CD2-CD2 4.2Å; W154-L239 HydrophobicContact CZ3-CD1 3.85Å; V155-L239 HydrophobicContact CG2-CB 3.87Å; V155-L239 HydrophobicContact CG2-CD1 4.22Å; I216-L239 HydrophobicContact CG1-CD2 4.47Å; I216-L239 HydrophobicContact CG2-CD2 4.27Å; V219-L239 HydrophobicContact CG1-CD2 4.28Å; M220-L239 HydrophobicContact CE-CD1 4.43Å; M220-L239 HydrophobicContact CE-CD2 3.86Å; M220-L239 HydrophobicContact CE-CG 3.67Å; G235-L239 WeakPolarHBondContact O-CB 3.36Å; G235-L239 WeakPolarHBondContact O-CD1 3.27Å; G235-L239 VanDerWaalsContact O-CG 3.28Å; G235-L239 WeakPolarHBondContact O-CG 3.35Å; G235-L239 PolarHBondContact O-N 3.37Å; A236-L239 PolarHBondContact O-N 2.97Å; L239-G241 PolarHBondContact O-N 2.87Å; L239-A242 PolarHBondContact O-N 3.21Å; L239-Q243 PolarHBondContact O-N 2.94Å
240	A	88.4	Confident	91.1	Very high	16 Å²	16	27.4 Å²	27.4	13%	0.132	16%	0.157	C	C	.	.	H	α-helix	trans	-59.4	-37.9	170.7	0	0	0	0	0	111.5	H92 V155 M159 A236 S238 A242 Q243	H92-A240 PolarHBondContact CD2-O 3.14Å; H92-A240 VanDerWaalsContact CD2-O 3.29Å; V155-A240 HydrophobicContact CG1-CB 4.26Å; M159-A240 HydrophobicContact CG-CB 4.34Å; M159-A240 HydrophobicContact SD-CB 3.73Å; A236-A240 PolarHBondContact O-N 3.39Å; S238-A240 VanDerWaalsContact C-N 3.35Å; S238-A240 PolarHBondContact O-N 3.28Å; A240-A242 PolarHBondContact O-N 3.48Å; A240-Q243 PolarHBondContact O-N 2.85Å
241	G	80.3	Confident	91.1	Very high	20 Å²	20	27.5 Å²	27.5	21%	0.206	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-5.7	173.9	0	0	0	0	0	115.5	I90 V237 S238 L239	I90-G241 WeakPolarHBondContact CD1-O 3.48Å; V237-G241 PolarHBondContact O-N 3.48Å; S238-G241 CarbonylContact O-C 3.53Å; S238-G241 WeakPolarHBondContact O-CA 3.45Å; S238-G241 PolarHBondContact O-N 3.15Å; L239-G241 PolarHBondContact O-N 2.87Å
242	A	80.3	Confident	91.1	Very high	54 Å²	54	27.3 Å²	27.3	45%	0.446	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	3.1	177.2	0	0	0	0	0	113.4	V219 S238 L239 A240	V219-A242 HydrophobicContact CG1-CB 3.56Å; V219-A242 HydrophobicContact CG2-CB 4.19Å; S238-A242 PolarHBondContact O-N 3.33Å; L239-A242 PolarHBondContact O-N 3.21Å; A240-A242 PolarHBondContact O-N 3.48Å
243	Q	76.8	Confident	91.2	Very high	32 Å²	32	27.3 Å²	27.3	15%	0.15	16%	0.157	C	C	.	.	S	Bend	trans	-77.8	175.5	173.1	-72.9	179.9	-32.2	0	0	111.8	M159 L239 A240 L246	M159-Q243 PolarHBondContact SD-OE1 2.93Å; M159-Q243 VanDerWaalsContact SD-OE1 3.41Å; L239-Q243 PolarHBondContact O-N 2.94Å; A240-Q243 PolarHBondContact O-N 2.85Å; Q243-L246 WeakPolarHBondContact O-CG 3.23Å
244	N	71.4	Confident	91.2	Very high	122 Å²	122	30 Å²	30	65%	0.652	17%	0.169	S	C	*	.	S	Bend	trans	-66.4	172.2	173.6	-69	-36.2	0	0	0	111.7
245	N	81.4	Confident	91.2	Very high	117 Å²	117	33.4 Å²	33.4	63%	0.626	19%	0.185	S	C	*	.			trans	71.5	31.2	177.3	-48.8	-45.4	0	0	0	115.6	S93	S93-N245 PolarHBondContact N-O 2.97Å; S93-N245 WeakPolarHBondContact OG-CB 3.42Å
246	L	89.8	Confident	91.3	Very high	54 Å²	54	33.4 Å²	33.4	28%	0.283	19%	0.185	S	C	.	.			trans	-79.3	141.4	171	-56.6	172.8	0	0	0	111.2	I90 I91 H92 Q243	I90-L246 HydrophobicContact CB-CB 4.45Å; I90-L246 HydrophobicContact CD1-CD1 3.72Å; I90-L246 HydrophobicContact CD1-CD2 4.29Å; I91-L246 CarbonylContact O-C 3.17Å; I91-L246 WeakPolarHBondContact O-CA 3.33Å; H92-L246 HydrophobicContact CB-CD2 4.17Å; Q243-L246 WeakPolarHBondContact O-CG 3.23Å
247	W	94.1	Very high	91.4	Very high	33 Å²	33	33.3 Å²	33.3	13%	0.125	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-139.6	170.2	178.2	59.5	-86.7	0	0	0	111	I91 H92 M98 Q99 V102 Y109 V249	I91-W247 HydrophobicContact CB-CD2 3.91Å; I91-W247 HydrophobicContact CB-CE3 4.14Å; I91-W247 HydrophobicContact CB-CH2 4.1Å; I91-W247 HydrophobicContact CB-CZ2 3.84Å; I91-W247 HydrophobicContact CB-CZ3 4.23Å; I91-W247 HydrophobicContact CD1-CE3 3.91Å; I91-W247 HydrophobicContact CD1-CH2 3.56Å; I91-W247 HydrophobicContact CD1-CZ2 4.21Å; I91-W247 HydrophobicContact CD1-CZ3 3.37Å; I91-W247 HydrophobicContact CG1-CH2 4.41Å; I91-W247 HydrophobicContact CG1-CZ3 4.37Å; I91-W247 HydrophobicContact CG2-CD2 4.23Å; I91-W247 VanDerWaalsContact CG2-CE2 3.49Å; I91-W247 HydrophobicContact CG2-CH2 3.76Å; I91-W247 HydrophobicContact CG2-CZ2 3.25Å; I91-W247 HydrophobicContact CG2-CZ3 4.39Å; I91-W247 PolarHBondContact N-O 2.87Å; I91-W247 PolarHBondContact O-N 3.23Å; I91-W247 PolarHBondContact O-NE1 3.36Å; H92-W247 PolarHBondContact O-NE1 3.02Å; H92-W247 VanDerWaalsContact O-NE1 3.17Å; M98-W247 HydrophobicContact CB-CH2 4.19Å; M98-W247 HydrophobicContact CB-CZ2 4.24Å; Q99-W247 HydrophobicContact CG-CZ2 3.72Å; V102-W247 HydrophobicContact CB-CH2 4.42Å; V102-W247 HydrophobicContact CG2-CH2 3.74Å; V102-W247 HydrophobicContact CG2-CZ3 3.81Å; Y109-W247 HydrophobicContact CD1-CB 4.49Å; Y109-W247 AromaticContact CD1-CD2 3.77Å; Y109-W247 HydrophobicContact CD1-CD2 3.77Å; Y109-W247 AromaticContact CD1-CE3 3.35Å; Y109-W247 HydrophobicContact CD1-CE3 3.35Å; Y109-W247 HydrophobicContact CD1-CG 4.29Å; Y109-W247 AromaticContact CD1-CZ3 3.79Å; Y109-W247 HydrophobicContact CD1-CZ3 3.79Å; Y109-W247 AromaticContact CE1-CD2 3.66Å; Y109-W247 HydrophobicContact CE1-CD2 3.66Å; Y109-W247 AromaticContact CE1-CE2 3.97Å; Y109-W247 AromaticContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CE3 3.48Å; Y109-W247 VanDerWaalsContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CG 4.36Å; Y109-W247 AromaticContact CE1-CH2 3.91Å; Y109-W247 HydrophobicContact CE1-CH2 3.91Å; Y109-W247 HydrophobicContact CE1-CZ2 4.08Å; Y109-W247 AromaticContact CE1-CZ3 3.61Å; Y109-W247 HydrophobicContact CE1-CZ3 3.61Å; W247-V249 HydrophobicContact CZ3-CG2 3.87Å
248	A	95.7	Very high	91.6	Very high	2 Å²	2	34 Å²	34	2%	0.017	19%	0.189	C	C	.	.			trans	-144.2	162.7	174.9	0	0	0	0	0	109.3	R110	R110-A248 HydrophobicContact CB-CB 4.35Å; R110-A248 WeakPolarHBondContact CB-O 3.45Å; R110-A248 PolarHBondContact N-O 3.47Å
249	V	97.5	Very high	91.8	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-82.4	134.2	178.7	-179.9	0	0	0	0	110.6	I91 V102 L107 W247 G251 G252 N253 V256	I91-V249 HydrophobicContact CD1-CG2 4.3Å; V102-V249 HydrophobicContact CG2-CG2 3.69Å; L107-V249 HydrophobicContact CB-CG1 4.18Å; L107-V249 HydrophobicContact CD1-CG1 4.09Å; W247-V249 HydrophobicContact CZ3-CG2 3.87Å; V249-G251 PolarHBondContact O-N 3.49Å; V249-G252 PolarHBondContact O-N 3.37Å; V249-N253 PolarHBondContact N-OD1 3.42Å; V249-V256 HydrophobicContact CG2-CG2 3.85Å
250	E	97.1	Very high	92	Very high	70 Å²	70	33.9 Å²	33.9	33%	0.327	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	126.1	171.4	-176.3	173.9	-162.7	0	0	109.8	K108 R110 G252 Q255	K108-E250 HydrophobicContact CB-CB 4.1Å; K108-E250 VanDerWaalsContact CB-OE2 3.31Å; K108-E250 WeakPolarHBondContact CB-OE2 3.42Å; K108-E250 WeakPolarHBondContact CD-OE2 3.32Å; K108-E250 WeakPolarHBondContact O-CB 3.21Å; K108-E250 PolarHBondContact O-N 3.33Å; R110-E250 HydrophobicContact CB-CB 4.48Å; E250-G252 VanDerWaalsContact C-N 3.25Å; E250-G252 PolarHBondContact O-N 3.15Å; E250-Q255 PolarHBondContact O-NE2 3.37Å
251	G	96.1	Very high	92.5	Very high	2 Å²	2	33.6 Å²	33.6	2%	0.021	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	7.9	-174.8	0	0	0	0	0	114.7	V249 Q255 V384 N385	V249-G251 PolarHBondContact O-N 3.49Å; G251-Q255 PolarHBondContact O-NE2 2.91Å; G251-V384 PolarHBondContact N-O 2.9Å; G251-N385 WeakPolarHBondContact CA-OD1 3.3Å; G251-N385 PolarHBondContact N-OD1 3.1Å
252	G	97.3	Very high	93.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.			trans	108.7	145.5	162.9	0	0	0	0	0	114.2	E85 V249 E250 K254 Q255	E85-G252 WeakPolarHBondContact OE1-CA 3.45Å; V249-G252 PolarHBondContact O-N 3.37Å; E250-G252 VanDerWaalsContact C-N 3.25Å; E250-G252 PolarHBondContact O-N 3.15Å; G252-K254 PolarHBondContact O-N 2.9Å; G252-K254 VanDerWaalsContact O-N 3.14Å; G252-Q255 WeakPolarHBondContact O-CB 3.03Å; G252-Q255 WeakPolarHBondContact O-CG 3.26Å; G252-Q255 PolarHBondContact O-N 2.83Å; G252-Q255 VanDerWaalsContact O-N 3.07Å
253	N	97.8	Very high	94.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.6	-174.7	-65.8	-25.6	0	0	0	112.4	L74 E85 G88 V249 Q255 V256 M463	L74-N253 HydrophobicContact CD1-CB 4.26Å; L74-N253 HydrophobicContact CD2-CB 4.46Å; E85-N253 PolarHBondContact OE1-N 3.09Å; G88-N253 PolarHBondContact O-ND2 3.48Å; V249-N253 PolarHBondContact N-OD1 3.42Å; N253-Q255 PolarHBondContact O-N 3.2Å; N253-Q255 VanDerWaalsContact O-N 3.12Å; N253-V256 WeakPolarHBondContact O-CB 3.36Å; N253-V256 PolarHBondContact O-N 3.47Å; N253-V256 VanDerWaalsContact O-N 3.13Å; N253-M463 HydrophobicContact CB-SD 4.42Å
254	K	97.1	Very high	95.1	Very high	58 Å²	58	40.6 Å²	40.6	25%	0.252	20%	0.204	S	C	.	.	H	α-helix	trans	-57.1	-24.2	174.7	73.6	-179.7	178.5	-176.7	0	114.1	L74 T76 E83 G252 V256 C257 S258	L74-K254 HydrophobicContact CB-CB 4.37Å; L74-K254 VanDerWaalsContact O-CB 3.23Å; L74-K254 WeakPolarHBondContact O-CB 3.36Å; T76-K254 HydrophobicContact CG2-CD 4.4Å; T76-K254 WeakPolarHBondContact OG1-CE 3.19Å; T76-K254 PolarHBondContact OG1-NZ 2.88Å; E83-K254 IonicContact OE1-NZ 2.91Å; E83-K254 PolarHBondContact OE1-NZ 2.78Å; G252-K254 PolarHBondContact O-N 2.9Å; G252-K254 VanDerWaalsContact O-N 3.14Å; K254-V256 PolarHBondContact O-N 3.16Å; K254-C257 PolarHBondContact O-N 3.21Å; K254-S258 PolarHBondContact O-N 3.13Å
255	Q	98.1	Very high	96.4	Very high	73 Å²	73	41.1 Å²	41.1	34%	0.341	21%	0.207	S	C	.	.	H	α-helix	trans	-63.4	-29.9	178.5	-70.1	-166.2	40.4	0	0	112.6	L107 E250 G251 G252 N253 C257 S258 G259	L107-Q255 HydrophobicContact CD1-CB 4.23Å; L107-Q255 HydrophobicContact CD2-CB 4.34Å; E250-Q255 PolarHBondContact O-NE2 3.37Å; G251-Q255 PolarHBondContact O-NE2 2.91Å; G252-Q255 WeakPolarHBondContact O-CB 3.03Å; G252-Q255 WeakPolarHBondContact O-CG 3.26Å; G252-Q255 PolarHBondContact O-N 2.83Å; G252-Q255 VanDerWaalsContact O-N 3.07Å; N253-Q255 PolarHBondContact O-N 3.2Å; N253-Q255 VanDerWaalsContact O-N 3.12Å; Q255-C257 VanDerWaalsContact C-N 3.34Å; Q255-C257 PolarHBondContact O-N 3.34Å; Q255-S258 PolarHBondContact O-N 3.17Å; Q255-G259 PolarHBondContact O-N 3.34Å
256	V	98.6	Very high	97.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-48.1	176.1	-178.7	0	0	0	0	109.7	I43 M98 F101 V102 L105 L107 V249 N253 K254 S258 G259 L260	I43-V256 HydrophobicContact CD1-CB 4.46Å; I43-V256 HydrophobicContact CD1-CG1 3.84Å; M98-V256 HydrophobicContact CE-CB 4.33Å; M98-V256 HydrophobicContact CE-CG1 4.13Å; M98-V256 HydrophobicContact CE-CG2 4.02Å; F101-V256 HydrophobicContact CB-CG1 3.79Å; F101-V256 HydrophobicContact CD2-CG1 4.01Å; F101-V256 HydrophobicContact CG-CG1 4.3Å; V102-V256 HydrophobicContact CG2-CG2 4.06Å; L105-V256 HydrophobicContact CD1-CG1 4.35Å; L107-V256 HydrophobicContact CD1-CG2 4.06Å; V249-V256 HydrophobicContact CG2-CG2 3.85Å; N253-V256 WeakPolarHBondContact O-CB 3.36Å; N253-V256 PolarHBondContact O-N 3.47Å; N253-V256 VanDerWaalsContact O-N 3.13Å; K254-V256 PolarHBondContact O-N 3.16Å; V256-S258 PolarHBondContact O-N 3.38Å; V256-G259 PolarHBondContact O-N 2.96Å; V256-L260 HydrophobicContact CG1-CD1 3.85Å; V256-L260 HydrophobicContact CG1-CG 4.23Å; V256-L260 VanDerWaalsContact O-CG 3.27Å; V256-L260 WeakPolarHBondContact O-CG 3.24Å; V256-L260 PolarHBondContact O-N 2.95Å
257	C	98.6	Very high	97.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.8	-48.8	-179.3	-53.2	0	0	0	0	112.2	I43 S46 V70 K254 Q255 G259 L260 L261	I43-C257 VanDerWaalsContact CA-SG 3.54Å; S46-C257 WeakPolarHBondContact CB-O 3.36Å; S46-C257 WeakPolarHBondContact OG-CA 3.47Å; S46-C257 WeakPolarHBondContact OG-CB 3.48Å; V70-C257 HydrophobicContact CG1-CB 3.84Å; K254-C257 PolarHBondContact O-N 3.21Å; Q255-C257 VanDerWaalsContact C-N 3.34Å; Q255-C257 PolarHBondContact O-N 3.34Å; C257-G259 VanDerWaalsContact C-N 3.29Å; C257-G259 PolarHBondContact O-N 2.88Å; C257-L260 PolarHBondContact O-N 3.11Å; C257-L261 WeakPolarHBondContact O-CG 3.43Å; C257-L261 PolarHBondContact O-N 2.98Å; C257-L261 VanDerWaalsContact O-N 3.16Å
258	S	98.2	Very high	97.8	Very high	45 Å²	45	39.6 Å²	39.6	32%	0.315	20%	0.204	S	C	.	.	H	α-helix	trans	-63.8	-36.7	178.5	-65.1	0	0	0	0	112.2	V70 K254 Q255 V256 K262	V70-S258 WeakPolarHBondContact CG1-OG 3.33Å; K254-S258 PolarHBondContact O-N 3.13Å; Q255-S258 PolarHBondContact O-N 3.17Å; V256-S258 PolarHBondContact O-N 3.38Å; S258-K262 WeakPolarHBondContact O-CG 3.43Å; S258-K262 PolarHBondContact O-N 2.93Å
259	G	98.5	Very high	97.9	Very high	13 Å²	13	41.7 Å²	41.7	13%	0.134	22%	0.215	C	C	.	.	H	α-helix	trans	-65.3	-47.4	176	0	0	0	0	0	112.5	L105 Q255 V256 C257 L261 K262 M263	L105-G259 VanDerWaalsContact CD2-CA 3.44Å; L105-G259 WeakPolarHBondContact CD2-O 3.46Å; Q255-G259 PolarHBondContact O-N 3.34Å; V256-G259 PolarHBondContact O-N 2.96Å; C257-G259 VanDerWaalsContact C-N 3.29Å; C257-G259 PolarHBondContact O-N 2.88Å; G259-L261 PolarHBondContact O-N 3.22Å; G259-K262 WeakPolarHBondContact O-CB 3.07Å; G259-K262 PolarHBondContact O-N 3.27Å; G259-M263 PolarHBondContact O-N 3.15Å
260	L	98.8	Very high	97.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-42.2	-179.6	-71.1	174	0	0	0	112.2	I43 A47 H50 F101 L105 V256 C257 K262 M263 A264	I43-L260 HydrophobicContact CD1-CD1 4.23Å; A47-L260 HydrophobicContact CB-CD1 4.21Å; H50-L260 HydrophobicContact CB-CB 4.23Å; H50-L260 HydrophobicContact CB-CD2 4.09Å; F101-L260 HydrophobicContact CB-CD2 4.16Å; F101-L260 HydrophobicContact CD1-CD1 4.34Å; F101-L260 HydrophobicContact CD1-CD2 3.61Å; F101-L260 HydrophobicContact CD2-CD1 3.83Å; F101-L260 HydrophobicContact CD2-CD2 4.5Å; F101-L260 HydrophobicContact CE1-CD1 4.47Å; F101-L260 HydrophobicContact CE1-CD2 4.07Å; F101-L260 HydrophobicContact CE2-CD1 3.98Å; F101-L260 HydrophobicContact CG-CD1 4.02Å; F101-L260 HydrophobicContact CG-CD2 3.85Å; F101-L260 HydrophobicContact CG-CG 4.41Å; F101-L260 HydrophobicContact CZ-CD1 4.3Å; L105-L260 HydrophobicContact CD1-CG 4.39Å; V256-L260 HydrophobicContact CG1-CD1 3.85Å; V256-L260 HydrophobicContact CG1-CG 4.23Å; V256-L260 VanDerWaalsContact O-CG 3.27Å; V256-L260 WeakPolarHBondContact O-CG 3.24Å; V256-L260 PolarHBondContact O-N 2.95Å; C257-L260 PolarHBondContact O-N 3.11Å; L260-K262 VanDerWaalsContact C-N 3.32Å; L260-K262 PolarHBondContact O-N 3.43Å; L260-M263 PolarHBondContact O-N 3.05Å; L260-A264 VanDerWaalsContact O-CB 3.28Å; L260-A264 WeakPolarHBondContact O-CB 3.32Å; L260-A264 PolarHBondContact O-N 3.4Å
261	L	98.7	Very high	97.9	Very high	9 Å²	9	44.9 Å²	44.9	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-40.8	175.4	-67.4	177.8	0	0	0	112.3	A41 A49 V64 V70 C257 G259 A264 N265 A266 L268	A41-L261 HydrophobicContact CB-CD1 4.11Å; A49-L261 HydrophobicContact CB-CD2 4Å; V64-L261 HydrophobicContact CB-CD2 4.26Å; V64-L261 HydrophobicContact CG1-CD2 4.14Å; V64-L261 HydrophobicContact CG2-CD2 3.8Å; V70-L261 HydrophobicContact CG1-CD1 3.86Å; V70-L261 HydrophobicContact CG2-CD1 4.21Å; C257-L261 WeakPolarHBondContact O-CG 3.43Å; C257-L261 PolarHBondContact O-N 2.98Å; C257-L261 VanDerWaalsContact O-N 3.16Å; G259-L261 PolarHBondContact O-N 3.22Å; L261-A264 PolarHBondContact O-N 2.89Å; L261-N265 PolarHBondContact O-N 3.01Å; L261-A266 HydrophobicContact CB-CB 4.49Å; L261-A266 HydrophobicContact CD2-CB 4.07Å; L261-A266 PolarHBondContact O-N 2.83Å; L261-L268 HydrophobicContact CD1-CD1 4.17Å; L261-L268 HydrophobicContact CD1-CD2 4.44Å
262	K	98.3	Very high	97.9	Very high	169 Å²	169	48 Å²	48	74%	0.735	24%	0.242	S	C	*	.	H	α-helix	trans	-65.6	-46.3	175.6	-71.6	174.1	-176.8	-179.2	0	111.7	S258 G259 L260 A264 N265	S258-K262 WeakPolarHBondContact O-CG 3.43Å; S258-K262 PolarHBondContact O-N 2.93Å; G259-K262 WeakPolarHBondContact O-CB 3.07Å; G259-K262 PolarHBondContact O-N 3.27Å; L260-K262 VanDerWaalsContact C-N 3.32Å; L260-K262 PolarHBondContact O-N 3.43Å; K262-A264 PolarHBondContact O-N 3.24Å; K262-N265 PolarHBondContact O-N 2.75Å
263	M	97.5	Very high	98	Very high	84 Å²	84	48.3 Å²	48.3	41%	0.414	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-36.4	175.8	-77.4	-172.7	73.6	0	0	112.3	Q104 L105 G259 L260 N265	Q104-M263 HydrophobicContact CB-CE 3.97Å; Q104-M263 HydrophobicContact CB-SD 4.17Å; L105-M263 HydrophobicContact CD2-CG 3.64Å; L105-M263 HydrophobicContact CD2-SD 3.29Å; L105-M263 WeakPolarHBondContact CD2-SD 3.49Å; L105-M263 HydrophobicContact CG-SD 3.89Å; G259-M263 PolarHBondContact O-N 3.15Å; L260-M263 PolarHBondContact O-N 3.05Å; M263-N265 PolarHBondContact O-N 3.43Å
264	A	97.6	Very high	97.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-9.1	177.3	0	0	0	0	0	113.3	A49 H50 R53 L260 L261 K262 A266	A49-A264 HydrophobicContact CB-CB 4.39Å; H50-A264 HydrophobicContact CB-CB 4.46Å; R53-A264 HydrophobicContact CB-CB 4.23Å; R53-A264 PolarHBondContact NE-O 3.15Å; L260-A264 VanDerWaalsContact O-CB 3.28Å; L260-A264 WeakPolarHBondContact O-CB 3.32Å; L260-A264 PolarHBondContact O-N 3.4Å; L261-A264 PolarHBondContact O-N 2.89Å; K262-A264 PolarHBondContact O-N 3.24Å; A264-A266 HydrophobicContact CB-CB 4.14Å; A264-A266 PolarHBondContact O-N 3.14Å
265	N	97.8	Very high	98	Very high	133 Å²	133	47.9 Å²	47.9	71%	0.711	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.7	45.3	-164.9	-166.8	41.4	0	0	0	111	L261 K262 M263	L261-N265 PolarHBondContact O-N 3.01Å; K262-N265 PolarHBondContact O-N 2.75Å; M263-N265 PolarHBondContact O-N 3.43Å
266	A	98	Very high	97.9	Very high	19 Å²	19	44.4 Å²	44.4	16%	0.157	23%	0.231	C	C	.	.			trans	-78.3	139.8	-178.4	0	0	0	0	0	110.3	A49 V64 L261 A264 L268	A49-A266 HydrophobicContact CB-CB 4.35Å; V64-A266 HydrophobicContact CG2-CB 3.92Å; L261-A266 HydrophobicContact CB-CB 4.49Å; L261-A266 HydrophobicContact CD2-CB 4.07Å; L261-A266 PolarHBondContact O-N 2.83Å; A264-A266 HydrophobicContact CB-CB 4.14Å; A264-A266 PolarHBondContact O-N 3.14Å; A266-L268 PolarHBondContact O-N 3.15Å
267	N	98.1	Very high	97.8	Very high	74 Å²	74	44.6 Å²	44.6	40%	0.396	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	97.5	173.9	-180	33.9	0	0	0	109.2	V62 D63 V64 L269	V62-N267 PolarHBondContact O-N 3.05Å; D63-N267 WeakPolarHBondContact CA-O 3.46Å; D63-N267 VanDerWaalsContact OD1-CB 3.28Å; D63-N267 WeakPolarHBondContact OD1-CB 3.47Å; D63-N267 PolarHBondContact OD1-ND2 3.17Å; V64-N267 PolarHBondContact N-O 3.19Å; N267-L269 PolarHBondContact O-N 3.35Å
268	L	98.3	Very high	97.7	Very high	79 Å²	79	45.2 Å²	45.2	41%	0.414	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.2	-179.4	178.7	64.6	0	0	0	110.7	A41 V64 E66 V70 L261 A266	A41-L268 HydrophobicContact CB-CD1 4.23Å; V64-L268 HydrophobicContact CB-CD1 4.35Å; V64-L268 HydrophobicContact CG1-CD1 4.29Å; E66-L268 HydrophobicContact CB-CD1 4.02Å; V70-L268 HydrophobicContact CG2-CD1 4.21Å; V70-L268 HydrophobicContact CG2-CD2 3.53Å; L261-L268 HydrophobicContact CD1-CD1 4.17Å; L261-L268 HydrophobicContact CD1-CD2 4.44Å; A266-L268 PolarHBondContact O-N 3.15Å
269	L	97.8	Very high	97.6	Very high	46 Å²	46	46.5 Å²	46.5	24%	0.241	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	115.7	178.1	-61.3	173.6	0	0	0	109.5	D63 V64 F65 E66 N267 A271	D63-L269 HydrophobicContact CB-CD1 4.1Å; V64-L269 PolarHBondContact O-N 2.94Å; F65-L269 WeakPolarHBondContact CA-O 3.34Å; F65-L269 HydrophobicContact CD1-CB 4.04Å; F65-L269 HydrophobicContact CD1-CD1 4.02Å; F65-L269 HydrophobicContact CE1-CB 4.26Å; F65-L269 HydrophobicContact CE1-CD1 3.45Å; F65-L269 VanDerWaalsContact CE1-CD1 3.45Å; F65-L269 HydrophobicContact CE2-CD1 4.22Å; F65-L269 HydrophobicContact CZ-CD1 3.58Å; E66-L269 PolarHBondContact N-O 3.09Å; N267-L269 PolarHBondContact O-N 3.35Å; L269-A271 VanDerWaalsContact C-N 3.28Å; L269-A271 PolarHBondContact O-N 3.32Å
270	K	97.6	Very high	97.1	Very high	133 Å²	133	52.1 Å²	52.1	58%	0.578	26%	0.262	S	S	*	.			trans	-77	81.2	173.5	-166.5	168	-167.5	161.1	0	110	E66 G68 E69	E66-K270 CarbonylContact O-C 3.59Å; E66-K270 VanDerWaalsContact O-CA 3.26Å; E66-K270 WeakPolarHBondContact O-CA 3.37Å; G68-K270 WeakPolarHBondContact O-CE 3.3Å; E69-K270 IonicContact OE1-NZ 2.68Å; E69-K270 PolarHBondContact OE1-NZ 3.42Å
271	A	97.3	Very high	96.4	Very high	6 Å²	6	56.4 Å²	56.4	5%	0.05	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	149.7	-171.8	0	0	0	0	0	112	F65 E66 K67 L269 F291 T292 A293	F65-A271 HydrophobicContact CD1-CB 4.08Å; E66-A271 CarbonylContact C-O 3.6Å; E66-A271 VanDerWaalsContact C-O 3.32Å; E66-A271 PolarHBondContact O-N 2.85Å; K67-A271 PolarHBondContact N-O 2.84Å; L269-A271 VanDerWaalsContact C-N 3.28Å; L269-A271 PolarHBondContact O-N 3.32Å; A271-F291 HydrophobicContact CB-CB 4.36Å; A271-F291 HydrophobicContact CB-CD2 3.77Å; A271-F291 HydrophobicContact CB-CG 4.37Å; A271-T292 CarbonylContact C-O 3.55Å; A271-T292 VanDerWaalsContact CA-O 3.23Å; A271-T292 WeakPolarHBondContact CA-O 3.29Å; A271-T292 WeakPolarHBondContact CB-O 3Å; A271-A293 HydrophobicContact CB-CB 3.91Å
272	Q	97.3	Very high	95.7	Very high	66 Å²	66	59.5 Å²	59.5	31%	0.308	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	117.6	172.7	178.7	174.6	7.1	0	0	109.9	K67 T274 F291 T292 S317	K67-Q272 HydrophobicContact CB-CB 3.82Å; K67-Q272 HydrophobicContact CB-CG 4.33Å; K67-Q272 HydrophobicContact CD-CG 4.19Å; Q272-T274 PolarHBondContact O-N 3.13Å; Q272-F291 CarbonylContact O-C 3.56Å; Q272-F291 WeakPolarHBondContact O-CA 3.5Å; Q272-F291 WeakPolarHBondContact O-CB 3.42Å; Q272-T292 PolarHBondContact N-O 3.17Å; Q272-T292 PolarHBondContact O-N 3.28Å; Q272-T292 PolarHBondContact O-OG1 3.33Å; Q272-S317 PolarHBondContact NE2-O 3.44Å
273	V	98.1	Very high	94.8	Very high	7 Å²	7	61.2 Å²	61.2	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	126.2	169.1	-173.6	0	0	0	0	109	V39 F65 I276 L289 N290 F291 L319	V39-V273 HydrophobicContact CG1-CB 4.12Å; V39-V273 HydrophobicContact CG1-CG2 3.92Å; V39-V273 HydrophobicContact CG2-CG2 3.94Å; F65-V273 HydrophobicContact CB-CG2 3.71Å; F65-V273 HydrophobicContact CD1-CG2 3.89Å; F65-V273 HydrophobicContact CD2-CG2 4.13Å; F65-V273 HydrophobicContact CG-CG2 3.65Å; V273-I276 HydrophobicContact CG1-CG1 4.25Å; V273-L289 HydrophobicContact CG1-CB 4.42Å; V273-L289 HydrophobicContact CG1-CD2 4.32Å; V273-L289 HydrophobicContact CG1-CG 4.08Å; V273-L289 HydrophobicContact CG2-CD2 4.38Å; V273-N290 CarbonylContact C-O 3.49Å; V273-N290 WeakPolarHBondContact CA-O 3.39Å; V273-F291 HydrophobicContact CG2-CB 4.38Å; V273-L319 HydrophobicContact CB-CD1 4.21Å; V273-L319 HydrophobicContact CG1-CD1 3.62Å
274	T	97.1	Very high	94.3	Very high	45 Å²	45	59.9 Å²	59.9	28%	0.276	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-32.5	-176.2	54.3	0	0	0	0	112.4	Q272 N290 T292 Q320	Q272-T274 PolarHBondContact O-N 3.13Å; T274-N290 PolarHBondContact N-O 2.84Å; T274-N290 PolarHBondContact OG1-O 2.73Å; T274-T292 HydrophobicContact CG2-CG2 3.92Å; T274-Q320 PolarHBondContact O-N 3.16Å
275	S	97.2	Very high	94	Very high	5 Å²	5	61 Å²	61	4%	0.035	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	155.1	172.4	74.4	0	0	0	0	113.7	N290 Q320 Q322	S275-N290 PolarHBondContact N-O 3.17Å; S275-N290 PolarHBondContact O-N 2.8Å; S275-N290 PolarHBondContact OG-ND2 3.49Å; S275-Q320 CarbonylContact C-O 3.46Å; S275-Q320 WeakPolarHBondContact CA-O 3.46Å; S275-Q320 WeakPolarHBondContact CB-O 3.24Å; S275-Q322 PolarHBondContact OG-OE1 3.48Å
276	I	97.6	Very high	93.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.4	172.1	-64.6	164.1	0	0	0	107.2	V273 Y287 Q288 L289 V305 L307 L319 Q320 F321 Q322 F324	V273-I276 HydrophobicContact CG1-CG1 4.25Å; I276-Y287 HydrophobicContact CG2-CD1 3.73Å; I276-Y287 HydrophobicContact CG2-CG 4.41Å; I276-Q288 WeakPolarHBondContact CA-O 3.32Å; I276-L289 HydrophobicContact CG1-CD1 3.89Å; I276-L289 HydrophobicContact CG1-CG 3.96Å; I276-L289 HydrophobicContact CG2-CD1 4.2Å; I276-V305 HydrophobicContact CD1-CG1 4.3Å; I276-L307 HydrophobicContact CD1-CD1 4.41Å; I276-L307 HydrophobicContact CD1-CD2 3.6Å; I276-L319 HydrophobicContact CD1-CD1 3.89Å; I276-L319 HydrophobicContact CD1-CD2 3.89Å; I276-L319 HydrophobicContact CD1-CG 4.32Å; I276-L319 HydrophobicContact CG1-CD1 3.98Å; I276-Q320 PolarHBondContact N-O 3.22Å; I276-F321 HydrophobicContact CB-CD1 4.46Å; I276-F321 HydrophobicContact CD1-CE1 4.22Å; I276-Q322 PolarHBondContact O-N 3.27Å; I276-F324 HydrophobicContact CG2-CE2 4.4Å; I276-F324 HydrophobicContact CG2-CZ 4.15Å; I276-F324 WeakPolarHBondContact O-CE2 3.16Å
277	S	96.8	Very high	93.9	Very high	4 Å²	4	56 Å²	56	3%	0.028	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.4	171.5	50.9	0	0	0	0	111.1	Y287 Q288 Q322	S277-Y287 WeakPolarHBondContact O-CA 3.17Å; S277-Q288 PolarHBondContact N-O 2.73Å; S277-Q288 PolarHBondContact O-N 3.22Å; S277-Q322 WeakPolarHBondContact CA-O 3.34Å; S277-Q322 WeakPolarHBondContact CB-O 3.49Å
278	P	96.2	Very high	93.9	Very high	13 Å²	13	55.4 Å²	55.4	8%	0.084	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	136.4	173.3	31.6	-31.1	0	0	0	109.8	L285 Y287 Q322 D323 F324	P278-L285 HydrophobicContact CB-CD1 3.91Å; P278-Y287 HydrophobicContact CB-CD1 4.38Å; P278-Y287 HydrophobicContact CB-CE1 4.14Å; P278-Q322 WeakPolarHBondContact CD-O 3.3Å; P278-D323 WeakPolarHBondContact CG-O 3.3Å; P278-F324 HydrophobicContact CG-CD1 4.19Å; P278-F324 HydrophobicContact CG-CD2 4.39Å; P278-F324 HydrophobicContact CG-CE1 4.3Å; P278-F324 HydrophobicContact CG-CE2 4.48Å; P278-F324 HydrophobicContact CG-CG 4.24Å; P278-F324 HydrophobicContact CG-CZ 4.44Å
279	L	94.4	Very high	93.9	Very high	72 Å²	72	51.7 Å²	51.7	38%	0.377	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124	173.8	-73.2	174.7	0	0	0	109.4	Q286 Q288 L301	L279-Q286 PolarHBondContact N-O 2.99Å; L279-Q286 PolarHBondContact O-N 2.85Å; L279-Q288 HydrophobicContact CD1-CB 3.72Å; L279-Q288 HydrophobicContact CG-CB 4.32Å; L279-L301 HydrophobicContact CD1-CD2 3.51Å
280	H	89.5	Confident	93.9	Very high	131 Å²	131	51.3 Å²	51.3	61%	0.606	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.5	177	-65.2	85.3	0	0	0	109.5	L284	H280-L284 WeakPolarHBondContact CA-O 3.48Å
281	S	84.7	Confident	93.9	Very high	90 Å²	90	46 Å²	46	63%	0.629	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	85.9	171.2	-177.9	0	0	0	0	108.9	E283 L284	S281-E283 PolarHBondContact O-N 3.42Å; S281-L284 PolarHBondContact N-O 2.8Å; S281-L284 WeakPolarHBondContact O-CB 3.22Å; S281-L284 PolarHBondContact O-N 3.39Å
282	G	82.6	Confident	93.9	Very high	73 Å²	73	48.3 Å²	48.3	75%	0.753	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	-123.5	-169.8	0	0	0	0	0	110.9
283	E	79.4	Confident	93.8	Very high	205 Å²	205	46.4 Å²	46.4	96%	0.958	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.3	174.8	-62.4	-169.8	166.9	0	0	113.3	S281	S281-E283 PolarHBondContact O-N 3.42Å
284	L	86.6	Confident	93.6	Very high	57 Å²	57	51.6 Å²	51.6	30%	0.298	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.2	179.9	-171.7	69.6	0	0	0	110.6	H27 H280 S281 Q286	H27-L284 VanDerWaalsContact CD2-CD1 3.45Å; H27-L284 WeakPolarHBondContact CD2-CD1 3.16Å; H280-L284 WeakPolarHBondContact CA-O 3.48Å; S281-L284 PolarHBondContact N-O 2.8Å; S281-L284 WeakPolarHBondContact O-CB 3.22Å; S281-L284 PolarHBondContact O-N 3.39Å; L284-Q286 HydrophobicContact CD2-CG 4.12Å; L284-Q286 HydrophobicContact CG-CG 4.14Å
285	L	92.6	Very high	93.3	Very high	24 Å²	24	55.1 Å²	55.1	13%	0.126	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.5	170.4	172.8	64.3	0	0	0	109.7	P278 Y287 P448	P278-L285 HydrophobicContact CB-CD1 3.91Å; L285-Y287 HydrophobicContact CD2-CE2 4.45Å; L285-Y287 HydrophobicContact CG-CE2 4.4Å; L285-P448 HydrophobicContact CD2-CB 3.94Å; L285-P448 WeakPolarHBondContact CD2-O 3.23Å
286	Q	96.1	Very high	93.1	Very high	46 Å²	46	56.6 Å²	56.6	22%	0.215	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	168.3	170.1	-67.7	-176	-48.6	0	0	110	L279 L284 Y302 D303	L279-Q286 PolarHBondContact N-O 2.99Å; L279-Q286 PolarHBondContact O-N 2.85Å; L284-Q286 HydrophobicContact CD2-CG 4.12Å; L284-Q286 HydrophobicContact CG-CG 4.14Å; Q286-Y302 CarbonylContact C-O 3.32Å; Q286-Y302 WeakPolarHBondContact CA-O 3.48Å; Q286-D303 PolarHBondContact NE2-OD1 3.19Å
287	Y	97.5	Very high	93.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.4	176.2	-66.6	-85.9	0	0	0	110.8	I276 S277 P278 L285 L301 Y302 V305 F324 H447 P448 N449 L450	I276-Y287 HydrophobicContact CG2-CD1 3.73Å; I276-Y287 HydrophobicContact CG2-CG 4.41Å; S277-Y287 WeakPolarHBondContact O-CA 3.17Å; P278-Y287 HydrophobicContact CB-CD1 4.38Å; P278-Y287 HydrophobicContact CB-CE1 4.14Å; L285-Y287 HydrophobicContact CD2-CE2 4.45Å; L285-Y287 HydrophobicContact CG-CE2 4.4Å; Y287-L301 CarbonylContact O-C 3.49Å; Y287-L301 WeakPolarHBondContact O-CA 3.35Å; Y287-Y302 PolarHBondContact N-O 3.25Å; Y287-Y302 PolarHBondContact O-N 3.39Å; Y287-V305 HydrophobicContact CD2-CG2 3.86Å; Y287-V305 HydrophobicContact CG-CG2 3.85Å; Y287-F324 HydrophobicContact CD1-CZ 4.5Å; Y287-F324 HydrophobicContact CE1-CE1 4.17Å; Y287-F324 HydrophobicContact CE1-CZ 4.07Å; Y287-H447 AromaticContact CZ-ND1 3.73Å; Y287-H447 PolarHBondContact OH-ND1 3.39Å; Y287-P448 PolarHBondContact OH-O 2.74Å; Y287-N449 HydrophobicContact CE2-CB 4.25Å; Y287-L450 HydrophobicContact CE1-CB 4.13Å; Y287-L450 HydrophobicContact CE1-CD2 4.14Å; Y287-L450 HydrophobicContact CE2-CB 4.17Å; Y287-L450 VanDerWaalsContact OH-CB 3.29Å; Y287-L450 WeakPolarHBondContact OH-CB 3.31Å
288	Q	97.8	Very high	93	Very high	62 Å²	62	63.3 Å²	63.3	29%	0.29	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.2	167.6	-175	174.3	19.2	0	0	109.5	I276 S277 L279 S299 L301	I276-Q288 WeakPolarHBondContact CA-O 3.32Å; S277-Q288 PolarHBondContact N-O 2.73Å; S277-Q288 PolarHBondContact O-N 3.22Å; L279-Q288 HydrophobicContact CD1-CB 3.72Å; L279-Q288 HydrophobicContact CG-CB 4.32Å; Q288-S299 VanDerWaalsContact CG-OG 3.3Å; Q288-S299 WeakPolarHBondContact CG-OG 3.28Å; Q288-S299 PolarHBondContact NE2-OG 3.07Å; Q288-L301 HydrophobicContact CB-CD2 3.78Å; Q288-L301 HydrophobicContact CG-CD2 4.18Å
289	L	98.1	Very high	93.1	Very high	0 Å²	0	65 Å²	65	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.8	174.3	-91.5	62.4	0	0	0	108.9	A37 V39 F65 V273 I276 S299 E300 Y302 V305	A37-L289 HydrophobicContact CB-CD2 3.6Å; V39-L289 HydrophobicContact CG2-CD2 4.23Å; F65-L289 HydrophobicContact CD2-CD2 4.42Å; F65-L289 HydrophobicContact CE2-CD2 4.05Å; V273-L289 HydrophobicContact CG1-CB 4.42Å; V273-L289 HydrophobicContact CG1-CD2 4.32Å; V273-L289 HydrophobicContact CG1-CG 4.08Å; V273-L289 HydrophobicContact CG2-CD2 4.38Å; I276-L289 HydrophobicContact CG1-CD1 3.89Å; I276-L289 HydrophobicContact CG1-CG 3.96Å; I276-L289 HydrophobicContact CG2-CD1 4.2Å; L289-S299 VanDerWaalsContact O-CA 3.32Å; L289-S299 WeakPolarHBondContact O-CA 3.18Å; L289-E300 PolarHBondContact N-O 2.92Å; L289-E300 PolarHBondContact O-N 2.81Å; L289-E300 VanDerWaalsContact O-N 3.07Å; L289-Y302 HydrophobicContact CB-CD2 4.11Å; L289-Y302 HydrophobicContact CB-CE2 4.08Å; L289-Y302 HydrophobicContact CD1-CD2 4.08Å; L289-Y302 HydrophobicContact CD2-CD2 3.97Å; L289-Y302 HydrophobicContact CD2-CE2 4.05Å; L289-Y302 HydrophobicContact CG-CD2 4.26Å; L289-V305 HydrophobicContact CD1-CG1 4.35Å; L289-V305 HydrophobicContact CD1-CG2 3.69Å; L289-V305 HydrophobicContact CD2-CG1 4.41Å
290	N	98	Very high	93.2	Very high	38 Å²	38	65.2 Å²	65.2	20%	0.203	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.1	168.5	-63.5	-40.6	0	0	0	109.3	V273 T274 S275 G298 S299	V273-N290 CarbonylContact C-O 3.49Å; V273-N290 WeakPolarHBondContact CA-O 3.39Å; T274-N290 PolarHBondContact N-O 2.84Å; T274-N290 PolarHBondContact OG1-O 2.73Å; S275-N290 PolarHBondContact N-O 3.17Å; S275-N290 PolarHBondContact O-N 2.8Å; S275-N290 PolarHBondContact OG-ND2 3.49Å; N290-G298 WeakPolarHBondContact CA-O 3.44Å; N290-S299 VanDerWaalsContact OD1-CB 3.23Å; N290-S299 WeakPolarHBondContact OD1-CB 3.49Å; N290-S299 PolarHBondContact OD1-OG 2.8Å
291	F	97.7	Very high	93.6	Very high	22 Å²	22	62.3 Å²	62.3	10%	0.096	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	159.6	-178.1	58.2	-91.8	0	0	0	112.4	F65 A271 Q272 V273 V297 G298 E300	F65-F291 HydrophobicContact CD1-CB 4.37Å; F65-F291 HydrophobicContact CD1-CD1 4.38Å; F65-F291 HydrophobicContact CD1-CG 4.22Å; F65-F291 HydrophobicContact CE1-CB 4.24Å; F65-F291 AromaticContact CE1-CD1 3.46Å; F65-F291 HydrophobicContact CE1-CD1 3.46Å; F65-F291 VanDerWaalsContact CE1-CD1 3.46Å; F65-F291 HydrophobicContact CE1-CD2 4.11Å; F65-F291 AromaticContact CE1-CE1 3.71Å; F65-F291 HydrophobicContact CE1-CE1 3.71Å; F65-F291 HydrophobicContact CE1-CE2 4.32Å; F65-F291 AromaticContact CE1-CG 3.67Å; F65-F291 HydrophobicContact CE1-CG 3.67Å; F65-F291 HydrophobicContact CE1-CZ 4.14Å; F65-F291 AromaticContact CZ-CD1 3.98Å; F65-F291 HydrophobicContact CZ-CD1 3.98Å; F65-F291 HydrophobicContact CZ-CE1 4.02Å; A271-F291 HydrophobicContact CB-CB 4.36Å; A271-F291 HydrophobicContact CB-CD2 3.77Å; A271-F291 HydrophobicContact CB-CG 4.37Å; Q272-F291 CarbonylContact O-C 3.56Å; Q272-F291 WeakPolarHBondContact O-CA 3.5Å; Q272-F291 WeakPolarHBondContact O-CB 3.42Å; V273-F291 HydrophobicContact CG2-CB 4.38Å; F291-V297 WeakPolarHBondContact O-CA 3.34Å; F291-G298 PolarHBondContact N-O 2.98Å; F291-G298 PolarHBondContact O-N 3.28Å; F291-E300 HydrophobicContact CE1-CB 4.13Å; F291-E300 HydrophobicContact CE1-CG 3.69Å; F291-E300 HydrophobicContact CZ-CG 3.99Å
292	T	97.3	Very high	94.2	Very high	54 Å²	54	58 Å²	58	33%	0.331	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.6	175.5	53.3	0	0	0	0	109.3	A271 Q272 T274 V297	A271-T292 CarbonylContact C-O 3.55Å; A271-T292 VanDerWaalsContact CA-O 3.23Å; A271-T292 WeakPolarHBondContact CA-O 3.29Å; A271-T292 WeakPolarHBondContact CB-O 3Å; Q272-T292 PolarHBondContact N-O 3.17Å; Q272-T292 PolarHBondContact O-N 3.28Å; Q272-T292 PolarHBondContact O-OG1 3.33Å; T274-T292 HydrophobicContact CG2-CG2 3.92Å; T292-V297 HydrophobicContact CG2-CG2 4.31Å
293	A	95.4	Very high	94.9	Very high	27 Å²	27	54.7 Å²	54.7	22%	0.223	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	170.4	175.8	0	0	0	0	0	109.6	A271 S295 G296	A271-A293 HydrophobicContact CB-CB 3.91Å; A293-S295 PolarHBondContact O-N 3.09Å; A293-S295 VanDerWaalsContact O-N 3.13Å; A293-G296 PolarHBondContact N-O 3.13Å; A293-G296 PolarHBondContact O-N 3.34Å
294	A	92.9	Very high	95.8	Very high	115 Å²	115	45 Å²	45	95%	0.95	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.8	173.4	0	0	0	0	0	112.9	G296	A294-G296 VanDerWaalsContact C-N 3.33Å
295	S	90.9	Very high	96.4	Very high	119 Å²	119	42.2 Å²	42.2	83%	0.832	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-6.8	176.1	53.6	0	0	0	0	114.5	A293	A293-S295 PolarHBondContact O-N 3.09Å; A293-S295 VanDerWaalsContact O-N 3.13Å
296	G	94.1	Very high	96.7	Very high	37 Å²	37	41.1 Å²	41.1	38%	0.381	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	124.1	-164.5	-178.6	0	0	0	0	0	113.5	A293 A294	A293-G296 PolarHBondContact N-O 3.13Å; A293-G296 PolarHBondContact O-N 3.34Å; A294-G296 VanDerWaalsContact C-N 3.33Å
297	V	95.9	Very high	96.8	Very high	124 Å²	124	38.9 Å²	38.9	75%	0.752	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	133.9	175.9	-175.7	0	0	0	0	109	F291 T292	F291-V297 WeakPolarHBondContact O-CA 3.34Å; T292-V297 HydrophobicContact CG2-CG2 4.31Å
298	G	96.1	Very high	96.8	Very high	20 Å²	20	39.5 Å²	39.5	21%	0.206	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	162.8	176.2	0	0	0	0	0	111.8	N290 F291	N290-G298 WeakPolarHBondContact CA-O 3.44Å; F291-G298 PolarHBondContact N-O 2.98Å; F291-G298 PolarHBondContact O-N 3.28Å
299	S	96.9	Very high	96.6	Very high	49 Å²	49	38 Å²	38	34%	0.343	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	131	177	-167.3	0	0	0	0	109.3	Q288 L289 N290	Q288-S299 VanDerWaalsContact CG-OG 3.3Å; Q288-S299 WeakPolarHBondContact CG-OG 3.28Å; Q288-S299 PolarHBondContact NE2-OG 3.07Å; L289-S299 VanDerWaalsContact O-CA 3.32Å; L289-S299 WeakPolarHBondContact O-CA 3.18Å; N290-S299 VanDerWaalsContact OD1-CB 3.23Å; N290-S299 WeakPolarHBondContact OD1-CB 3.49Å; N290-S299 PolarHBondContact OD1-OG 2.8Å
300	E	97.4	Very high	96.4	Very high	77 Å²	77	38.7 Å²	38.7	36%	0.36	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153	-176.7	-68.2	-66.1	166.1	0	0	110.9	R35 L289 F291 Y302	R35-E300 IonicContact CZ-OE2 3.67Å; R35-E300 IonicContact NH1-OE2 3.22Å; R35-E300 PolarHBondContact NH1-OE2 3.43Å; R35-E300 IonicContact NH2-OE2 2.8Å; R35-E300 PolarHBondContact NH2-OE2 3.05Å; L289-E300 PolarHBondContact N-O 2.92Å; L289-E300 PolarHBondContact O-N 2.81Å; L289-E300 VanDerWaalsContact O-N 3.07Å; F291-E300 HydrophobicContact CE1-CB 4.13Å; F291-E300 HydrophobicContact CE1-CG 3.69Å; F291-E300 HydrophobicContact CZ-CG 3.99Å; E300-Y302 HydrophobicContact CB-CD2 4.47Å; E300-Y302 HydrophobicContact CB-CE2 3.59Å
301	L	97.4	Very high	96.1	Very high	70 Å²	70	37.8 Å²	37.8	37%	0.366	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.3	179.4	-62.8	179.8	0	0	0	111.7	L279 Y287 Q288	L279-L301 HydrophobicContact CD1-CD2 3.51Å; Y287-L301 CarbonylContact O-C 3.49Å; Y287-L301 WeakPolarHBondContact O-CA 3.35Å; Q288-L301 HydrophobicContact CB-CD2 3.78Å; Q288-L301 HydrophobicContact CG-CD2 4.18Å
302	Y	97.9	Very high	95.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.6	-178.6	-65.5	-81.4	0	0	0	112	R35 A37 D63 F65 Q286 Y287 L289 E300	R35-Y302 HydrophobicContact CB-CD1 3.73Å; R35-Y302 HydrophobicContact CB-CE1 4.12Å; R35-Y302 PolarHBondContact NH2-OH 3.41Å; A37-Y302 HydrophobicContact CB-CD1 3.56Å; A37-Y302 HydrophobicContact CB-CD2 3.8Å; A37-Y302 HydrophobicContact CB-CE1 3.8Å; A37-Y302 HydrophobicContact CB-CE2 4Å; A37-Y302 HydrophobicContact CB-CG 3.57Å; D63-Y302 HydrophobicContact CB-CE1 3.83Å; D63-Y302 WeakPolarHBondContact CB-OH 3.46Å; D63-Y302 VanDerWaalsContact OD2-CE1 3.24Å; D63-Y302 WeakPolarHBondContact OD2-CE1 3.27Å; D63-Y302 PolarHBondContact OD2-OH 3.24Å; F65-Y302 AromaticContact CE2-CE2 3.96Å; F65-Y302 HydrophobicContact CE2-CE2 3.96Å; F65-Y302 AromaticContact CE2-CZ 3.76Å; F65-Y302 WeakPolarHBondContact CE2-OH 3.39Å; F65-Y302 HydrophobicContact CZ-CE2 4Å; F65-Y302 AromaticContact CZ-CZ 3.87Å; F65-Y302 WeakPolarHBondContact CZ-OH 3.39Å; Q286-Y302 CarbonylContact C-O 3.32Å; Q286-Y302 WeakPolarHBondContact CA-O 3.48Å; Y287-Y302 PolarHBondContact N-O 3.25Å; Y287-Y302 PolarHBondContact O-N 3.39Å; L289-Y302 HydrophobicContact CB-CD2 4.11Å; L289-Y302 HydrophobicContact CB-CE2 4.08Å; L289-Y302 HydrophobicContact CD1-CD2 4.08Å; L289-Y302 HydrophobicContact CD2-CD2 3.97Å; L289-Y302 HydrophobicContact CD2-CE2 4.05Å; L289-Y302 HydrophobicContact CG-CD2 4.26Å; E300-Y302 HydrophobicContact CB-CD2 4.47Å; E300-Y302 HydrophobicContact CB-CE2 3.59Å
303	D	97.4	Very high	95.3	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.016	26%	0.26	C	S	.	.	S	Bend	trans	-80.7	-33.8	177	-54.2	-52	0	0	0	111.3	P33 S34 R35 Q286 N449 W481	P33-D303 HydrophobicContact CB-CB 3.92Å; S34-D303 WeakPolarHBondContact CA-OD2 3.35Å; S34-D303 PolarHBondContact N-OD2 2.76Å; R35-D303 PolarHBondContact N-OD2 3.02Å; R35-D303 PolarHBondContact O-N 2.91Å; Q286-D303 PolarHBondContact NE2-OD1 3.19Å; D303-N449 VanDerWaalsContact O-CB 3.3Å; D303-N449 WeakPolarHBondContact O-CB 3.36Å; D303-W481 HydrophobicContact CB-CH2 3.67Å; D303-W481 HydrophobicContact CB-CZ3 3.84Å
304	I	98.3	Very high	94.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	139	179.5	-57.4	172.8	0	0	0	109.2	P33 I36 A37 F56 N449 Y451 A477 W481	P33-I304 HydrophobicContact CB-CD1 4.14Å; P33-I304 HydrophobicContact CG-CD1 4Å; I36-I304 WeakPolarHBondContact CA-O 3.23Å; I36-I304 HydrophobicContact CB-CB 4.42Å; I36-I304 HydrophobicContact CD1-CD1 4.11Å; I36-I304 HydrophobicContact CG1-CB 4.08Å; I36-I304 HydrophobicContact CG1-CD1 4.32Å; I36-I304 HydrophobicContact CG2-CB 3.9Å; I36-I304 HydrophobicContact CG2-CG2 3.97Å; A37-I304 PolarHBondContact N-O 2.86Å; F56-I304 HydrophobicContact CE2-CD1 4.39Å; F56-I304 HydrophobicContact CZ-CD1 3.93Å; I304-N449 WeakPolarHBondContact CA-O 3.41Å; I304-N449 HydrophobicContact CG1-CB 4.15Å; I304-Y451 HydrophobicContact CG2-CD2 4.01Å; I304-Y451 HydrophobicContact CG2-CE2 3.86Å; I304-A477 HydrophobicContact CD1-CB 4.37Å; I304-A477 HydrophobicContact CG2-CB 4.48Å; I304-W481 HydrophobicContact CD1-CD2 4.47Å; I304-W481 HydrophobicContact CD1-CE3 3.92Å; I304-W481 HydrophobicContact CD1-CZ3 4.44Å; I304-W481 HydrophobicContact CG1-CE3 4.11Å; I304-W481 HydrophobicContact CG1-CZ3 4.21Å
305	V	98.6	Very high	94.6	Very high	0 Å²	0	35 Å²	35	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.9	177.3	-178.7	0	0	0	0	109.7	A37 I276 Y287 L289 L307 N449 L450 Y451	A37-V305 HydrophobicContact CB-CG2 4.4Å; A37-V305 CarbonylContact O-C 3.59Å; A37-V305 WeakPolarHBondContact O-CA 3.47Å; I276-V305 HydrophobicContact CD1-CG1 4.3Å; Y287-V305 HydrophobicContact CD2-CG2 3.86Å; Y287-V305 HydrophobicContact CG-CG2 3.85Å; L289-V305 HydrophobicContact CD1-CG1 4.35Å; L289-V305 HydrophobicContact CD1-CG2 3.69Å; L289-V305 HydrophobicContact CD2-CG1 4.41Å; V305-L307 HydrophobicContact CG1-CD2 4Å; V305-N449 PolarHBondContact N-O 3.08Å; V305-L450 HydrophobicContact CB-CD1 3.63Å; V305-L450 HydrophobicContact CG1-CD1 3.62Å; V305-L450 WeakPolarHBondContact O-CA 3.35Å; V305-Y451 PolarHBondContact O-N 3.13Å
306	V	98.8	Very high	94.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122.1	173.1	-173.5	0	0	0	0	110.1	A37 V38 V39 T48 Y451 L453 I473	A37-V306 PolarHBondContact O-N 2.83Å; V38-V306 CarbonylContact C-O 3.53Å; V38-V306 WeakPolarHBondContact CA-O 3.47Å; V38-V306 HydrophobicContact CG2-CB 4.41Å; V39-V306 PolarHBondContact N-O 2.95Å; T48-V306 HydrophobicContact CG2-CB 4.17Å; T48-V306 HydrophobicContact CG2-CG1 3.99Å; T48-V306 HydrophobicContact CG2-CG2 3.99Å; V306-Y451 HydrophobicContact CG2-CD2 4.3Å; V306-L453 HydrophobicContact CG1-CB 4.48Å; V306-I473 HydrophobicContact CG1-CD1 4.12Å; V306-I473 HydrophobicContact CG1-CG2 3.97Å; V306-I473 HydrophobicContact CG2-CG2 3.74Å
307	L	98.4	Very high	93.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	107.5	176.9	-55.9	-179.1	0	0	0	109.6	V39 I276 V305 L311 L319 F321 L446 L450 Y451 Y452 L453	V39-L307 HydrophobicContact CB-CD2 3.98Å; V39-L307 HydrophobicContact CG2-CD2 3.8Å; I276-L307 HydrophobicContact CD1-CD1 4.41Å; I276-L307 HydrophobicContact CD1-CD2 3.6Å; V305-L307 HydrophobicContact CG1-CD2 4Å; L307-L311 HydrophobicContact CD1-CD1 3.72Å; L307-L311 HydrophobicContact CD1-CD2 4.15Å; L307-L319 HydrophobicContact CD1-CD2 4.32Å; L307-L319 HydrophobicContact CD2-CD2 4.05Å; L307-F321 HydrophobicContact CD1-CE1 3.85Å; L307-F321 HydrophobicContact CD1-CZ 3.57Å; L307-L446 HydrophobicContact CD1-CD1 3.9Å; L307-L450 HydrophobicContact CD1-CD1 4.05Å; L307-L450 HydrophobicContact CG-CD1 4.05Å; L307-Y451 PolarHBondContact N-O 2.94Å; L307-Y452 HydrophobicContact CB-CD2 4.19Å; L307-L453 WeakPolarHBondContact O-CB 3.47Å; L307-L453 PolarHBondContact O-N 3.41Å
308	A	97.7	Very high	93.5	Very high	13 Å²	13	27 Å²	27	11%	0.107	19%	0.192	C	C	.	.			trans	-109.4	29.5	177.5	0	0	0	0	0	112.3	V38 V39 L453 N454	V38-A308 HydrophobicContact CG1-CB 4.3Å; V39-A308 CarbonylContact O-C 3.57Å; V39-A308 VanDerWaalsContact O-C 3.24Å; V39-A308 VanDerWaalsContact O-CA 3.26Å; V39-A308 WeakPolarHBondContact O-CA 3.43Å; V39-A308 WeakPolarHBondContact O-CB 3.23Å; V39-A308 PolarHBondContact O-N 3.45Å; A308-L453 HydrophobicContact CB-CB 4.34Å; A308-L453 HydrophobicContact CB-CD1 4.24Å; A308-N454 WeakPolarHBondContact CA-OD1 3.27Å; A308-N454 PolarHBondContact O-OD1 3.09Å
309	T	94	Very high	93.4	Very high	30 Å²	30	27 Å²	27	18%	0.184	19%	0.187	C	C	.	.	S	Bend	trans	-124.5	142.7	168.8	179.7	0	0	0	0	109.8	V39 L311 Y452 N454	V39-T309 HydrophobicContact CG1-CG2 4.22Å; V39-T309 PolarHBondContact O-N 3.12Å; T309-L311 HydrophobicContact CG2-CD2 4.43Å; T309-Y452 WeakPolarHBondContact O-CE2 3.37Å; T309-N454 VanDerWaalsContact C-OD1 3.22Å; T309-N454 WeakPolarHBondContact CA-OD1 3.4Å; T309-N454 PolarHBondContact N-OD1 3.28Å; T309-N454 PolarHBondContact O-OD1 3.05Å
310	P	93	Very high	93.3	Very high	14 Å²	14	30.4 Å²	30.4	9%	0.091	20%	0.198	C	C	.	.			trans	-55.1	141.2	170	-26	35.5	0	0	0	112.5	V315 Y335	P310-V315 HydrophobicContact CB-CB 4.3Å; P310-V315 HydrophobicContact CB-CG1 4.14Å; P310-V315 HydrophobicContact CB-CG2 3.88Å; P310-Y335 HydrophobicContact CB-CD2 4.5Å; P310-Y335 HydrophobicContact CB-CE1 3.9Å; P310-Y335 HydrophobicContact CB-CE2 3.9Å; P310-Y335 HydrophobicContact CG-CD1 4.4Å; P310-Y335 HydrophobicContact CG-CE1 3.64Å
311	L	92.6	Very high	93.2	Very high	20 Å²	20	28.9 Å²	28.9	11%	0.105	19%	0.19	C	C	.	.			trans	-109.5	-9.8	-175.4	-61.9	176.7	0	0	0	114.1	L307 T309 L319 F321 L331 L446 Y452	L307-L311 HydrophobicContact CD1-CD1 3.72Å; L307-L311 HydrophobicContact CD1-CD2 4.15Å; T309-L311 HydrophobicContact CG2-CD2 4.43Å; L311-L319 HydrophobicContact CD2-CD2 3.77Å; L311-F321 HydrophobicContact CD1-CE2 4.37Å; L311-F321 HydrophobicContact CD1-CZ 4Å; L311-F321 HydrophobicContact CD2-CE2 4.34Å; L311-F321 HydrophobicContact CD2-CZ 4.24Å; L311-L331 HydrophobicContact CB-CD1 4.14Å; L311-L331 HydrophobicContact CD1-CD1 4.08Å; L311-L446 HydrophobicContact CD1-CD1 3.89Å; L311-Y452 HydrophobicContact CB-CE2 4.37Å; L311-Y452 HydrophobicContact CD1-CD2 3.69Å; L311-Y452 HydrophobicContact CD1-CE2 3.78Å; L311-Y452 HydrophobicContact CD1-CG 4.17Å; L311-Y452 HydrophobicContact CG-CD2 4.08Å; L311-Y452 HydrophobicContact CG-CE2 3.68Å; L311-Y452 PolarHBondContact N-OH 3.49Å
312	Q	91.2	Very high	93.1	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	19%	0.187	C	C	.	.	S	Bend	trans	-59.6	139	179.2	-76.5	71.6	14	0	0	111.3	S314 V315 Y335 Y452 W458	Q312-S314 PolarHBondContact O-N 2.95Å; Q312-V315 PolarHBondContact O-N 2.96Å; Q312-Y335 HydrophobicContact CB-CD2 4.13Å; Q312-Y335 HydrophobicContact CB-CE2 4.36Å; Q312-Y335 HydrophobicContact CG-CD2 4.26Å; Q312-Y335 HydrophobicContact CG-CE2 4.16Å; Q312-Y335 VanDerWaalsContact OE1-CE2 3.24Å; Q312-Y452 PolarHBondContact OE1-OH 3.27Å; Q312-W458 HydrophobicContact CG-CZ2 3.84Å; Q312-W458 VanDerWaalsContact NE2-CZ2 3.26Å
313	A	86.9	Confident	92.9	Very high	64 Å²	64	35.1 Å²	35.1	53%	0.529	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-51.4	-37.9	-177.1	0	0	0	0	0	113.3	V315 G316	A313-V315 PolarHBondContact O-N 3.01Å; A313-V315 VanDerWaalsContact O-N 3.1Å; A313-G316 PolarHBondContact O-N 3.17Å
314	S	85.3	Confident	92.7	Very high	56 Å²	56	35.9 Å²	35.9	39%	0.392	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-57.4	-24.3	178	61	0	0	0	0	115.2	Q312 S334 Y335	Q312-S314 PolarHBondContact O-N 2.95Å; S314-S334 VanDerWaalsContact OG-CA 3.31Å; S314-S334 WeakPolarHBondContact OG-CA 3.4Å; S314-Y335 PolarHBondContact OG-N 3.47Å
315	V	87.3	Confident	92.2	Very high	38 Å²	38	40.1 Å²	40.1	23%	0.23	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-85.4	-20.9	-179.6	-178.6	0	0	0	0	111.3	P310 Q312 A313 Y335 Q430	P310-V315 HydrophobicContact CB-CB 4.3Å; P310-V315 HydrophobicContact CB-CG1 4.14Å; P310-V315 HydrophobicContact CB-CG2 3.88Å; Q312-V315 PolarHBondContact O-N 2.96Å; A313-V315 PolarHBondContact O-N 3.01Å; A313-V315 VanDerWaalsContact O-N 3.1Å; V315-Y335 HydrophobicContact CG2-CD1 4.12Å; V315-Y335 HydrophobicContact CG2-CD2 3.73Å; V315-Y335 HydrophobicContact CG2-CE2 4.43Å; V315-Y335 HydrophobicContact CG2-CG 3.55Å; V315-Q430 HydrophobicContact CG1-CB 4.48Å; V315-Q430 HydrophobicContact CG2-CB 4.25Å
316	G	85.4	Confident	91.6	Very high	53 Å²	53	45.7 Å²	45.7	55%	0.546	30%	0.296	S	S	.	.			trans	57.1	51.8	-178.6	0	0	0	0	0	112.1	A313 G318	A313-G316 PolarHBondContact O-N 3.17Å; G316-G318 PolarHBondContact O-N 3.31Å; G316-G318 VanDerWaalsContact O-N 3.09Å
317	S	85.8	Confident	91	Very high	17 Å²	17	50.4 Å²	50.4	12%	0.119	33%	0.327	C	S	.	.			trans	-55.5	-29.8	-178	65.2	0	0	0	0	112.6	Q272 L319	Q272-S317 PolarHBondContact NE2-O 3.44Å; S317-L319 PolarHBondContact OG-N 3.21Å
318	G	88.3	Confident	90.4	Very high	42 Å²	42	52.9 Å²	52.9	43%	0.433	34%	0.338	S	S	.	.			trans	77.7	7.4	-174	0	0	0	0	0	113.1	G316	G316-G318 PolarHBondContact O-N 3.31Å; G316-G318 VanDerWaalsContact O-N 3.09Å
319	L	93.7	Very high	89.4	Confident	20 Å²	20	58.7 Å²	58.7	11%	0.105	37%	0.367	C	S	.	.			trans	-90.1	129.5	179.5	-177	63.6	0	0	0	110.3	V273 I276 L307 L311 S317 F321	V273-L319 HydrophobicContact CB-CD1 4.21Å; V273-L319 HydrophobicContact CG1-CD1 3.62Å; I276-L319 HydrophobicContact CD1-CD1 3.89Å; I276-L319 HydrophobicContact CD1-CD2 3.89Å; I276-L319 HydrophobicContact CD1-CG 4.32Å; I276-L319 HydrophobicContact CG1-CD1 3.98Å; L307-L319 HydrophobicContact CD1-CD2 4.32Å; L307-L319 HydrophobicContact CD2-CD2 4.05Å; L311-L319 HydrophobicContact CD2-CD2 3.77Å; S317-L319 PolarHBondContact OG-N 3.21Å; L319-F321 HydrophobicContact CD2-CE2 4.33Å; L319-F321 HydrophobicContact CD2-CZ 4.03Å
320	Q	94.5	Very high	88.8	Confident	121 Å²	121	64.8 Å²	64.8	57%	0.565	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.2	175.4	-62.3	-168.6	-16.7	0	0	111.6	T274 S275 I276 Q322	T274-Q320 PolarHBondContact O-N 3.16Å; S275-Q320 CarbonylContact C-O 3.46Å; S275-Q320 WeakPolarHBondContact CA-O 3.46Å; S275-Q320 WeakPolarHBondContact CB-O 3.24Å; I276-Q320 PolarHBondContact N-O 3.22Å; Q320-Q322 HydrophobicContact CB-CG 4.48Å
321	F	94.9	Very high	88.6	Confident	45 Å²	45	65.3 Å²	65.3	20%	0.197	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.1	171.7	-65.3	-86.9	0	0	0	108.3	I276 L307 L311 L319 F324 F328 L450	I276-F321 HydrophobicContact CB-CD1 4.46Å; I276-F321 HydrophobicContact CD1-CE1 4.22Å; L307-F321 HydrophobicContact CD1-CE1 3.85Å; L307-F321 HydrophobicContact CD1-CZ 3.57Å; L311-F321 HydrophobicContact CD1-CE2 4.37Å; L311-F321 HydrophobicContact CD1-CZ 4Å; L311-F321 HydrophobicContact CD2-CE2 4.34Å; L311-F321 HydrophobicContact CD2-CZ 4.24Å; L319-F321 HydrophobicContact CD2-CE2 4.33Å; L319-F321 HydrophobicContact CD2-CZ 4.03Å; F321-F324 HydrophobicContact CB-CD2 3.75Å; F321-F324 HydrophobicContact CB-CE2 3.74Å; F321-F324 HydrophobicContact CD1-CD2 4.4Å; F321-F324 AromaticContact CD1-CE2 3.66Å; F321-F324 HydrophobicContact CD1-CE2 3.66Å; F321-F324 AromaticContact CD1-CZ 3.84Å; F321-F324 HydrophobicContact CD1-CZ 3.84Å; F321-F324 HydrophobicContact CG-CE2 4.2Å; F321-F328 HydrophobicContact CB-CB 3.62Å; F321-F328 HydrophobicContact CB-CD1 4.17Å; F321-F328 HydrophobicContact CB-CG 4.02Å; F321-F328 HydrophobicContact CD1-CD1 4.36Å; F321-F328 HydrophobicContact CD1-CD2 4.46Å; F321-F328 HydrophobicContact CD1-CG 4.19Å; F321-F328 HydrophobicContact CD2-CB 4.47Å; F321-F328 AromaticContact CD2-CD1 3.39Å; F321-F328 HydrophobicContact CD2-CD1 3.39Å; F321-F328 AromaticContact CD2-CE1 3.77Å; F321-F328 HydrophobicContact CD2-CE1 3.77Å; F321-F328 AromaticContact CD2-CG 3.98Å; F321-F328 HydrophobicContact CD2-CG 3.98Å; F321-F328 AromaticContact CE2-CD1 3.78Å; F321-F328 HydrophobicContact CE2-CD1 3.78Å; F321-F328 AromaticContact CE2-CE1 3.63Å; F321-F328 HydrophobicContact CE2-CE1 3.63Å; F321-F328 HydrophobicContact CE2-CZ 4.27Å; F321-F328 HydrophobicContact CG-CB 3.99Å; F321-F328 AromaticContact CG-CD1 3.72Å; F321-F328 HydrophobicContact CG-CD1 3.72Å; F321-F328 HydrophobicContact CG-CD2 4.5Å; F321-F328 HydrophobicContact CG-CE1 4.36Å; F321-F328 AromaticContact CG-CG 3.8Å; F321-F328 HydrophobicContact CG-CG 3.8Å; F321-F328 HydrophobicContact CZ-CD1 4.41Å; F321-F328 HydrophobicContact CZ-CE1 4.1Å; F321-F328 HydrophobicContact CZ-CZ 4.3Å; F321-L450 HydrophobicContact CE1-CD2 4.15Å
322	Q	95.1	Very high	88.4	Confident	66 Å²	66	69.2 Å²	69.2	31%	0.308	42%	0.422	S	S	.	.			trans	-115.6	146.4	-174.6	-66.3	171.4	-4.3	0	0	109.7	S275 I276 S277 P278 Q320 F324	S275-Q322 PolarHBondContact OG-OE1 3.48Å; I276-Q322 PolarHBondContact O-N 3.27Å; S277-Q322 WeakPolarHBondContact CA-O 3.34Å; S277-Q322 WeakPolarHBondContact CB-O 3.49Å; P278-Q322 WeakPolarHBondContact CD-O 3.3Å; Q320-Q322 HydrophobicContact CB-CG 4.48Å; Q322-F324 WeakPolarHBondContact O-CD2 3.47Å; Q322-F324 PolarHBondContact O-N 2.71Å; Q322-F324 VanDerWaalsContact O-N 3.1Å
323	D	93.4	Very high	88.2	Confident	134 Å²	134	70.7 Å²	70.7	72%	0.717	44%	0.437	S	S	*	.	S	Bend	trans	58.7	24.6	172.4	-49.6	-44.4	0	0	0	115.7	P278	P278-D323 WeakPolarHBondContact CG-O 3.3Å
324	F	93.3	Very high	88.5	Confident	19 Å²	19	69.8 Å²	69.8	8%	0.083	43%	0.427	C	S	.	.			trans	-78.5	141.3	170.3	-75.5	-97.2	0	0	0	111.3	I276 P278 Y287 F321 Q322 P326 P327 F328 H447 L450	I276-F324 HydrophobicContact CG2-CE2 4.4Å; I276-F324 HydrophobicContact CG2-CZ 4.15Å; I276-F324 WeakPolarHBondContact O-CE2 3.16Å; P278-F324 HydrophobicContact CG-CD1 4.19Å; P278-F324 HydrophobicContact CG-CD2 4.39Å; P278-F324 HydrophobicContact CG-CE1 4.3Å; P278-F324 HydrophobicContact CG-CE2 4.48Å; P278-F324 HydrophobicContact CG-CG 4.24Å; P278-F324 HydrophobicContact CG-CZ 4.44Å; Y287-F324 HydrophobicContact CD1-CZ 4.5Å; Y287-F324 HydrophobicContact CE1-CE1 4.17Å; Y287-F324 HydrophobicContact CE1-CZ 4.07Å; F321-F324 HydrophobicContact CB-CD2 3.75Å; F321-F324 HydrophobicContact CB-CE2 3.74Å; F321-F324 HydrophobicContact CD1-CD2 4.4Å; F321-F324 AromaticContact CD1-CE2 3.66Å; F321-F324 HydrophobicContact CD1-CE2 3.66Å; F321-F324 AromaticContact CD1-CZ 3.84Å; F321-F324 HydrophobicContact CD1-CZ 3.84Å; F321-F324 HydrophobicContact CG-CE2 4.2Å; Q322-F324 WeakPolarHBondContact O-CD2 3.47Å; Q322-F324 PolarHBondContact O-N 2.71Å; Q322-F324 VanDerWaalsContact O-N 3.1Å; F324-P326 CarbonylContact C-O 3.54Å; F324-P326 WeakPolarHBondContact CB-O 3.41Å; F324-P326 CarbonylContact O-C 3.52Å; F324-P326 VanDerWaalsContact O-C 3.3Å; F324-P327 WeakPolarHBondContact O-CA 3.39Å; F324-F328 HydrophobicContact CB-CB 4.4Å; F324-F328 HydrophobicContact CG-CB 4.35Å; F324-H447 HydrophobicContact CE1-CB 4.12Å; F324-L450 HydrophobicContact CE1-CD2 3.95Å; F324-L450 HydrophobicContact CZ-CD2 3.88Å
325	A	88.6	Confident	88.8	Confident	90 Å²	90	67.8 Å²	67.8	74%	0.744	41%	0.411	S	S	*	.	S	Bend	trans	-130.1	109.6	174.7	0	0	0	0	0	110
326	P	86.3	Confident	88.9	Confident	116 Å²	116	67.7 Å²	67.7	75%	0.753	41%	0.408	S	S	*	.	S	Bend	cis	-63.9	160.1	-3.5	30.3	-36	0	0	0	112.2	F324 F328	F324-P326 CarbonylContact C-O 3.54Å; F324-P326 WeakPolarHBondContact CB-O 3.41Å; F324-P326 CarbonylContact O-C 3.52Å; F324-P326 VanDerWaalsContact O-C 3.3Å; P326-F328 PolarHBondContact O-N 3.12Å
327	P	85.9	Confident	89.1	Confident	100 Å²	100	66.3 Å²	66.3	65%	0.649	39%	0.394	S	S	*	.			trans	-51.7	141.1	173.4	-25.9	35	0	0	0	111	F324 D329	F324-P327 WeakPolarHBondContact O-CA 3.39Å; P327-D329 PolarHBondContact O-N 3.06Å
328	F	84.3	Confident	89.3	Confident	52 Å²	52	65.9 Å²	65.9	23%	0.228	39%	0.39	C	S	.	.			trans	-71.5	112	178.2	-172.7	-90.6	0	0	0	109.6	F321 F324 P326 L331 L446	F321-F328 HydrophobicContact CB-CB 3.62Å; F321-F328 HydrophobicContact CB-CD1 4.17Å; F321-F328 HydrophobicContact CB-CG 4.02Å; F321-F328 HydrophobicContact CD1-CD1 4.36Å; F321-F328 HydrophobicContact CD1-CD2 4.46Å; F321-F328 HydrophobicContact CD1-CG 4.19Å; F321-F328 HydrophobicContact CD2-CB 4.47Å; F321-F328 AromaticContact CD2-CD1 3.39Å; F321-F328 HydrophobicContact CD2-CD1 3.39Å; F321-F328 AromaticContact CD2-CE1 3.77Å; F321-F328 HydrophobicContact CD2-CE1 3.77Å; F321-F328 AromaticContact CD2-CG 3.98Å; F321-F328 HydrophobicContact CD2-CG 3.98Å; F321-F328 AromaticContact CE2-CD1 3.78Å; F321-F328 HydrophobicContact CE2-CD1 3.78Å; F321-F328 AromaticContact CE2-CE1 3.63Å; F321-F328 HydrophobicContact CE2-CE1 3.63Å; F321-F328 HydrophobicContact CE2-CZ 4.27Å; F321-F328 HydrophobicContact CG-CB 3.99Å; F321-F328 AromaticContact CG-CD1 3.72Å; F321-F328 HydrophobicContact CG-CD1 3.72Å; F321-F328 HydrophobicContact CG-CD2 4.5Å; F321-F328 HydrophobicContact CG-CE1 4.36Å; F321-F328 AromaticContact CG-CG 3.8Å; F321-F328 HydrophobicContact CG-CG 3.8Å; F321-F328 HydrophobicContact CZ-CD1 4.41Å; F321-F328 HydrophobicContact CZ-CE1 4.1Å; F321-F328 HydrophobicContact CZ-CZ 4.3Å; F324-F328 HydrophobicContact CB-CB 4.4Å; F324-F328 HydrophobicContact CG-CB 4.35Å; P326-F328 PolarHBondContact O-N 3.12Å; F328-L331 HydrophobicContact CE1-CG 4.43Å; F328-L331 HydrophobicContact CZ-CD2 4.29Å; F328-L331 HydrophobicContact CZ-CG 4.22Å; F328-L446 HydrophobicContact CE2-CB 3.98Å; F328-L446 HydrophobicContact CE2-CD1 3.84Å; F328-L446 HydrophobicContact CE2-CD2 4.02Å; F328-L446 HydrophobicContact CE2-CG 4.16Å; F328-L446 HydrophobicContact CZ-CD1 3.8Å; F328-L446 HydrophobicContact CZ-CD2 4.06Å; F328-L446 HydrophobicContact CZ-CG 4.4Å
329	D	76.9	Confident	89.7	Confident	135 Å²	135	64.2 Å²	64.2	72%	0.722	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-69.9	145.4	176.5	-70.2	-34.6	0	0	0	111	P327 L331	P327-D329 PolarHBondContact O-N 3.06Å; D329-L331 PolarHBondContact O-N 3.45Å
330	E	83.1	Confident	89.8	Confident	158 Å²	158	63.2 Å²	63.2	74%	0.738	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-60	129.5	172.1	-73.5	-172	174.4	0	0	110.4
331	L	87.2	Confident	90	Very high	24 Å²	24	57.5 Å²	57.5	13%	0.126	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-65.2	129.6	176	-66.8	-177	0	0	0	109.7	L311 F328 D329 Y452	L311-L331 HydrophobicContact CB-CD1 4.14Å; L311-L331 HydrophobicContact CD1-CD1 4.08Å; F328-L331 HydrophobicContact CE1-CG 4.43Å; F328-L331 HydrophobicContact CZ-CD2 4.29Å; F328-L331 HydrophobicContact CZ-CG 4.22Å; D329-L331 PolarHBondContact O-N 3.45Å; L331-Y452 HydrophobicContact CD1-CD1 3.85Å; L331-Y452 HydrophobicContact CD1-CE1 3.54Å
332	P	88.3	Confident	90.2	Very high	102 Å²	102	55.4 Å²	55.4	66%	0.662	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-66.9	161.7	-175.3	27.7	-35.4	0	0	0	112.4
333	G	88.5	Confident	90.3	Very high	32 Å²	32	52.2 Å²	52.2	33%	0.33	32%	0.316	S	S	.	.			trans	92.2	178.8	175	0	0	0	0	0	114
334	S	92.3	Very high	90.5	Very high	46 Å²	46	47 Å²	47	32%	0.322	29%	0.287	S	S	.	.			trans	-134.8	163.3	-178.2	59.2	0	0	0	0	110.9	S314 H434	S314-S334 VanDerWaalsContact OG-CA 3.31Å; S314-S334 WeakPolarHBondContact OG-CA 3.4Å; S334-H434 PolarHBondContact O-N 3.46Å; S334-H434 WeakPolarHBondContact OG-CB 3.43Å
335	Y	92.1	Very high	90.7	Very high	13 Å²	13	46 Å²	46	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	145.2	170.5	-86.1	-121.6	0	0	0	110.5	P310 Q312 S314 V315 Q430 Y432 P433 W458	P310-Y335 HydrophobicContact CB-CD2 4.5Å; P310-Y335 HydrophobicContact CB-CE1 3.9Å; P310-Y335 HydrophobicContact CB-CE2 3.9Å; P310-Y335 HydrophobicContact CG-CD1 4.4Å; P310-Y335 HydrophobicContact CG-CE1 3.64Å; Q312-Y335 HydrophobicContact CB-CD2 4.13Å; Q312-Y335 HydrophobicContact CB-CE2 4.36Å; Q312-Y335 HydrophobicContact CG-CD2 4.26Å; Q312-Y335 HydrophobicContact CG-CE2 4.16Å; Q312-Y335 VanDerWaalsContact OE1-CE2 3.24Å; S314-Y335 PolarHBondContact OG-N 3.47Å; V315-Y335 HydrophobicContact CG2-CD1 4.12Å; V315-Y335 HydrophobicContact CG2-CD2 3.73Å; V315-Y335 HydrophobicContact CG2-CE2 4.43Å; V315-Y335 HydrophobicContact CG2-CG 3.55Å; Y335-Q430 HydrophobicContact CD1-CB 4.48Å; Y335-Q430 PolarHBondContact O-OE1 3.43Å; Y335-Y432 CarbonylContact C-O 3.45Å; Y335-Y432 VanDerWaalsContact CA-O 3.27Å; Y335-Y432 WeakPolarHBondContact CA-O 3.47Å; Y335-Y432 WeakPolarHBondContact CB-O 3.4Å; Y335-Y432 WeakPolarHBondContact CD1-O 3.23Å; Y335-P433 HydrophobicContact CE1-CG 4.4Å; Y335-P433 HydrophobicContact CE2-CG 4.28Å; Y335-W458 HydrophobicContact CE2-CZ2 4.12Å
336	H	89.4	Confident	91.1	Very high	37 Å²	37	45 Å²	45	17%	0.171	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	126.9	173.5	-174.9	72.6	0	0	0	109.9	Y224 G225 A431 Y432 H434	Y224-H336 PolarHBondContact O-CD2 3.18Å; G225-H336 PolarHBondContact O-NE2 3.43Å; H336-A431 PolarHBondContact O-N 3.36Å; H336-Y432 PolarHBondContact N-O 2.98Å; H336-H434 HydrophobicContact CB-CB 4.49Å
337	G	89.3	Confident	91.6	Very high	24 Å²	24	39.7 Å²	39.7	25%	0.247	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	134.2	172.7	0	0	0	0	0	111.3	W429	G337-W429 CarbonylContact C-O 3.3Å; G337-W429 VanDerWaalsContact CA-O 3.3Å; G337-W429 WeakPolarHBondContact CA-O 3.29Å
338	T	90.1	Very high	92.1	Very high	7 Å²	7	36.5 Å²	36.5	4%	0.043	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.6	171.5	-62.4	0	0	0	0	108.8	F404 W429	T338-F404 HydrophobicContact CG2-CD1 3.76Å; T338-F404 HydrophobicContact CG2-CE1 4.08Å; T338-W429 PolarHBondContact N-O 2.96Å; T338-W429 PolarHBondContact O-N 3.1Å
339	V	95.8	Very high	92.7	Very high	7 Å²	7	34 Å²	34	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	126.9	178.2	-175.3	0	0	0	0	109.9	F404 S405 V426 E428	V339-F404 WeakPolarHBondContact O-CA 3.36Å; V339-S405 PolarHBondContact N-O 2.9Å; V339-S405 PolarHBondContact O-N 2.93Å; V339-V426 HydrophobicContact CG1-CG1 3.6Å; V339-E428 HydrophobicContact CG1-CG 4.39Å; V339-E428 HydrophobicContact CG2-CG 4.05Å
340	A	97.3	Very high	93.7	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	115.4	169.3	0	0	0	0	0	109.1	S86 F404 T427	S86-A340 VanDerWaalsContact O-CB 3.24Å; S86-A340 WeakPolarHBondContact O-CB 3.43Å; A340-F404 HydrophobicContact CB-CD1 4.18Å; A340-F404 HydrophobicContact CB-CE1 3.96Å; A340-T427 PolarHBondContact N-O 3.04Å; A340-T427 PolarHBondContact O-N 2.82Å
341	T	98.1	Very high	94.2	Very high	1 Å²	1	25 Å²	25	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114	174.1	-54.2	0	0	0	0	109.7	V343 K402 V403 L414 A424 Q425 V426	T341-V343 HydrophobicContact CG2-CG2 3.75Å; T341-K402 WeakPolarHBondContact O-CA 3.48Å; T341-V403 PolarHBondContact N-O 3.39Å; T341-V403 PolarHBondContact O-N 3.32Å; T341-L414 HydrophobicContact CG2-CD2 4.41Å; T341-A424 HydrophobicContact CG2-CB 4.16Å; T341-Q425 CarbonylContact C-O 3.59Å; T341-Q425 WeakPolarHBondContact CA-O 3.25Å; T341-V426 HydrophobicContact CG2-CG2 4.13Å
342	I	98.1	Very high	94.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	113.6	174.3	-55.4	-61.4	0	0	0	109.3	V77 V79 V400 Y401 K402 A424 Q425	V77-I342 HydrophobicContact CG2-CB 3.9Å; V77-I342 HydrophobicContact CG2-CG1 3.52Å; V77-I342 HydrophobicContact CG2-CG2 4.22Å; V79-I342 HydrophobicContact CG2-CG2 3.72Å; I342-V400 HydrophobicContact CG2-CG1 3.5Å; I342-V400 VanDerWaalsContact CG2-CG1 3.5Å; I342-Y401 CarbonylContact C-O 3.56Å; I342-Y401 VanDerWaalsContact CA-O 3.3Å; I342-Y401 WeakPolarHBondContact CA-O 3.24Å; I342-K402 HydrophobicContact CD1-CB 3.54Å; I342-K402 HydrophobicContact CD1-CD 3.92Å; I342-K402 HydrophobicContact CD1-CG 3.56Å; I342-A424 CarbonylContact O-C 3.57Å; I342-A424 WeakPolarHBondContact O-CA 3.42Å; I342-Q425 HydrophobicContact CB-CB 4.45Å; I342-Q425 PolarHBondContact N-O 3.38Å; I342-Q425 PolarHBondContact O-N 2.85Å
343	V	98	Very high	95	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.3	-174.6	-174	0	0	0	0	110.1	T341 V400 Y401 L414 F418 Y421 S423 A424	T341-V343 HydrophobicContact CG2-CG2 3.75Å; V343-V400 CarbonylContact O-C 3.54Å; V343-V400 WeakPolarHBondContact O-CA 3.2Å; V343-Y401 PolarHBondContact N-O 3.18Å; V343-Y401 PolarHBondContact O-N 3.15Å; V343-L414 HydrophobicContact CG2-CD2 4.05Å; V343-F418 HydrophobicContact CB-CE1 4.07Å; V343-F418 HydrophobicContact CB-CE2 3.98Å; V343-F418 HydrophobicContact CB-CZ 3.71Å; V343-F418 HydrophobicContact CG1-CD1 4.01Å; V343-F418 HydrophobicContact CG1-CD2 4.03Å; V343-F418 HydrophobicContact CG1-CE1 3.93Å; V343-F418 HydrophobicContact CG1-CE2 3.96Å; V343-F418 HydrophobicContact CG1-CG 4.07Å; V343-F418 HydrophobicContact CG1-CZ 3.9Å; V343-F418 HydrophobicContact CG2-CD2 4.46Å; V343-F418 HydrophobicContact CG2-CE2 3.77Å; V343-F418 HydrophobicContact CG2-CZ 3.92Å; V343-Y421 HydrophobicContact CG1-CG 4.05Å; V343-S423 WeakPolarHBondContact CA-O 3.25Å; V343-A424 HydrophobicContact CG2-CB 4.28Å
344	H	97.8	Very high	95.3	Very high	23 Å²	23	21.8 Å²	21.8	11%	0.106	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	109.9	168.1	176.9	-140.1	0	0	0	108.8	V79 N80 G399 Y421 Y422 S423	V79-H344 HydrophobicContact CG1-CB 3.73Å; N80-H344 PolarHBondContact ND2-CE1 3.23Å; N80-H344 PolarHBondContact ND2-ND1 3.43Å; N80-H344 PolarHBondContact ND2-NE2 3.25Å; N80-H344 VanDerWaalsContact ND2-NE2 3.17Å; H344-G399 CarbonylContact C-O 3.59Å; H344-G399 WeakPolarHBondContact CA-O 3.46Å; H344-G399 PolarHBondContact CD2-O 3.07Å; H344-Y421 CarbonylContact O-C 3.56Å; H344-Y421 WeakPolarHBondContact O-CA 3.47Å; H344-Y421 WeakPolarHBondContact O-CB 3.46Å; H344-Y422 AromaticContact CE1-CD2 3.37Å; H344-Y422 WeakPolarHBondContact CE1-CD2 3.45Å; H344-Y422 AromaticContact CE1-CE2 3.99Å; H344-Y422 AromaticContact ND1-CD2 3.55Å; H344-Y422 AromaticContact ND1-CG 3.97Å; H344-Y422 AromaticContact NE2-CD2 3.88Å; H344-Y422 PolarHBondContact O-N 2.91Å; H344-S423 PolarHBondContact N-O 2.98Å
345	G	97	Very high	95.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-163.5	-172.4	0	0	0	0	0	115.2	A398 G399 Y401 S420	G345-A398 WeakPolarHBondContact O-CA 3.47Å; G345-G399 PolarHBondContact N-O 3.06Å; G345-G399 PolarHBondContact O-N 3.48Å; G345-Y401 WeakPolarHBondContact O-CE2 3.32Å; G345-S420 WeakPolarHBondContact CA-O 3.47Å
346	Y	97.3	Very high	95.5	Very high	69 Å²	69	26 Å²	26	27%	0.271	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	113.2	179	-61.4	-94.2	0	0	0	109.6	N348 Q396 A398 F418 R419 S420 Y422	Y346-N348 PolarHBondContact O-N 3.19Å; Y346-Q396 WeakPolarHBondContact CE1-O 3.47Å; Y346-A398 HydrophobicContact CE1-CB 4.29Å; Y346-A398 HydrophobicContact CE2-CB 4.06Å; Y346-F418 CarbonylContact O-C 3.45Å; Y346-F418 VanDerWaalsContact O-CA 3.32Å; Y346-F418 WeakPolarHBondContact O-CA 3.44Å; Y346-R419 PolarHBondContact O-N 3.26Å; Y346-S420 VanDerWaalsContact CD2-OG 3.27Å; Y346-S420 WeakPolarHBondContact CD2-OG 3.29Å; Y346-S420 PolarHBondContact N-O 3.46Å; Y346-Y422 AromaticContact CE2-CE2 3.9Å; Y346-Y422 HydrophobicContact CE2-CE2 3.9Å; Y346-Y422 AromaticContact CE2-CZ 4Å; Y346-Y422 PolarHBondContact OH-OH 2.89Å
347	L	97.1	Very high	95.7	Very high	4 Å²	4	25 Å²	25	2%	0.021	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	135.6	178.2	-170.5	71.8	0	0	0	110.6	T349 F352 F360 V378 Y401 L417 F418	L347-T349 VanDerWaalsContact C-N 3.34Å; L347-T349 PolarHBondContact O-N 3.17Å; L347-F352 HydrophobicContact CD1-CE2 4.15Å; L347-F352 HydrophobicContact CD2-CE2 4.12Å; L347-F352 HydrophobicContact CG-CE2 4.17Å; L347-F360 HydrophobicContact CD2-CE1 3.8Å; L347-F360 HydrophobicContact CD2-CZ 3.79Å; L347-V378 HydrophobicContact CD1-CG2 3.88Å; L347-Y401 HydrophobicContact CB-CE1 3.88Å; L347-Y401 HydrophobicContact CB-CE2 4.27Å; L347-Y401 HydrophobicContact CD1-CD1 4.37Å; L347-Y401 HydrophobicContact CD1-CE1 4.4Å; L347-Y401 HydrophobicContact CD2-CE1 4.01Å; L347-Y401 HydrophobicContact CG-CE1 4.33Å; L347-L417 WeakPolarHBondContact CD1-O 3.39Å; L347-F418 HydrophobicContact CD1-CD1 4.3Å; L347-F418 HydrophobicContact CD1-CE1 3.89Å; L347-F418 HydrophobicContact CD1-CZ 4.29Å
348	N	97.1	Very high	95.9	Very high	33 Å²	33	32.7 Å²	32.7	18%	0.176	18%	0.175	C	C	.	.			trans	-80.5	82.3	172.1	-173.1	16.2	0	0	0	110.4	Y346 S350 F351 T416 L417 R419	Y346-N348 PolarHBondContact O-N 3.19Å; N348-S350 PolarHBondContact O-N 3.23Å; N348-S350 VanDerWaalsContact O-N 3.13Å; N348-F351 VanDerWaalsContact O-CB 3.27Å; N348-F351 WeakPolarHBondContact O-CB 3.31Å; N348-F351 PolarHBondContact O-N 3.36Å; N348-F351 VanDerWaalsContact O-N 3.08Å; N348-T416 WeakPolarHBondContact CB-O 3.45Å; N348-T416 PolarHBondContact ND2-O 2.85Å; N348-L417 WeakPolarHBondContact CB-O 3.31Å; N348-L417 PolarHBondContact N-O 3.43Å; N348-R419 HydrophobicContact CB-CG 3.93Å
349	T	96.8	Very high	96	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-60.4	-24.4	-179.8	61.8	0	0	0	0	113.2	L347 F351 F352 F354 P357 F360 P395	L347-T349 VanDerWaalsContact C-N 3.34Å; L347-T349 PolarHBondContact O-N 3.17Å; T349-F351 PolarHBondContact O-N 2.72Å; T349-F352 PolarHBondContact O-N 3.35Å; T349-F354 CarbonylContact C-O 3.49Å; T349-F354 WeakPolarHBondContact CB-O 3.38Å; T349-F354 PolarHBondContact O-N 3.22Å; T349-F354 VanDerWaalsContact O-N 3.07Å; T349-F354 PolarHBondContact OG1-O 3.04Å; T349-P357 HydrophobicContact CG2-CB 4.04Å; T349-P357 WeakPolarHBondContact OG1-CA 3.37Å; T349-F360 HydrophobicContact CG2-CB 3.69Å; T349-F360 HydrophobicContact CG2-CD1 4.03Å; T349-F360 HydrophobicContact CG2-CD2 3.93Å; T349-F360 HydrophobicContact CG2-CG 3.62Å; T349-P395 HydrophobicContact CG2-CB 3.64Å; T349-P395 HydrophobicContact CG2-CG 4.15Å
350	S	96.2	Very high	95.9	Very high	50 Å²	50	38.3 Å²	38.3	35%	0.35	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-66.3	-26.5	178.5	-48.1	0	0	0	0	112.4	N348 F352 G353 F354 R419	N348-S350 PolarHBondContact O-N 3.23Å; N348-S350 VanDerWaalsContact O-N 3.13Å; S350-F352 PolarHBondContact O-N 2.96Å; S350-G353 PolarHBondContact O-N 3Å; S350-F354 WeakPolarHBondContact CA-O 3.22Å; S350-F354 PolarHBondContact N-O 3.27Å; S350-F354 VanDerWaalsContact N-O 3.16Å; S350-R419 PolarHBondContact OG-NH2 3.3Å
351	F	95.3	Very high	95.7	Very high	52 Å²	52	41.4 Å²	41.4	23%	0.228	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-61.5	-29.5	171.6	179.7	-98.9	0	0	0	112.3	F120 N348 T349 L373 F375 T416 L417	F120-F351 HydrophobicContact CD1-CE1 4.38Å; F120-F351 HydrophobicContact CE1-CD1 4.26Å; F120-F351 AromaticContact CE1-CE1 3.59Å; F120-F351 HydrophobicContact CE1-CE1 3.59Å; F120-F351 HydrophobicContact CE1-CZ 4.06Å; F120-F351 HydrophobicContact CZ-CE1 4.17Å; F120-F351 WeakPolarHBondContact CZ-O 3.31Å; N348-F351 VanDerWaalsContact O-CB 3.27Å; N348-F351 WeakPolarHBondContact O-CB 3.31Å; N348-F351 PolarHBondContact O-N 3.36Å; N348-F351 VanDerWaalsContact O-N 3.08Å; T349-F351 PolarHBondContact O-N 2.72Å; F351-L373 HydrophobicContact CZ-CD2 4.43Å; F351-F375 AromaticContact CE1-CE1 3.77Å; F351-F375 HydrophobicContact CE1-CE1 3.77Å; F351-F375 AromaticContact CE1-CZ 3.96Å; F351-F375 HydrophobicContact CE1-CZ 3.96Å; F351-F375 HydrophobicContact CZ-CE1 4.13Å; F351-T416 HydrophobicContact CD2-CG2 3.5Å; F351-T416 VanDerWaalsContact CD2-CG2 3.5Å; F351-T416 HydrophobicContact CE2-CG2 3.43Å; F351-T416 VanDerWaalsContact CE2-CG2 3.43Å; F351-T416 HydrophobicContact CG-CG2 4.43Å; F351-T416 HydrophobicContact CZ-CG2 4.32Å; F351-L417 HydrophobicContact CD1-CD2 3.97Å; F351-L417 HydrophobicContact CE1-CD2 3.89Å
352	F	95.9	Very high	95.5	Very high	1 Å²	1	42 Å²	42	0%	0.004	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-95.7	13.7	179.3	-55.3	-73.4	0	0	0	113	F120 L347 T349 S350 F354 F360 V365 F375 V378 L417	F120-F352 HydrophobicContact CB-CD1 4.38Å; F120-F352 HydrophobicContact CD1-CD1 4.03Å; F120-F352 HydrophobicContact CD1-CE1 4.2Å; F120-F352 HydrophobicContact CD2-CD1 4.15Å; F120-F352 HydrophobicContact CE1-CD1 4.3Å; F120-F352 HydrophobicContact CE2-CD1 4.45Å; F120-F352 AromaticContact CG-CD1 3.94Å; F120-F352 HydrophobicContact CG-CD1 3.94Å; F120-F352 HydrophobicContact CG-CE1 4.46Å; L347-F352 HydrophobicContact CD1-CE2 4.15Å; L347-F352 HydrophobicContact CD2-CE2 4.12Å; L347-F352 HydrophobicContact CG-CE2 4.17Å; T349-F352 PolarHBondContact O-N 3.35Å; S350-F352 PolarHBondContact O-N 2.96Å; F352-F354 HydrophobicContact CB-CD2 4.2Å; F352-F354 WeakPolarHBondContact O-CD2 3.4Å; F352-F354 WeakPolarHBondContact O-CE2 3.33Å; F352-F360 HydrophobicContact CB-CE2 4.05Å; F352-F360 AromaticContact CD2-CE2 3.91Å; F352-F360 HydrophobicContact CD2-CE2 3.91Å; F352-F360 HydrophobicContact CD2-CZ 4.37Å; F352-F360 HydrophobicContact CG-CE2 4.15Å; F352-V365 HydrophobicContact CD1-CG1 3.87Å; F352-V365 HydrophobicContact CD1-CG2 4.48Å; F352-V365 HydrophobicContact CE1-CB 4.25Å; F352-V365 HydrophobicContact CE1-CG1 3.78Å; F352-V365 HydrophobicContact CE1-CG2 4.47Å; F352-F375 HydrophobicContact CE1-CE2 4.49Å; F352-F375 AromaticContact CE1-CZ 3.99Å; F352-F375 HydrophobicContact CE1-CZ 3.99Å; F352-F375 HydrophobicContact CZ-CZ 4.35Å; F352-V378 HydrophobicContact CE1-CG1 4.27Å; F352-V378 HydrophobicContact CE2-CG1 4.3Å; F352-V378 HydrophobicContact CZ-CG1 3.59Å; F352-L417 HydrophobicContact CZ-CD2 4.12Å
353	G	95.5	Very high	95.4	Very high	53 Å²	53	42.7 Å²	42.7	55%	0.546	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	13.9	-178.1	0	0	0	0	0	115.1	S350 P355	S350-G353 PolarHBondContact O-N 3Å; G353-P355 VanDerWaalsContact O-CD 3.27Å; G353-P355 WeakPolarHBondContact O-CD 3.43Å
354	F	95.8	Very high	95.3	Very high	37 Å²	37	43.8 Å²	43.8	16%	0.162	24%	0.239	C	C	.	.			trans	-114.3	86.3	177.1	-63.9	-96.9	0	0	0	111.4	V125 T349 S350 F352 D356 L359 F360 F362	V125-F354 HydrophobicContact CG2-CE2 3.99Å; T349-F354 CarbonylContact C-O 3.49Å; T349-F354 WeakPolarHBondContact CB-O 3.38Å; T349-F354 PolarHBondContact O-N 3.22Å; T349-F354 VanDerWaalsContact O-N 3.07Å; T349-F354 PolarHBondContact OG1-O 3.04Å; S350-F354 WeakPolarHBondContact CA-O 3.22Å; S350-F354 PolarHBondContact N-O 3.27Å; S350-F354 VanDerWaalsContact N-O 3.16Å; F352-F354 HydrophobicContact CB-CD2 4.2Å; F352-F354 WeakPolarHBondContact O-CD2 3.4Å; F352-F354 WeakPolarHBondContact O-CE2 3.33Å; F354-D356 VanDerWaalsContact C-N 3.3Å; F354-D356 PolarHBondContact O-N 3.06Å; F354-L359 HydrophobicContact CD1-CB 4.15Å; F354-L359 WeakPolarHBondContact CD1-O 3.43Å; F354-L359 WeakPolarHBondContact CE1-O 3.31Å; F354-F360 HydrophobicContact CB-CB 4.25Å; F354-F360 HydrophobicContact CB-CD2 4.2Å; F354-F360 AromaticContact CD2-CD2 3.74Å; F354-F360 HydrophobicContact CD2-CD2 3.74Å; F354-F360 HydrophobicContact CD2-CE2 4.37Å; F354-F360 HydrophobicContact CE2-CD2 4.34Å; F354-F360 HydrophobicContact CG-CB 4.31Å; F354-F360 AromaticContact CG-CD2 3.96Å; F354-F360 HydrophobicContact CG-CD2 3.96Å; F354-F362 HydrophobicContact CE1-CE2 4.45Å; F354-F362 AromaticContact CE2-CE2 3.9Å; F354-F362 HydrophobicContact CE2-CE2 3.9Å; F354-F362 AromaticContact CZ-CE2 3.67Å; F354-F362 HydrophobicContact CZ-CE2 3.67Å; F354-F362 HydrophobicContact CZ-CZ 4.32Å
355	P	94.4	Very high	95.3	Very high	103 Å²	103	42.7 Å²	42.7	67%	0.669	23%	0.234	S	C	*	.	S	Bend	trans	-56.9	-42.8	178.4	-26.1	34.4	0	0	0	112.9	G353 P357 R419	G353-P355 VanDerWaalsContact O-CD 3.27Å; G353-P355 WeakPolarHBondContact O-CD 3.43Å; P355-P357 WeakPolarHBondContact O-CD 3.08Å; P355-R419 PolarHBondContact O-NH2 3.12Å
356	D	94.3	Very high	95.3	Very high	44 Å²	44	43.7 Å²	43.7	24%	0.235	24%	0.239	C	C	.	.	S	Bend	trans	-88.4	111.8	173	-173.2	-9.4	0	0	0	110.3	F354 R358 L359	F354-D356 VanDerWaalsContact C-N 3.3Å; F354-D356 PolarHBondContact O-N 3.06Å; D356-R358 PolarHBondContact O-N 3.38Å; D356-R358 VanDerWaalsContact OD1-CB 3.29Å; D356-R358 WeakPolarHBondContact OD1-CB 3.24Å; D356-R358 WeakPolarHBondContact OD1-CG 3.48Å; D356-R358 IonicContact OD1-CZ 3.16Å; D356-R358 PolarHBondContact OD1-N 3.42Å; D356-R358 IonicContact OD1-NE 2.7Å; D356-R358 PolarHBondContact OD1-NE 3.1Å; D356-R358 IonicContact OD1-NH2 2.79Å; D356-R358 IonicContact OD2-CZ 3.65Å; D356-R358 VanDerWaalsContact OD2-CZ 3.22Å; D356-R358 IonicContact OD2-NE 3.25Å; D356-R358 PolarHBondContact OD2-NE 2.98Å; D356-R358 IonicContact OD2-NH2 3.6Å; D356-R358 PolarHBondContact OD2-NH2 3.29Å; D356-L359 HydrophobicContact CB-CD1 4.21Å; D356-L359 HydrophobicContact CB-CG 4.23Å; D356-L359 PolarHBondContact O-N 3.11Å; D356-L359 VanDerWaalsContact O-N 3.08Å
357	P	92.9	Very high	95.3	Very high	16 Å²	16	40.4 Å²	40.4	10%	0.104	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-61.8	-18.4	-179.9	-18.6	30.8	0	0	0	113.6	T349 P355 L359 F360 P395 Q396 R419	T349-P357 HydrophobicContact CG2-CB 4.04Å; T349-P357 WeakPolarHBondContact OG1-CA 3.37Å; P355-P357 WeakPolarHBondContact O-CD 3.08Å; P357-L359 PolarHBondContact O-N 3.16Å; P357-F360 PolarHBondContact O-N 3.21Å; P357-P395 HydrophobicContact CB-CB 3.89Å; P357-Q396 HydrophobicContact CB-CG 4.25Å; P357-Q396 PolarHBondContact O-NE2 3.05Å; P357-R419 VanDerWaalsContact CG-NH1 3.33Å
358	R	92.2	Very high	95.2	Very high	187 Å²	187	40.8 Å²	40.8	71%	0.706	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-67.5	-22.2	177.4	-63.8	173.5	-66.4	-175.9	3.7	112.9	D356 Q396	D356-R358 PolarHBondContact O-N 3.38Å; D356-R358 VanDerWaalsContact OD1-CB 3.29Å; D356-R358 WeakPolarHBondContact OD1-CB 3.24Å; D356-R358 WeakPolarHBondContact OD1-CG 3.48Å; D356-R358 IonicContact OD1-CZ 3.16Å; D356-R358 PolarHBondContact OD1-N 3.42Å; D356-R358 IonicContact OD1-NE 2.7Å; D356-R358 PolarHBondContact OD1-NE 3.1Å; D356-R358 IonicContact OD1-NH2 2.79Å; D356-R358 IonicContact OD2-CZ 3.65Å; D356-R358 VanDerWaalsContact OD2-CZ 3.22Å; D356-R358 IonicContact OD2-NE 3.25Å; D356-R358 PolarHBondContact OD2-NE 2.98Å; D356-R358 IonicContact OD2-NH2 3.6Å; D356-R358 PolarHBondContact OD2-NH2 3.29Å; R358-Q396 HydrophobicContact CG-CG 4.28Å; R358-Q396 VanDerWaalsContact CG-NE2 3.34Å
359	L	92.9	Very high	94.7	Very high	120 Å²	120	44.5 Å²	44.5	63%	0.628	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-91.3	-0.5	178.5	-59	-179.7	0	0	0	112.7	F354 D356 P357 P361	F354-L359 HydrophobicContact CD1-CB 4.15Å; F354-L359 WeakPolarHBondContact CD1-O 3.43Å; F354-L359 WeakPolarHBondContact CE1-O 3.31Å; D356-L359 HydrophobicContact CB-CD1 4.21Å; D356-L359 HydrophobicContact CB-CG 4.23Å; D356-L359 PolarHBondContact O-N 3.11Å; D356-L359 VanDerWaalsContact O-N 3.08Å; P357-L359 PolarHBondContact O-N 3.16Å; L359-P361 VanDerWaalsContact O-CD 3.22Å; L359-P361 WeakPolarHBondContact O-CD 3.42Å
360	F	94.5	Very high	94.2	Very high	11 Å²	11	46.1 Å²	46.1	5%	0.048	26%	0.255	C	S	.	.			trans	-93.6	104.8	179	-174.8	-85.2	0	0	0	110.2	L347 T349 F352 F354 P357 F362 V365 P395	L347-F360 HydrophobicContact CD2-CE1 3.8Å; L347-F360 HydrophobicContact CD2-CZ 3.79Å; T349-F360 HydrophobicContact CG2-CB 3.69Å; T349-F360 HydrophobicContact CG2-CD1 4.03Å; T349-F360 HydrophobicContact CG2-CD2 3.93Å; T349-F360 HydrophobicContact CG2-CG 3.62Å; F352-F360 HydrophobicContact CB-CE2 4.05Å; F352-F360 AromaticContact CD2-CE2 3.91Å; F352-F360 HydrophobicContact CD2-CE2 3.91Å; F352-F360 HydrophobicContact CD2-CZ 4.37Å; F352-F360 HydrophobicContact CG-CE2 4.15Å; F354-F360 HydrophobicContact CB-CB 4.25Å; F354-F360 HydrophobicContact CB-CD2 4.2Å; F354-F360 AromaticContact CD2-CD2 3.74Å; F354-F360 HydrophobicContact CD2-CD2 3.74Å; F354-F360 HydrophobicContact CD2-CE2 4.37Å; F354-F360 HydrophobicContact CE2-CD2 4.34Å; F354-F360 HydrophobicContact CG-CB 4.31Å; F354-F360 AromaticContact CG-CD2 3.96Å; F354-F360 HydrophobicContact CG-CD2 3.96Å; P357-F360 PolarHBondContact O-N 3.21Å; F360-F362 HydrophobicContact CD2-CD2 4.09Å; F360-F362 HydrophobicContact CE1-CB 3.94Å; F360-F362 HydrophobicContact CE1-CD2 4.45Å; F360-F362 VanDerWaalsContact CE1-O 3.25Å; F360-F362 WeakPolarHBondContact CE1-O 3.39Å; F360-F362 AromaticContact CE2-CD2 3.85Å; F360-F362 HydrophobicContact CE2-CD2 3.85Å; F360-F362 HydrophobicContact CZ-CB 3.99Å; F360-F362 HydrophobicContact CZ-CD2 4.05Å; F360-V365 HydrophobicContact CE2-CG2 4.19Å; F360-V365 HydrophobicContact CZ-CG2 3.67Å; F360-P395 HydrophobicContact CB-CG 4.13Å; F360-P395 HydrophobicContact CD1-CG 3.65Å; F360-P395 HydrophobicContact CG-CG 4.28Å
361	P	91.9	Very high	93.5	Very high	66 Å²	66	50.6 Å²	50.6	43%	0.429	28%	0.283	S	S	.	.			trans	-98.7	-0.7	-172.2	40.4	-34.5	0	0	0	113.2	K116 L359	K116-P361 HydrophobicContact CD-CB 4.26Å; L359-P361 VanDerWaalsContact O-CD 3.22Å; L359-P361 WeakPolarHBondContact O-CD 3.42Å
362	F	95.3	Very high	92.9	Very high	13 Å²	13	51.9 Å²	51.9	6%	0.057	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	136.1	-167.4	-49.8	-62.1	0	0	0	112.1	K116 A118 E128 F354 F360 V365	K116-F362 HydrophobicContact CB-CD1 4.02Å; K116-F362 CarbonylContact O-C 3.56Å; K116-F362 WeakPolarHBondContact O-CA 3.48Å; A118-F362 HydrophobicContact CB-CB 4.4Å; A118-F362 HydrophobicContact CB-CD1 3.69Å; A118-F362 HydrophobicContact CB-CD2 3.75Å; A118-F362 HydrophobicContact CB-CE1 3.85Å; A118-F362 HydrophobicContact CB-CE2 3.89Å; A118-F362 HydrophobicContact CB-CG 3.66Å; A118-F362 HydrophobicContact CB-CZ 3.96Å; E128-F362 HydrophobicContact CB-CE1 3.91Å; E128-F362 HydrophobicContact CB-CZ 3.97Å; E128-F362 HydrophobicContact CG-CE1 4.05Å; E128-F362 HydrophobicContact CG-CZ 3.59Å; F354-F362 HydrophobicContact CE1-CE2 4.45Å; F354-F362 AromaticContact CE2-CE2 3.9Å; F354-F362 HydrophobicContact CE2-CE2 3.9Å; F354-F362 AromaticContact CZ-CE2 3.67Å; F354-F362 HydrophobicContact CZ-CE2 3.67Å; F354-F362 HydrophobicContact CZ-CZ 4.32Å; F360-F362 HydrophobicContact CD2-CD2 4.09Å; F360-F362 HydrophobicContact CE1-CB 3.94Å; F360-F362 HydrophobicContact CE1-CD2 4.45Å; F360-F362 VanDerWaalsContact CE1-O 3.25Å; F360-F362 WeakPolarHBondContact CE1-O 3.39Å; F360-F362 AromaticContact CE2-CD2 3.85Å; F360-F362 HydrophobicContact CE2-CD2 3.85Å; F360-F362 HydrophobicContact CZ-CB 3.99Å; F360-F362 HydrophobicContact CZ-CD2 4.05Å; F362-V365 HydrophobicContact CB-CG2 4.4Å
363	A	94.8	Very high	92.7	Very high	15 Å²	15	52.6 Å²	52.6	12%	0.124	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-25.8	167.5	0	0	0	0	0	111.5	K116 A379 S380	K116-A363 PolarHBondContact O-N 3.23Å; A363-A379 CarbonylContact O-C 3.54Å; A363-A379 VanDerWaalsContact O-CA 3.27Å; A363-A379 WeakPolarHBondContact O-CA 3.3Å; A363-S380 PolarHBondContact O-N 3.06Å
364	S	95.6	Very high	92.7	Very high	22 Å²	22	52.2 Å²	52.2	15%	0.154	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.3	179.5	-171.3	0	0	0	0	111.1	K116 T117 A118 V378	K116-S364 PolarHBondContact O-N 3.13Å; K116-S364 VanDerWaalsContact O-N 3.13Å; T117-S364 CarbonylContact C-O 3.56Å; T117-S364 WeakPolarHBondContact CA-O 3.37Å; A118-S364 PolarHBondContact N-O 2.87Å; S364-V378 CarbonylContact C-O 3.47Å; S364-V378 WeakPolarHBondContact CA-O 3.39Å
365	V	97.6	Very high	92.7	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.2	170.3	-176.2	0	0	0	0	108.1	A118 F120 F352 F360 F362 S377 V378	A118-V365 WeakPolarHBondContact O-CA 3.43Å; F120-V365 HydrophobicContact CB-CG1 3.59Å; F352-V365 HydrophobicContact CD1-CG1 3.87Å; F352-V365 HydrophobicContact CD1-CG2 4.48Å; F352-V365 HydrophobicContact CE1-CB 4.25Å; F352-V365 HydrophobicContact CE1-CG1 3.78Å; F352-V365 HydrophobicContact CE1-CG2 4.47Å; F360-V365 HydrophobicContact CE2-CG2 4.19Å; F360-V365 HydrophobicContact CZ-CG2 3.67Å; F362-V365 HydrophobicContact CB-CG2 4.4Å; V365-S377 CarbonylContact O-C 3.56Å; V365-S377 VanDerWaalsContact O-CA 3.23Å; V365-S377 WeakPolarHBondContact O-CA 3.37Å; V365-S377 WeakPolarHBondContact O-CB 3.25Å; V365-V378 HydrophobicContact CB-CG1 3.97Å; V365-V378 HydrophobicContact CG2-CG1 4.46Å; V365-V378 PolarHBondContact N-O 3.04Å; V365-V378 PolarHBondContact O-N 2.85Å
366	L	97.4	Very high	92.8	Very high	20 Å²	20	45.6 Å²	45.6	11%	0.105	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	158.6	173.7	-47.6	-174.7	0	0	0	109.7	T117 A118 V119 F120 P218 V222	T117-L366 HydrophobicContact CG2-CD1 3.99Å; T117-L366 HydrophobicContact CG2-CG 3.82Å; A118-L366 PolarHBondContact O-N 2.97Å; V119-L366 WeakPolarHBondContact CA-O 3.34Å; F120-L366 PolarHBondContact N-O 3.47Å; P218-L366 HydrophobicContact CB-CB 3.77Å; P218-L366 HydrophobicContact CB-CD1 4.23Å; V222-L366 HydrophobicContact CB-CD2 3.99Å; V222-L366 HydrophobicContact CG1-CD1 4.37Å; V222-L366 HydrophobicContact CG1-CD2 4.09Å; V222-L366 HydrophobicContact CG2-CD2 4.04Å
367	T	96.7	Very high	92.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.3	-179.7	61.3	0	0	0	0	112.1	F120 P218 R221 L373 F375 N376	F120-T367 WeakPolarHBondContact O-CA 3.47Å; P218-T367 WeakPolarHBondContact CA-O 3.35Å; R221-T367 WeakPolarHBondContact CD-O 3.43Å; R221-T367 PolarHBondContact NE-O 3.5Å; R221-T367 PolarHBondContact NE-OG1 3.5Å; R221-T367 PolarHBondContact NH2-OG1 3.21Å; T367-L373 HydrophobicContact CG2-CD1 3.87Å; T367-F375 HydrophobicContact CG2-CD2 3.96Å; T367-F375 HydrophobicContact CG2-CE1 4.33Å; T367-F375 HydrophobicContact CG2-CE2 3.42Å; T367-F375 VanDerWaalsContact CG2-CE2 3.42Å; T367-F375 HydrophobicContact CG2-CZ 3.62Å; T367-F375 PolarHBondContact OG1-O 2.83Å; T367-N376 PolarHBondContact N-O 3.38Å; T367-N376 VanDerWaalsContact N-O 3.12Å; T367-N376 VanDerWaalsContact OG1-C 3.28Å; T367-N376 WeakPolarHBondContact OG1-CA 3.4Å; T367-N376 PolarHBondContact OG1-O 3.25Å
368	T	94.9	Very high	93.1	Very high	13 Å²	13	43 Å²	43	8%	0.08	23%	0.232	C	C	.	.			trans	-71.1	168	164.6	57.6	0	0	0	0	110.9	V119 F120 N121 I126 P218 R221 T370	V119-T368 HydrophobicContact CG1-CG2 3.82Å; F120-T368 PolarHBondContact O-N 3.23Å; N121-T368 VanDerWaalsContact CA-OG1 3.31Å; N121-T368 WeakPolarHBondContact CA-OG1 3.44Å; N121-T368 HydrophobicContact CB-CG2 4.3Å; I126-T368 HydrophobicContact CD1-CG2 3.79Å; P218-T368 HydrophobicContact CG-CG2 4.17Å; R221-T368 PolarHBondContact NE-O 2.75Å; T368-T370 PolarHBondContact O-N 2.8Å; T368-T370 VanDerWaalsContact O-N 3.16Å; T368-T370 PolarHBondContact OG1-OG1 3.07Å; T368-T370 VanDerWaalsContact OG1-OG1 3.14Å
369	E	88.2	Confident	93.3	Very high	110 Å²	110	35.2 Å²	35.2	51%	0.514	21%	0.207	S	C	.	.	S	Bend	trans	-71.2	106.2	170.4	-177.3	174.9	-172.9	0	0	109.6	N227	N227-E369 VanDerWaalsContact CB-OE2 3.24Å; N227-E369 WeakPolarHBondContact CB-OE2 3.34Å; N227-E369 PolarHBondContact ND2-OE1 3.3Å; N227-E369 PolarHBondContact ND2-OE2 2.68Å
370	T	86.8	Confident	93.4	Very high	35 Å²	35	30.2 Å²	30.2	22%	0.215	18%	0.182	C	C	.	.			trans	-145.7	127	179.4	-48.1	0	0	0	0	109.8	T368 S372 L373	T368-T370 PolarHBondContact O-N 2.8Å; T368-T370 VanDerWaalsContact O-N 3.16Å; T368-T370 PolarHBondContact OG1-OG1 3.07Å; T368-T370 VanDerWaalsContact OG1-OG1 3.14Å; T370-S372 VanDerWaalsContact CG2-OG 3.31Å; T370-S372 WeakPolarHBondContact CG2-OG 3.37Å; T370-S372 PolarHBondContact O-N 3.24Å; T370-L373 PolarHBondContact O-N 3.36Å
371	P	80.8	Confident	93.5	Very high	144 Å²	144	31.2 Å²	31.2	94%	0.935	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.1	-175.9	-27.2	34.9	0	0	0	115.1	L373	P371-L373 VanDerWaalsContact C-N 3.32Å
372	S	83.3	Confident	93.6	Very high	78 Å²	78	28.6 Å²	28.6	55%	0.545	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-16.9	178.7	55.6	0	0	0	0	113.8	S122 T370	S122-S372 VanDerWaalsContact CB-OG 3.31Å; S122-S372 WeakPolarHBondContact CB-OG 3.47Å; S122-S372 PolarHBondContact OG-OG 2.85Å; T370-S372 VanDerWaalsContact CG2-OG 3.31Å; T370-S372 WeakPolarHBondContact CG2-OG 3.37Å; T370-S372 PolarHBondContact O-N 3.24Å
373	L	91.5	Very high	93.6	Very high	17 Å²	17	28.2 Å²	28.2	9%	0.089	17%	0.171	C	C	.	.			trans	-93.9	120.6	-175.9	-68	175.3	0	0	0	111.8	F120 F351 T367 T370 P371 F375	F120-L373 HydrophobicContact CD1-CD2 4.28Å; F120-L373 HydrophobicContact CE1-CD2 3.98Å; F351-L373 HydrophobicContact CZ-CD2 4.43Å; T367-L373 HydrophobicContact CG2-CD1 3.87Å; T370-L373 PolarHBondContact O-N 3.36Å; P371-L373 VanDerWaalsContact C-N 3.32Å; L373-F375 HydrophobicContact CD2-CE1 3.93Å
374	F	94.3	Very high	93.7	Very high	45 Å²	45	27.5 Å²	27.5	20%	0.197	17%	0.166	C	C	.	.			trans	-89.3	2.6	-180	57.5	-97	0	0	0	114.1	S405 L409 Q413 T416 L417	F374-S405 WeakPolarHBondContact O-CB 3.47Å; F374-L409 HydrophobicContact CD2-CD2 3.66Å; F374-L409 HydrophobicContact CE2-CD2 4.11Å; F374-Q413 VanDerWaalsContact CB-NE2 3.34Å; F374-Q413 HydrophobicContact CD1-CG 4.12Å; F374-Q413 HydrophobicContact CD2-CB 3.83Å; F374-Q413 HydrophobicContact CD2-CG 3.8Å; F374-Q413 HydrophobicContact CE1-CB 4.48Å; F374-Q413 HydrophobicContact CE1-CG 4.27Å; F374-Q413 HydrophobicContact CE2-CB 3.56Å; F374-Q413 HydrophobicContact CE2-CG 3.96Å; F374-Q413 HydrophobicContact CG-CB 4.39Å; F374-Q413 HydrophobicContact CG-CG 3.88Å; F374-Q413 HydrophobicContact CZ-CB 3.91Å; F374-Q413 HydrophobicContact CZ-CG 4.19Å; F374-T416 HydrophobicContact CE1-CG2 4.28Å; F374-T416 HydrophobicContact CZ-CG2 4.23Å; F374-L417 HydrophobicContact CE2-CD1 3.73Å; F374-L417 HydrophobicContact CE2-CG 3.92Å; F374-L417 HydrophobicContact CZ-CD1 4.2Å; F374-L417 HydrophobicContact CZ-CD2 4.32Å; F374-L417 HydrophobicContact CZ-CG 3.87Å
375	F	96.1	Very high	93.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.179	C	C	.	.			trans	-137.5	157.6	-178.9	72.1	-77.1	0	0	0	110.7	R221 F351 F352 T367 L373 V378 V403 L417	R221-F375 PolarHBondContact NH2-O 3.23Å; F351-F375 AromaticContact CE1-CE1 3.77Å; F351-F375 HydrophobicContact CE1-CE1 3.77Å; F351-F375 AromaticContact CE1-CZ 3.96Å; F351-F375 HydrophobicContact CE1-CZ 3.96Å; F351-F375 HydrophobicContact CZ-CE1 4.13Å; F352-F375 HydrophobicContact CE1-CE2 4.49Å; F352-F375 AromaticContact CE1-CZ 3.99Å; F352-F375 HydrophobicContact CE1-CZ 3.99Å; F352-F375 HydrophobicContact CZ-CZ 4.35Å; T367-F375 HydrophobicContact CG2-CD2 3.96Å; T367-F375 HydrophobicContact CG2-CE1 4.33Å; T367-F375 HydrophobicContact CG2-CE2 3.42Å; T367-F375 VanDerWaalsContact CG2-CE2 3.42Å; T367-F375 HydrophobicContact CG2-CZ 3.62Å; T367-F375 PolarHBondContact OG1-O 2.83Å; L373-F375 HydrophobicContact CD2-CE1 3.93Å; F375-V378 HydrophobicContact CE2-CG1 4.22Å; F375-V403 HydrophobicContact CB-CG1 3.85Å; F375-V403 HydrophobicContact CD2-CG1 4.38Å; F375-V403 HydrophobicContact CG-CG1 4.38Å; F375-L417 HydrophobicContact CD1-CD1 4.21Å; F375-L417 HydrophobicContact CD1-CD2 4.1Å; F375-L417 HydrophobicContact CE1-CD2 3.75Å; F375-L417 HydrophobicContact CG-CD1 4.22Å; F375-L417 HydrophobicContact CZ-CD2 3.98Å
376	N	95.7	Very high	93.5	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	18%	0.184	C	C	.	.	S	Bend	trans	-95.9	-39.1	-178.7	-62.6	-20.5	0	0	0	111.5	R221 T367 F404	R221-N376 HydrophobicContact CB-CB 4.33Å; R221-N376 PolarHBondContact NH2-OD1 2.68Å; R221-N376 VanDerWaalsContact NH2-OD1 3.15Å; R221-N376 WeakPolarHBondContact O-CB 3.25Å; T367-N376 PolarHBondContact N-O 3.38Å; T367-N376 VanDerWaalsContact N-O 3.12Å; T367-N376 VanDerWaalsContact OG1-C 3.28Å; T367-N376 WeakPolarHBondContact OG1-CA 3.4Å; T367-N376 PolarHBondContact OG1-O 3.25Å; N376-F404 HydrophobicContact CB-CB 4.25Å; N376-F404 PolarHBondContact N-O 3.27Å
377	S	97.1	Very high	93.1	Very high	2 Å²	2	34 Å²	34	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	159.9	175.5	60.4	0	0	0	0	112.3	V222 V365 V403 F404	V222-S377 WeakPolarHBondContact CG2-OG 3.41Å; V365-S377 CarbonylContact O-C 3.56Å; V365-S377 VanDerWaalsContact O-CA 3.23Å; V365-S377 WeakPolarHBondContact O-CA 3.37Å; V365-S377 WeakPolarHBondContact O-CB 3.25Å; S377-V403 WeakPolarHBondContact O-CA 3.39Å; S377-V403 WeakPolarHBondContact O-CG1 3.4Å; S377-F404 PolarHBondContact N-O 2.8Å; S377-F404 PolarHBondContact O-N 2.95Å
378	V	97.6	Very high	92.5	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.8	166.2	58.3	0	0	0	0	110	L347 F352 S364 V365 F375 Y401 K402 V403 F418	L347-V378 HydrophobicContact CD1-CG2 3.88Å; F352-V378 HydrophobicContact CE1-CG1 4.27Å; F352-V378 HydrophobicContact CE2-CG1 4.3Å; F352-V378 HydrophobicContact CZ-CG1 3.59Å; S364-V378 CarbonylContact C-O 3.47Å; S364-V378 WeakPolarHBondContact CA-O 3.39Å; V365-V378 HydrophobicContact CB-CG1 3.97Å; V365-V378 HydrophobicContact CG2-CG1 4.46Å; V365-V378 PolarHBondContact N-O 3.04Å; V365-V378 PolarHBondContact O-N 2.85Å; F375-V378 HydrophobicContact CE2-CG1 4.22Å; V378-Y401 HydrophobicContact CG2-CD1 4.28Å; V378-K402 CarbonylContact C-O 3.57Å; V378-K402 WeakPolarHBondContact CA-O 3.37Å; V378-V403 HydrophobicContact CB-CG2 4.27Å; V378-V403 HydrophobicContact CG2-CG2 3.93Å; V378-F418 HydrophobicContact CG2-CZ 4.43Å
379	A	96.5	Very high	92	Very high	23 Å²	23	41.2 Å²	41.2	19%	0.19	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.7	-178.8	0	0	0	0	0	112.5	A363 V381 Y401 K402	A363-A379 CarbonylContact O-C 3.54Å; A363-A379 VanDerWaalsContact O-CA 3.27Å; A363-A379 WeakPolarHBondContact O-CA 3.3Å; A379-V381 PolarHBondContact O-N 2.96Å; A379-Y401 CarbonylContact O-C 3.59Å; A379-Y401 WeakPolarHBondContact O-CA 3.31Å; A379-K402 PolarHBondContact N-O 3.04Å; A379-K402 PolarHBondContact O-N 3.33Å
380	S	95.8	Very high	92	Very high	15 Å²	15	38.8 Å²	38.8	11%	0.105	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	104.6	167	-176.1	0	0	0	0	109.5	A363 R392	A363-S380 PolarHBondContact O-N 3.06Å; S380-R392 PolarHBondContact O-NE 3.42Å
381	V	94.8	Very high	92.1	Very high	33 Å²	33	43.5 Å²	43.5	20%	0.2	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-91.2	148.2	-173.2	-70.6	0	0	0	0	112.1	Y84 A379 V400 K402	Y84-V381 HydrophobicContact CD1-CB 4.32Å; Y84-V381 HydrophobicContact CD1-CG2 3.71Å; Y84-V381 HydrophobicContact CE1-CG2 4.31Å; Y84-V381 HydrophobicContact CG-CG2 4.46Å; A379-V381 PolarHBondContact O-N 2.96Å; V381-V400 HydrophobicContact CG2-CB 4.31Å; V381-V400 HydrophobicContact CG2-CG1 3.8Å; V381-V400 WeakPolarHBondContact CG2-O 3.47Å; V381-V400 PolarHBondContact N-O 3.07Å; V381-K402 HydrophobicContact CG1-CB 3.47Å; V381-K402 VanDerWaalsContact CG1-CB 3.47Å; V381-K402 HydrophobicContact CG1-CD 4.36Å; V381-K402 HydrophobicContact CG2-CB 4.38Å
382	C	94.6	Very high	92.5	Very high	11 Å²	11	39.7 Å²	39.7	7%	0.074	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-97	147.9	175.3	-60.2	0	0	0	0	110.1	Y84 R110 I386 F390	Y84-C382 WeakPolarHBondContact CD1-O 3.26Å; R110-C382 PolarHBondContact NH1-O 3.25Å; C382-I386 HydrophobicContact CB-CD1 3.7Å; C382-I386 HydrophobicContact CB-CG1 4.49Å; C382-F390 HydrophobicContact CB-CE1 4.16Å; C382-F390 HydrophobicContact CB-CZ 4.3Å
383	P	95.9	Very high	92.9	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.026	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-60.7	158.9	173.1	27.6	-34.3	0	0	0	110.6	N82 E83 Y84 R110 N385 I386 F390	N82-P383 HydrophobicContact CB-CB 4.04Å; E83-P383 CarbonylContact O-C 3.2Å; E83-P383 VanDerWaalsContact O-CA 3.27Å; E83-P383 WeakPolarHBondContact O-CA 3.44Å; Y84-P383 HydrophobicContact CD1-CB 4.5Å; Y84-P383 HydrophobicContact CE1-CB 4.01Å; Y84-P383 VanDerWaalsContact CE1-N 3.34Å; R110-P383 WeakPolarHBondContact CD-O 3.46Å; R110-P383 PolarHBondContact NH1-O 3.36Å; P383-N385 VanDerWaalsContact CG-O 3.31Å; P383-N385 WeakPolarHBondContact CG-O 3.2Å; P383-N385 PolarHBondContact O-N 3.32Å; P383-I386 HydrophobicContact CG-CG1 4.32Å; P383-I386 WeakPolarHBondContact O-CG1 3.28Å; P383-F390 HydrophobicContact CG-CD2 4.37Å; P383-F390 HydrophobicContact CG-CE2 3.99Å; P383-F390 HydrophobicContact CG-CZ 4.45Å
384	V	96.5	Very high	92.7	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	25%	0.254	C	S	.	.	S	Bend	trans	-67.7	-24.5	177	-63.9	0	0	0	0	112.7	T76 E83 E85 R110 G251	T76-V384 HydrophobicContact CG2-CG1 3.91Å; E83-V384 HydrophobicContact CB-CG2 3.63Å; E83-V384 PolarHBondContact O-N 2.76Å; E85-V384 HydrophobicContact CG-CG1 3.97Å; R110-V384 VanDerWaalsContact CD-O 3.27Å; R110-V384 WeakPolarHBondContact CD-O 3.29Å; R110-V384 WeakPolarHBondContact CG-O 3.33Å; G251-V384 PolarHBondContact N-O 2.9Å
385	N	95.5	Very high	92.4	Very high	82 Å²	82	43.5 Å²	43.5	44%	0.439	25%	0.25	S	S	.	.	S	Bend	trans	-110.8	121.4	172.5	-66.4	-50.3	0	0	0	109.3	G251 P383	G251-N385 WeakPolarHBondContact CA-OD1 3.3Å; G251-N385 PolarHBondContact N-OD1 3.1Å; P383-N385 VanDerWaalsContact CG-O 3.31Å; P383-N385 WeakPolarHBondContact CG-O 3.2Å; P383-N385 PolarHBondContact O-N 3.32Å
386	I	93.1	Very high	92.1	Very high	19 Å²	19	46.8 Å²	46.8	10%	0.097	27%	0.266	C	S	.	.			trans	-119.3	114.5	-173.7	-60.4	-175.7	0	0	0	109.5	R110 R111 V113 C382 P383 F390	R110-I386 HydrophobicContact CG-CD1 3.84Å; R110-I386 HydrophobicContact CG-CG1 4.04Å; R111-I386 HydrophobicContact CB-CB 4.27Å; R111-I386 HydrophobicContact CB-CG2 4.25Å; R111-I386 WeakPolarHBondContact O-CD1 3.42Å; V113-I386 HydrophobicContact CG2-CD1 3.78Å; V113-I386 HydrophobicContact CG2-CG2 4.19Å; C382-I386 HydrophobicContact CB-CD1 3.7Å; C382-I386 HydrophobicContact CB-CG1 4.49Å; P383-I386 HydrophobicContact CG-CG1 4.32Å; P383-I386 WeakPolarHBondContact O-CG1 3.28Å; I386-F390 HydrophobicContact CG2-CB 3.63Å; I386-F390 HydrophobicContact CG2-CD1 3.89Å; I386-F390 HydrophobicContact CG2-CG 3.91Å
387	S	89.1	Confident	92	Very high	79 Å²	79	49.2 Å²	49.2	55%	0.552	28%	0.277	S	S	*	.			trans	-72.1	161.3	176.6	64.8	0	0	0	0	112.6	G389 F390	S387-G389 PolarHBondContact O-N 3.16Å; S387-G389 VanDerWaalsContact O-N 3.16Å; S387-F390 WeakPolarHBondContact O-CB 3.49Å; S387-F390 PolarHBondContact O-N 2.92Å; S387-F390 VanDerWaalsContact O-N 3.13Å
388	A	84	Confident	91.9	Very high	92 Å²	92	50.3 Å²	50.3	76%	0.76	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30	-178.3	0	0	0	0	0	113.8	R111	R111-A388 VanDerWaalsContact NH1-C 3.27Å; R111-A388 PolarHBondContact NH1-O 3.38Å
389	G	83.9	Confident	91.8	Very high	71 Å²	71	50.3 Å²	50.3	73%	0.732	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	6.7	-179.7	0	0	0	0	0	115.1	S387 R391	S387-G389 PolarHBondContact O-N 3.16Å; S387-G389 VanDerWaalsContact O-N 3.16Å; G389-R391 PolarHBondContact O-N 2.79Å
390	F	89.2	Confident	91.8	Very high	59 Å²	59	49.8 Å²	49.8	26%	0.259	28%	0.281	S	S	.	.			trans	-64.3	133.7	-178.6	179.3	-92.2	0	0	0	111.5	V113 C382 P383 I386 S387 R392	V113-F390 HydrophobicContact CG1-CE1 4.39Å; V113-F390 HydrophobicContact CG2-CD1 4.01Å; V113-F390 HydrophobicContact CG2-CE1 4.22Å; C382-F390 HydrophobicContact CB-CE1 4.16Å; C382-F390 HydrophobicContact CB-CZ 4.3Å; P383-F390 HydrophobicContact CG-CD2 4.37Å; P383-F390 HydrophobicContact CG-CE2 3.99Å; P383-F390 HydrophobicContact CG-CZ 4.45Å; I386-F390 HydrophobicContact CG2-CB 3.63Å; I386-F390 HydrophobicContact CG2-CD1 3.89Å; I386-F390 HydrophobicContact CG2-CG 3.91Å; S387-F390 WeakPolarHBondContact O-CB 3.49Å; S387-F390 PolarHBondContact O-N 2.92Å; S387-F390 VanDerWaalsContact O-N 3.13Å; F390-R392 HydrophobicContact CE1-CG 4.42Å
391	R	89.3	Confident	91.9	Very high	134 Å²	134	49.4 Å²	49.4	51%	0.506	28%	0.277	S	S	.	.			trans	-129.5	144.2	167.8	68.5	-178.1	-177.7	98.9	6.4	109.3	G389 K393 E397	G389-R391 PolarHBondContact O-N 2.79Å; R391-K393 PolarHBondContact O-N 3.13Å; R391-E397 IonicContact CZ-OE1 3.45Å; R391-E397 IonicContact NH1-OE1 3.38Å; R391-E397 PolarHBondContact NH1-OE1 2.89Å; R391-E397 IonicContact NH2-OE1 2.72Å; R391-E397 PolarHBondContact NH2-OE1 3.02Å; R391-E397 IonicContact NH2-OE2 3.39Å; R391-E397 PolarHBondContact NH2-OE2 3.05Å
392	R	89.1	Confident	92.1	Very high	64 Å²	64	48.2 Å²	48.2	24%	0.242	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-58.7	138	168.3	-81.1	-164.9	-171.4	85.1	4.1	109.2	V113 A114 S380 F390	V113-R392 HydrophobicContact CG1-CG 4.18Å; V113-R392 VanDerWaalsContact O-CZ 3.28Å; V113-R392 PolarHBondContact O-NH1 3.43Å; V113-R392 PolarHBondContact O-NH2 2.95Å; A114-R392 PolarHBondContact O-NH1 3.34Å; S380-R392 PolarHBondContact O-NE 3.42Å; F390-R392 HydrophobicContact CE1-CG 4.42Å
393	K	90.6	Very high	92.2	Very high	94 Å²	94	47.7 Å²	47.7	41%	0.409	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-69.8	130.8	175.1	-66.2	-62.9	-170	175.9	0	108.7	R391 E397	R391-K393 PolarHBondContact O-N 3.13Å; K393-E397 HydrophobicContact CB-CB 4.1Å; K393-E397 HydrophobicContact CD-CB 4.07Å; K393-E397 WeakPolarHBondContact CD-OE2 3.27Å; K393-E397 IonicContact NZ-OE2 3.3Å; K393-E397 PolarHBondContact NZ-OE2 3.29Å
394	Q	87.6	Confident	92.3	Very high	109 Å²	109	48.8 Å²	48.8	51%	0.509	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-69.5	158.9	173.4	-65.2	-170.1	-8.1	0	0	109.6	Q396 E397	Q394-Q396 PolarHBondContact O-N 3.23Å; Q394-E397 PolarHBondContact O-N 3.44Å
395	P	88.1	Confident	92.2	Very high	17 Å²	17	48.8 Å²	48.8	11%	0.11	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.7	-176.5	-27.3	36.7	0	0	0	116	T349 P357 F360 E397	T349-P395 HydrophobicContact CG2-CB 3.64Å; T349-P395 HydrophobicContact CG2-CG 4.15Å; P357-P395 HydrophobicContact CB-CB 3.89Å; F360-P395 HydrophobicContact CB-CG 4.13Å; F360-P395 HydrophobicContact CD1-CG 3.65Å; F360-P395 HydrophobicContact CG-CG 4.28Å; P395-E397 VanDerWaalsContact C-N 3.34Å
396	Q	89.9	Confident	92.1	Very high	69 Å²	69	47.6 Å²	47.6	32%	0.322	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-15	173.6	-45.5	74.9	18.8	0	0	112.7	Y346 P357 R358 Q394	Y346-Q396 WeakPolarHBondContact CE1-O 3.47Å; P357-Q396 HydrophobicContact CB-CG 4.25Å; P357-Q396 PolarHBondContact O-NE2 3.05Å; R358-Q396 HydrophobicContact CG-CG 4.28Å; R358-Q396 VanDerWaalsContact CG-NE2 3.34Å; Q394-Q396 PolarHBondContact O-N 3.23Å
397	E	93.6	Very high	92.1	Very high	53 Å²	53	54.1 Å²	54.1	25%	0.248	30%	0.297	C	S	.	.	S	Bend	trans	-100.4	150.6	175.5	-62.7	-179.3	-117.8	0	0	109.4	R391 K393 Q394 P395 G399	R391-E397 IonicContact CZ-OE1 3.45Å; R391-E397 IonicContact NH1-OE1 3.38Å; R391-E397 PolarHBondContact NH1-OE1 2.89Å; R391-E397 IonicContact NH2-OE1 2.72Å; R391-E397 PolarHBondContact NH2-OE1 3.02Å; R391-E397 IonicContact NH2-OE2 3.39Å; R391-E397 PolarHBondContact NH2-OE2 3.05Å; K393-E397 HydrophobicContact CB-CB 4.1Å; K393-E397 HydrophobicContact CD-CB 4.07Å; K393-E397 WeakPolarHBondContact CD-OE2 3.27Å; K393-E397 IonicContact NZ-OE2 3.3Å; K393-E397 PolarHBondContact NZ-OE2 3.29Å; Q394-E397 PolarHBondContact O-N 3.44Å; P395-E397 VanDerWaalsContact C-N 3.34Å; E397-G399 PolarHBondContact O-N 3.23Å; E397-G399 VanDerWaalsContact O-N 3.15Å
398	A	94.7	Very high	92.4	Very high	25 Å²	25	52.8 Å²	52.8	21%	0.207	29%	0.288	C	S	.	.			trans	-65	117.8	172.8	0	0	0	0	0	109.9	G345 Y346 Y422	G345-A398 WeakPolarHBondContact O-CA 3.47Å; Y346-A398 HydrophobicContact CE1-CB 4.29Å; Y346-A398 HydrophobicContact CE2-CB 4.06Å; A398-Y422 HydrophobicContact CB-CD2 4.46Å; A398-Y422 HydrophobicContact CB-CE2 3.71Å
399	G	95.7	Very high	93	Very high	3 Å²	3	49.3 Å²	49.3	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	169.8	179.2	0	0	0	0	0	112	H344 G345 E397	H344-G399 CarbonylContact C-O 3.59Å; H344-G399 WeakPolarHBondContact CA-O 3.46Å; H344-G399 PolarHBondContact CD2-O 3.07Å; G345-G399 PolarHBondContact N-O 3.06Å; G345-G399 PolarHBondContact O-N 3.48Å; E397-G399 PolarHBondContact O-N 3.23Å; E397-G399 VanDerWaalsContact O-N 3.15Å
400	V	97.2	Very high	93.6	Very high	11 Å²	11	49.5 Å²	49.5	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.3	169.6	-175.7	0	0	0	0	108.1	V79 Y84 I342 V343 V381	V79-V400 HydrophobicContact CG1-CG1 4.5Å; V79-V400 HydrophobicContact CG1-CG2 3.96Å; Y84-V400 HydrophobicContact CD1-CB 4.45Å; Y84-V400 HydrophobicContact CD1-CG1 4Å; Y84-V400 HydrophobicContact CD2-CG1 4.26Å; Y84-V400 HydrophobicContact CE1-CB 3.87Å; Y84-V400 HydrophobicContact CE1-CG1 3.88Å; Y84-V400 HydrophobicContact CE1-CG2 4.2Å; Y84-V400 HydrophobicContact CE2-CG1 4.18Å; Y84-V400 HydrophobicContact CE2-CG2 4.2Å; Y84-V400 HydrophobicContact CG-CG1 4.19Å; I342-V400 HydrophobicContact CG2-CG1 3.5Å; I342-V400 VanDerWaalsContact CG2-CG1 3.5Å; V343-V400 CarbonylContact O-C 3.54Å; V343-V400 WeakPolarHBondContact O-CA 3.2Å; V381-V400 HydrophobicContact CG2-CB 4.31Å; V381-V400 HydrophobicContact CG2-CG1 3.8Å; V381-V400 WeakPolarHBondContact CG2-O 3.47Å; V381-V400 PolarHBondContact N-O 3.07Å
401	Y	97.7	Very high	93.9	Very high	7 Å²	7	54.3 Å²	54.3	3%	0.027	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.4	-175.2	-62	-93.1	0	0	0	110	I342 V343 G345 L347 V378 A379 F418	I342-Y401 CarbonylContact C-O 3.56Å; I342-Y401 VanDerWaalsContact CA-O 3.3Å; I342-Y401 WeakPolarHBondContact CA-O 3.24Å; V343-Y401 PolarHBondContact N-O 3.18Å; V343-Y401 PolarHBondContact O-N 3.15Å; G345-Y401 WeakPolarHBondContact O-CE2 3.32Å; L347-Y401 HydrophobicContact CB-CE1 3.88Å; L347-Y401 HydrophobicContact CB-CE2 4.27Å; L347-Y401 HydrophobicContact CD1-CD1 4.37Å; L347-Y401 HydrophobicContact CD1-CE1 4.4Å; L347-Y401 HydrophobicContact CD2-CE1 4.01Å; L347-Y401 HydrophobicContact CG-CE1 4.33Å; V378-Y401 HydrophobicContact CG2-CD1 4.28Å; A379-Y401 CarbonylContact O-C 3.59Å; A379-Y401 WeakPolarHBondContact O-CA 3.31Å; Y401-F418 HydrophobicContact CD2-CD1 4.5Å; Y401-F418 AromaticContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CE2-CE1 4.38Å; Y401-F418 AromaticContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CZ 4.27Å
402	K	97.8	Very high	94.3	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.035	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.7	167.8	-176.6	172.5	-167.9	176.3	0	108.4	E85 S86 G87 T341 I342 V378 A379 V381 F404	E85-K402 PolarHBondContact O-NZ 3.35Å; S86-K402 VanDerWaalsContact C-NZ 3.3Å; S86-K402 WeakPolarHBondContact O-CE 3.32Å; S86-K402 PolarHBondContact O-NZ 2.84Å; G87-K402 PolarHBondContact O-NZ 3.03Å; G87-K402 VanDerWaalsContact O-NZ 3.13Å; T341-K402 WeakPolarHBondContact O-CA 3.48Å; I342-K402 HydrophobicContact CD1-CB 3.54Å; I342-K402 HydrophobicContact CD1-CD 3.92Å; I342-K402 HydrophobicContact CD1-CG 3.56Å; V378-K402 CarbonylContact C-O 3.57Å; V378-K402 WeakPolarHBondContact CA-O 3.37Å; A379-K402 PolarHBondContact N-O 3.04Å; A379-K402 PolarHBondContact O-N 3.33Å; V381-K402 HydrophobicContact CG1-CB 3.47Å; V381-K402 VanDerWaalsContact CG1-CB 3.47Å; V381-K402 HydrophobicContact CG1-CD 4.36Å; V381-K402 HydrophobicContact CG2-CB 4.38Å; K402-F404 HydrophobicContact CD-CE2 3.98Å; K402-F404 HydrophobicContact CD-CZ 4.05Å; K402-F404 HydrophobicContact CG-CE2 4.47Å; K402-F404 VanDerWaalsContact NZ-CZ 3.3Å
403	V	98.1	Very high	94.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.1	170.9	-170.4	0	0	0	0	107.9	T341 F375 S377 V378 L409 L417 F418	T341-V403 PolarHBondContact N-O 3.39Å; T341-V403 PolarHBondContact O-N 3.32Å; F375-V403 HydrophobicContact CB-CG1 3.85Å; F375-V403 HydrophobicContact CD2-CG1 4.38Å; F375-V403 HydrophobicContact CG-CG1 4.38Å; S377-V403 WeakPolarHBondContact O-CA 3.39Å; S377-V403 WeakPolarHBondContact O-CG1 3.4Å; V378-V403 HydrophobicContact CB-CG2 4.27Å; V378-V403 HydrophobicContact CG2-CG2 3.93Å; V403-L409 HydrophobicContact CB-CD1 4.07Å; V403-L409 HydrophobicContact CG1-CD1 3.74Å; V403-L417 HydrophobicContact CG1-CD1 3.94Å; V403-L417 HydrophobicContact CG2-CD1 4.3Å; V403-F418 HydrophobicContact CG2-CE2 3.86Å; V403-F418 HydrophobicContact CG2-CZ 3.86Å
404	F	97.3	Very high	95	Very high	28 Å²	28	46.4 Å²	46.4	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.2	167.4	-78.8	-65.6	0	0	0	109.3	V222 T338 V339 A340 N376 S377 K402	V222-F404 HydrophobicContact CG2-CD2 4.24Å; T338-F404 HydrophobicContact CG2-CD1 3.76Å; T338-F404 HydrophobicContact CG2-CE1 4.08Å; V339-F404 WeakPolarHBondContact O-CA 3.36Å; A340-F404 HydrophobicContact CB-CD1 4.18Å; A340-F404 HydrophobicContact CB-CE1 3.96Å; N376-F404 HydrophobicContact CB-CB 4.25Å; N376-F404 PolarHBondContact N-O 3.27Å; S377-F404 PolarHBondContact N-O 2.8Å; S377-F404 PolarHBondContact O-N 2.95Å; K402-F404 HydrophobicContact CD-CE2 3.98Å; K402-F404 HydrophobicContact CD-CZ 4.05Å; K402-F404 HydrophobicContact CG-CE2 4.47Å; K402-F404 VanDerWaalsContact NZ-CZ 3.3Å
405	S	95.6	Very high	95.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	156.2	178.9	52.3	0	0	0	0	111.9	V339 F374 Q407	V339-S405 PolarHBondContact N-O 2.9Å; V339-S405 PolarHBondContact O-N 2.93Å; F374-S405 WeakPolarHBondContact O-CB 3.47Å; S405-Q407 WeakPolarHBondContact CB-O 3.23Å; S405-Q407 PolarHBondContact O-N 2.89Å; S405-Q407 PolarHBondContact OG-O 3.43Å
406	P	91.9	Very high	95.9	Very high	58 Å²	58	50.1 Å²	50.1	38%	0.377	26%	0.26	S	S	.	.	S	Bend	trans	-64	-28.7	175.1	-22.3	34	0	0	0	113.3
407	Q	93.4	Very high	96.2	Very high	156 Å²	156	46.9 Å²	46.9	73%	0.729	25%	0.245	S	C	*	.	S	Bend	trans	-140.6	165	-178.9	-65	-177.8	-4.1	0	0	110.6	S405 L409	S405-Q407 WeakPolarHBondContact CB-O 3.23Å; S405-Q407 PolarHBondContact O-N 2.89Å; S405-Q407 PolarHBondContact OG-O 3.43Å; Q407-L409 PolarHBondContact O-N 3.09Å
408	S	96	Very high	96.4	Very high	50 Å²	50	44.3 Å²	44.3	35%	0.35	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-61.1	128.4	176	-76.9	0	0	0	0	111.2	V426 E428	S408-V426 WeakPolarHBondContact OG-CG1 3.36Å; S408-E428 PolarHBondContact OG-OE1 3.4Å
409	L	96.8	Very high	96.5	Very high	19 Å²	19	49.1 Å²	49.1	10%	0.099	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-73.9	129.7	-173.6	-61.1	178.4	0	0	0	111.3	F374 V403 Q407 Q413 L414 L417	F374-L409 HydrophobicContact CD2-CD2 3.66Å; F374-L409 HydrophobicContact CE2-CD2 4.11Å; V403-L409 HydrophobicContact CB-CD1 4.07Å; V403-L409 HydrophobicContact CG1-CD1 3.74Å; Q407-L409 PolarHBondContact O-N 3.09Å; L409-Q413 HydrophobicContact CB-CB 4.42Å; L409-Q413 HydrophobicContact CD2-CB 4.38Å; L409-L414 HydrophobicContact CB-CD2 4.1Å; L409-L414 HydrophobicContact CB-CG 3.95Å; L409-L414 HydrophobicContact CD1-CD2 3.86Å; L409-L417 HydrophobicContact CD1-CD1 4.44Å
410	D	96.4	Very high	96.5	Very high	76 Å²	76	51.9 Å²	51.9	41%	0.406	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-76.5	170.8	173.5	74.8	46	0	0	0	112.2	S412 Q413 L414	D410-S412 VanDerWaalsContact C-N 3.26Å; D410-S412 PolarHBondContact O-N 2.84Å; D410-S412 VanDerWaalsContact OD1-CA 3.27Å; D410-S412 WeakPolarHBondContact OD1-CA 3.48Å; D410-S412 VanDerWaalsContact OD1-CB 3.28Å; D410-S412 WeakPolarHBondContact OD1-CB 3.49Å; D410-S412 PolarHBondContact OD1-N 3.34Å; D410-S412 PolarHBondContact OD1-OG 3.12Å; D410-Q413 PolarHBondContact O-N 3.27Å; D410-Q413 PolarHBondContact OD1-N 3.18Å; D410-L414 WeakPolarHBondContact O-CG 3.28Å; D410-L414 PolarHBondContact O-N 2.92Å
411	K	96.4	Very high	96.5	Very high	159 Å²	159	55 Å²	55	69%	0.691	28%	0.276	S	S	*	.	H	α-helix	trans	-62.4	-31.4	-178.7	-69.8	-178	-179.4	175.8	0	113.2	K415	K411-K415 WeakPolarHBondContact O-CB 3.48Å; K411-K415 VanDerWaalsContact O-CG 3.23Å; K411-K415 WeakPolarHBondContact O-CG 3.33Å; K411-K415 PolarHBondContact O-N 3.09Å; K411-K415 VanDerWaalsContact O-N 3.11Å
412	S	96.5	Very high	96.5	Very high	71 Å²	71	61.7 Å²	61.7	50%	0.497	30%	0.302	S	S	.	.	H	α-helix	trans	-72.7	-45.3	179	77	0	0	0	0	110.6	D410 L414 K415 T416	D410-S412 VanDerWaalsContact C-N 3.26Å; D410-S412 PolarHBondContact O-N 2.84Å; D410-S412 VanDerWaalsContact OD1-CA 3.27Å; D410-S412 WeakPolarHBondContact OD1-CA 3.48Å; D410-S412 VanDerWaalsContact OD1-CB 3.28Å; D410-S412 WeakPolarHBondContact OD1-CB 3.49Å; D410-S412 PolarHBondContact OD1-N 3.34Å; D410-S412 PolarHBondContact OD1-OG 3.12Å; S412-L414 PolarHBondContact O-N 3.41Å; S412-K415 CarbonylContact O-C 3.57Å; S412-K415 PolarHBondContact O-N 3.29Å; S412-K415 VanDerWaalsContact O-N 3.13Å; S412-T416 PolarHBondContact O-N 2.85Å; S412-T416 PolarHBondContact O-OG1 3.35Å; S412-T416 VanDerWaalsContact O-OG1 3.06Å
413	Q	97.3	Very high	96.4	Very high	46 Å²	46	63 Å²	63	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-60.3	-44.3	175.4	-71.6	173.9	-25.9	0	0	111.7	F374 L409 D410 K415 T416 L417	F374-Q413 VanDerWaalsContact CB-NE2 3.34Å; F374-Q413 HydrophobicContact CD1-CG 4.12Å; F374-Q413 HydrophobicContact CD2-CB 3.83Å; F374-Q413 HydrophobicContact CD2-CG 3.8Å; F374-Q413 HydrophobicContact CE1-CB 4.48Å; F374-Q413 HydrophobicContact CE1-CG 4.27Å; F374-Q413 HydrophobicContact CE2-CB 3.56Å; F374-Q413 HydrophobicContact CE2-CG 3.96Å; F374-Q413 HydrophobicContact CG-CB 4.39Å; F374-Q413 HydrophobicContact CG-CG 3.88Å; F374-Q413 HydrophobicContact CZ-CB 3.91Å; F374-Q413 HydrophobicContact CZ-CG 4.19Å; L409-Q413 HydrophobicContact CB-CB 4.42Å; L409-Q413 HydrophobicContact CD2-CB 4.38Å; D410-Q413 PolarHBondContact O-N 3.27Å; D410-Q413 PolarHBondContact OD1-N 3.18Å; Q413-K415 PolarHBondContact O-N 2.93Å; Q413-T416 WeakPolarHBondContact O-CB 3.33Å; Q413-T416 PolarHBondContact O-N 3.18Å; Q413-L417 PolarHBondContact O-N 3.05Å; Q413-L417 VanDerWaalsContact O-N 3.11Å
414	L	97.9	Very high	96.4	Very high	10 Å²	10	64.9 Å²	64.9	5%	0.052	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-40.9	173.9	-73.8	171.5	0	0	0	112.3	T341 V343 L409 D410 S412 T416 L417 F418 Y421 A424	T341-L414 HydrophobicContact CG2-CD2 4.41Å; V343-L414 HydrophobicContact CG2-CD2 4.05Å; L409-L414 HydrophobicContact CB-CD2 4.1Å; L409-L414 HydrophobicContact CB-CG 3.95Å; L409-L414 HydrophobicContact CD1-CD2 3.86Å; D410-L414 WeakPolarHBondContact O-CG 3.28Å; D410-L414 PolarHBondContact O-N 2.92Å; S412-L414 PolarHBondContact O-N 3.41Å; L414-T416 VanDerWaalsContact C-N 3.28Å; L414-T416 PolarHBondContact O-N 2.92Å; L414-L417 PolarHBondContact O-N 3.26Å; L414-F418 HydrophobicContact CD2-CD2 4.37Å; L414-F418 HydrophobicContact CD2-CE2 4.39Å; L414-F418 WeakPolarHBondContact O-CB 3.47Å; L414-F418 WeakPolarHBondContact O-CD2 3.48Å; L414-F418 PolarHBondContact O-N 3.09Å; L414-Y421 HydrophobicContact CB-CE1 3.93Å; L414-Y421 HydrophobicContact CD1-CE1 4.4Å; L414-A424 HydrophobicContact CD1-CB 4.39Å
415	K	96.8	Very high	96.4	Very high	149 Å²	149	66 Å²	66	65%	0.648	33%	0.333	S	S	*	.	H	α-helix	trans	-69.5	-25.2	176.1	-77	176.9	179.1	-173.5	0	113.2	K411 S412 Q413 F418	K411-K415 WeakPolarHBondContact O-CB 3.48Å; K411-K415 VanDerWaalsContact O-CG 3.23Å; K411-K415 WeakPolarHBondContact O-CG 3.33Å; K411-K415 PolarHBondContact O-N 3.09Å; K411-K415 VanDerWaalsContact O-N 3.11Å; S412-K415 CarbonylContact O-C 3.57Å; S412-K415 PolarHBondContact O-N 3.29Å; S412-K415 VanDerWaalsContact O-N 3.13Å; Q413-K415 PolarHBondContact O-N 2.93Å; K415-F418 CarbonylContact C-O 3.52Å; K415-F418 VanDerWaalsContact O-O 3.07Å
416	T	96.4	Very high	96.5	Very high	55 Å²	55	69.5 Å²	69.5	34%	0.337	35%	0.354	S	S	.	.	H	α-helix	trans	-68.3	-47.6	171.5	-62.2	0	0	0	0	110.5	N348 F351 F374 S412 Q413 L414	N348-T416 WeakPolarHBondContact CB-O 3.45Å; N348-T416 PolarHBondContact ND2-O 2.85Å; F351-T416 HydrophobicContact CD2-CG2 3.5Å; F351-T416 VanDerWaalsContact CD2-CG2 3.5Å; F351-T416 HydrophobicContact CE2-CG2 3.43Å; F351-T416 VanDerWaalsContact CE2-CG2 3.43Å; F351-T416 HydrophobicContact CG-CG2 4.43Å; F351-T416 HydrophobicContact CZ-CG2 4.32Å; F374-T416 HydrophobicContact CE1-CG2 4.28Å; F374-T416 HydrophobicContact CZ-CG2 4.23Å; S412-T416 PolarHBondContact O-N 2.85Å; S412-T416 PolarHBondContact O-OG1 3.35Å; S412-T416 VanDerWaalsContact O-OG1 3.06Å; Q413-T416 WeakPolarHBondContact O-CB 3.33Å; Q413-T416 PolarHBondContact O-N 3.18Å; L414-T416 VanDerWaalsContact C-N 3.28Å; L414-T416 PolarHBondContact O-N 2.92Å
417	L	97.1	Very high	96.6	Very high	0 Å²	0	68 Å²	68	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-77.8	-27.9	-178.8	-70	-179.8	0	0	0	114.3	L347 N348 F351 F352 F374 F375 V403 L409 Q413 L414	L347-L417 WeakPolarHBondContact CD1-O 3.39Å; N348-L417 WeakPolarHBondContact CB-O 3.31Å; N348-L417 PolarHBondContact N-O 3.43Å; F351-L417 HydrophobicContact CD1-CD2 3.97Å; F351-L417 HydrophobicContact CE1-CD2 3.89Å; F352-L417 HydrophobicContact CZ-CD2 4.12Å; F374-L417 HydrophobicContact CE2-CD1 3.73Å; F374-L417 HydrophobicContact CE2-CG 3.92Å; F374-L417 HydrophobicContact CZ-CD1 4.2Å; F374-L417 HydrophobicContact CZ-CD2 4.32Å; F374-L417 HydrophobicContact CZ-CG 3.87Å; F375-L417 HydrophobicContact CD1-CD1 4.21Å; F375-L417 HydrophobicContact CD1-CD2 4.1Å; F375-L417 HydrophobicContact CE1-CD2 3.75Å; F375-L417 HydrophobicContact CG-CD1 4.22Å; F375-L417 HydrophobicContact CZ-CD2 3.98Å; V403-L417 HydrophobicContact CG1-CD1 3.94Å; V403-L417 HydrophobicContact CG2-CD1 4.3Å; L409-L417 HydrophobicContact CD1-CD1 4.44Å; Q413-L417 PolarHBondContact O-N 3.05Å; Q413-L417 VanDerWaalsContact O-N 3.11Å; L414-L417 PolarHBondContact O-N 3.26Å
418	F	97.7	Very high	96.7	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.8	-175.2	-61.1	-86.3	0	0	0	110.9	V343 Y346 L347 V378 Y401 V403 L414 K415 S420 Y421	V343-F418 HydrophobicContact CB-CE1 4.07Å; V343-F418 HydrophobicContact CB-CE2 3.98Å; V343-F418 HydrophobicContact CB-CZ 3.71Å; V343-F418 HydrophobicContact CG1-CD1 4.01Å; V343-F418 HydrophobicContact CG1-CD2 4.03Å; V343-F418 HydrophobicContact CG1-CE1 3.93Å; V343-F418 HydrophobicContact CG1-CE2 3.96Å; V343-F418 HydrophobicContact CG1-CG 4.07Å; V343-F418 HydrophobicContact CG1-CZ 3.9Å; V343-F418 HydrophobicContact CG2-CD2 4.46Å; V343-F418 HydrophobicContact CG2-CE2 3.77Å; V343-F418 HydrophobicContact CG2-CZ 3.92Å; Y346-F418 CarbonylContact O-C 3.45Å; Y346-F418 VanDerWaalsContact O-CA 3.32Å; Y346-F418 WeakPolarHBondContact O-CA 3.44Å; L347-F418 HydrophobicContact CD1-CD1 4.3Å; L347-F418 HydrophobicContact CD1-CE1 3.89Å; L347-F418 HydrophobicContact CD1-CZ 4.29Å; V378-F418 HydrophobicContact CG2-CZ 4.43Å; Y401-F418 HydrophobicContact CD2-CD1 4.5Å; Y401-F418 AromaticContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CE2-CE1 4.38Å; Y401-F418 AromaticContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CZ 4.27Å; V403-F418 HydrophobicContact CG2-CE2 3.86Å; V403-F418 HydrophobicContact CG2-CZ 3.86Å; L414-F418 HydrophobicContact CD2-CD2 4.37Å; L414-F418 HydrophobicContact CD2-CE2 4.39Å; L414-F418 WeakPolarHBondContact O-CB 3.47Å; L414-F418 WeakPolarHBondContact O-CD2 3.48Å; L414-F418 PolarHBondContact O-N 3.09Å; K415-F418 CarbonylContact C-O 3.52Å; K415-F418 VanDerWaalsContact O-O 3.07Å; F418-S420 PolarHBondContact O-N 3.29Å; F418-Y421 HydrophobicContact CB-CD1 4.43Å
419	R	96.1	Very high	96.5	Very high	126 Å²	126	66.6 Å²	66.6	48%	0.475	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	-39.8	174.9	-68.9	177.6	176.3	-176.4	-1	110.8	Y346 N348 S350 P355 P357	Y346-R419 PolarHBondContact O-N 3.26Å; N348-R419 HydrophobicContact CB-CG 3.93Å; S350-R419 PolarHBondContact OG-NH2 3.3Å; P355-R419 PolarHBondContact O-NH2 3.12Å; P357-R419 VanDerWaalsContact CG-NH1 3.33Å
420	S	96.4	Very high	96.2	Very high	61 Å²	61	69.6 Å²	69.6	43%	0.427	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	156.3	171	58.1	0	0	0	0	109.6	G345 Y346 F418	G345-S420 WeakPolarHBondContact CA-O 3.47Å; Y346-S420 VanDerWaalsContact CD2-OG 3.27Å; Y346-S420 WeakPolarHBondContact CD2-OG 3.29Å; Y346-S420 PolarHBondContact N-O 3.46Å; F418-S420 PolarHBondContact O-N 3.29Å
421	Y	97.1	Very high	95.6	Very high	77 Å²	77	66.2 Å²	66.2	30%	0.302	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.2	174.4	64.7	-90.7	0	0	0	110.5	V343 H344 L414 F418 A424	V343-Y421 HydrophobicContact CG1-CG 4.05Å; H344-Y421 CarbonylContact O-C 3.56Å; H344-Y421 WeakPolarHBondContact O-CA 3.47Å; H344-Y421 WeakPolarHBondContact O-CB 3.46Å; L414-Y421 HydrophobicContact CB-CE1 3.93Å; L414-Y421 HydrophobicContact CD1-CE1 4.4Å; F418-Y421 HydrophobicContact CB-CD1 4.43Å; Y421-A424 HydrophobicContact CD2-CB 4.41Å; Y421-A424 HydrophobicContact CE2-CB 4.27Å
422	Y	96.7	Very high	95.5	Very high	147 Å²	147	60.9 Å²	60.9	58%	0.576	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	-37.1	178.5	-58.5	-74.9	0	0	0	111.9	H344 Y346 A398	H344-Y422 AromaticContact CE1-CD2 3.37Å; H344-Y422 WeakPolarHBondContact CE1-CD2 3.45Å; H344-Y422 AromaticContact CE1-CE2 3.99Å; H344-Y422 AromaticContact ND1-CD2 3.55Å; H344-Y422 AromaticContact ND1-CG 3.97Å; H344-Y422 AromaticContact NE2-CD2 3.88Å; H344-Y422 PolarHBondContact O-N 2.91Å; Y346-Y422 AromaticContact CE2-CE2 3.9Å; Y346-Y422 HydrophobicContact CE2-CE2 3.9Å; Y346-Y422 AromaticContact CE2-CZ 4Å; Y346-Y422 PolarHBondContact OH-OH 2.89Å; A398-Y422 HydrophobicContact CB-CD2 4.46Å; A398-Y422 HydrophobicContact CB-CE2 3.71Å
423	S	96.8	Very high	95.3	Very high	36 Å²	36	57.5 Å²	57.5	25%	0.252	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	149.1	179.7	62.1	0	0	0	0	111.3	V343 H344	V343-S423 WeakPolarHBondContact CA-O 3.25Å; H344-S423 PolarHBondContact N-O 2.98Å
424	A	97.3	Very high	95.2	Very high	39 Å²	39	59.6 Å²	59.6	32%	0.322	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125	170.2	0	0	0	0	0	108.7	T341 I342 V343 L414 Y421	T341-A424 HydrophobicContact CG2-CB 4.16Å; I342-A424 CarbonylContact O-C 3.57Å; I342-A424 WeakPolarHBondContact O-CA 3.42Å; V343-A424 HydrophobicContact CG2-CB 4.28Å; L414-A424 HydrophobicContact CD1-CB 4.39Å; Y421-A424 HydrophobicContact CD2-CB 4.41Å; Y421-A424 HydrophobicContact CE2-CB 4.27Å
425	Q	97.4	Very high	95	Very high	52 Å²	52	59.6 Å²	59.6	24%	0.243	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.6	179.5	-66.7	164.1	15.2	0	0	107.8	V77 T78 V79 T341 I342	V77-Q425 VanDerWaalsContact CB-OE1 3.27Å; V77-Q425 HydrophobicContact CG2-CB 4.48Å; V77-Q425 VanDerWaalsContact CG2-OE1 3.26Å; T78-Q425 PolarHBondContact O-NE2 3.1Å; T78-Q425 PolarHBondContact O-OE1 3.14Å; V79-Q425 VanDerWaalsContact CG2-OE1 3.25Å; T341-Q425 CarbonylContact C-O 3.59Å; T341-Q425 WeakPolarHBondContact CA-O 3.25Å; I342-Q425 HydrophobicContact CB-CB 4.45Å; I342-Q425 PolarHBondContact N-O 3.38Å; I342-Q425 PolarHBondContact O-N 2.85Å
426	V	97.3	Very high	94.5	Very high	73 Å²	73	53.5 Å²	53.5	44%	0.442	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	133.7	-175.9	-178.1	0	0	0	0	108.7	V339 T341 S408 E428	V339-V426 HydrophobicContact CG1-CG1 3.6Å; T341-V426 HydrophobicContact CG2-CG2 4.13Å; S408-V426 WeakPolarHBondContact OG-CG1 3.36Å; V426-E428 HydrophobicContact CG1-CG 4.17Å
427	T	95.9	Very high	93.8	Very high	26 Å²	26	52.4 Å²	52.4	16%	0.16	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124	168.7	-47	0	0	0	0	108.8	A340 W429	A340-T427 PolarHBondContact N-O 3.04Å; A340-T427 PolarHBondContact O-N 2.82Å; T427-W429 HydrophobicContact CG2-CD2 4.08Å; T427-W429 VanDerWaalsContact CG2-CE2 3.4Å; T427-W429 HydrophobicContact CG2-CE3 4.49Å; T427-W429 HydrophobicContact CG2-CH2 3.76Å; T427-W429 HydrophobicContact CG2-CZ2 3.25Å; T427-W429 HydrophobicContact CG2-CZ3 4.35Å
428	E	94.6	Very high	92.8	Very high	134 Å²	134	58 Å²	58	63%	0.626	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.7	179.5	-57.5	-172.9	176.7	0	0	109.4	V339 S408 V426	V339-E428 HydrophobicContact CG1-CG 4.39Å; V339-E428 HydrophobicContact CG2-CG 4.05Å; S408-E428 PolarHBondContact OG-OE1 3.4Å; V426-E428 HydrophobicContact CG1-CG 4.17Å
429	W	91.6	Very high	91.9	Very high	42 Å²	42	61.1 Å²	61.1	16%	0.159	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.9	-178.9	-59	117	0	0	0	110.2	R73 A75 S86 G337 T338 T427 A431	R73-W429 HydrophobicContact CB-CE3 4.5Å; R73-W429 HydrophobicContact CG-CD2 4.27Å; R73-W429 HydrophobicContact CG-CE3 3.75Å; R73-W429 HydrophobicContact CG-CZ3 4.18Å; A75-W429 HydrophobicContact CB-CH2 3.5Å; A75-W429 HydrophobicContact CB-CZ2 3.74Å; S86-W429 PolarHBondContact O-NE1 2.72Å; G337-W429 CarbonylContact C-O 3.3Å; G337-W429 VanDerWaalsContact CA-O 3.3Å; G337-W429 WeakPolarHBondContact CA-O 3.29Å; T338-W429 PolarHBondContact N-O 2.96Å; T338-W429 PolarHBondContact O-N 3.1Å; T427-W429 HydrophobicContact CG2-CD2 4.08Å; T427-W429 VanDerWaalsContact CG2-CE2 3.4Å; T427-W429 HydrophobicContact CG2-CE3 4.49Å; T427-W429 HydrophobicContact CG2-CH2 3.76Å; T427-W429 HydrophobicContact CG2-CZ2 3.25Å; T427-W429 HydrophobicContact CG2-CZ3 4.35Å; W429-A431 HydrophobicContact CB-CB 3.71Å; W429-A431 PolarHBondContact O-N 3.1Å
430	Q	89.7	Confident	91.4	Very high	83 Å²	83	57.7 Å²	57.7	39%	0.388	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	75.4	154.2	-65.1	-58.1	-35.6	0	0	106.9	V315 Y335	V315-Q430 HydrophobicContact CG1-CB 4.48Å; V315-Q430 HydrophobicContact CG2-CB 4.25Å; Y335-Q430 HydrophobicContact CD1-CB 4.48Å; Y335-Q430 PolarHBondContact O-OE1 3.43Å
431	A	85.4	Confident	91.1	Very high	5 Å²	5	56 Å²	56	4%	0.041	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-31.7	-161	0	0	0	0	0	113.2	R73 H336 W429	R73-A431 PolarHBondContact NH1-O 2.89Å; H336-A431 PolarHBondContact O-N 3.36Å; W429-A431 HydrophobicContact CB-CB 3.71Å; W429-A431 PolarHBondContact O-N 3.1Å
432	Y	92.7	Very high	90.8	Very high	47 Å²	47	53 Å²	53	18%	0.184	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	150.1	-168.6	-52.3	-61.9	0	0	0	109.9	N223 Y224 Y335 H336	N223-Y432 VanDerWaalsContact O-CE2 3.29Å; N223-Y432 WeakPolarHBondContact O-CE2 3.41Å; N223-Y432 PolarHBondContact O-OH 3.32Å; Y224-Y432 AromaticContact CD1-CD1 3.44Å; Y224-Y432 HydrophobicContact CD1-CD1 3.44Å; Y224-Y432 VanDerWaalsContact CD1-CD1 3.44Å; Y224-Y432 HydrophobicContact CD1-CD2 4.04Å; Y224-Y432 AromaticContact CD1-CE1 3.55Å; Y224-Y432 HydrophobicContact CD1-CE1 3.55Å; Y224-Y432 HydrophobicContact CD1-CE2 4.15Å; Y224-Y432 AromaticContact CD1-CG 3.69Å; Y224-Y432 HydrophobicContact CD1-CG 3.69Å; Y224-Y432 AromaticContact CD1-CZ 3.93Å; Y224-Y432 AromaticContact CE1-CD1 3.76Å; Y224-Y432 HydrophobicContact CE1-CD1 3.76Å; Y224-Y432 AromaticContact CE1-CE1 3.77Å; Y224-Y432 HydrophobicContact CE1-CE1 3.77Å; Y224-Y432 HydrophobicContact CE1-CG 4.42Å; Y224-Y432 WeakPolarHBondContact O-CD2 3.47Å; Y335-Y432 CarbonylContact C-O 3.45Å; Y335-Y432 VanDerWaalsContact CA-O 3.27Å; Y335-Y432 WeakPolarHBondContact CA-O 3.47Å; Y335-Y432 WeakPolarHBondContact CB-O 3.4Å; Y335-Y432 WeakPolarHBondContact CD1-O 3.23Å; H336-Y432 PolarHBondContact N-O 2.98Å
433	P	93.8	Very high	90.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.4	145	159.4	-26.5	36.5	0	0	0	111	Q226 Y335 Y435 E457 W458	Q226-P433 PolarHBondContact NE2-O 2.98Å; Y335-P433 HydrophobicContact CE1-CG 4.4Å; Y335-P433 HydrophobicContact CE2-CG 4.28Å; P433-Y435 HydrophobicContact CB-CD1 4.13Å; P433-Y435 HydrophobicContact CB-CE1 3.95Å; P433-Y435 HydrophobicContact CG-CE1 4.09Å; P433-Y435 VanDerWaalsContact O-CD2 3.32Å; P433-Y435 WeakPolarHBondContact O-CD2 3.33Å; P433-Y435 PolarHBondContact O-N 3.26Å; P433-Y435 VanDerWaalsContact O-N 3.12Å; P433-E457 HydrophobicContact CG-CB 4.02Å; P433-W458 HydrophobicContact CB-CD2 3.8Å; P433-W458 HydrophobicContact CB-CE3 3.84Å; P433-W458 HydrophobicContact CB-CG 4.37Å; P433-W458 HydrophobicContact CB-CH2 3.9Å; P433-W458 HydrophobicContact CB-CZ2 3.9Å; P433-W458 HydrophobicContact CB-CZ3 3.88Å; P433-W458 HydrophobicContact CG-CD2 3.94Å; P433-W458 HydrophobicContact CG-CE3 4.46Å; P433-W458 HydrophobicContact CG-CG 4.03Å; P433-W458 HydrophobicContact CG-CZ2 4.33Å
434	H	93.9	Very high	90.4	Very high	90 Å²	90	47.2 Å²	47.2	42%	0.417	28%	0.275	S	S	.	.			trans	-73.6	100.6	162.7	-171.9	69.7	0	0	0	107.3	S334 H336 Q439	S334-H434 PolarHBondContact O-N 3.46Å; S334-H434 WeakPolarHBondContact OG-CB 3.43Å; H336-H434 HydrophobicContact CB-CB 4.49Å; H434-Q439 PolarHBondContact O-OE1 2.97Å
435	Y	93.7	Very high	90.2	Very high	9 Å²	9	47.5 Å²	47.5	4%	0.035	27%	0.27	C	S	.	.			trans	-75.7	131.8	-166.9	-71.1	-66.7	0	0	0	111.1	Y224 I230 V234 P433 E457 S461	Y224-Y435 HydrophobicContact CD1-CE2 4.16Å; Y224-Y435 HydrophobicContact CE1-CE2 4.4Å; Y224-Y435 HydrophobicContact CG-CE2 4.24Å; I230-Y435 HydrophobicContact CG2-CD2 4.13Å; I230-Y435 HydrophobicContact CG2-CG 4.33Å; V234-Y435 HydrophobicContact CB-CD1 4.42Å; V234-Y435 HydrophobicContact CB-CE1 4.35Å; V234-Y435 HydrophobicContact CG1-CD1 4.04Å; V234-Y435 HydrophobicContact CG1-CD2 3.78Å; V234-Y435 HydrophobicContact CG1-CE1 3.77Å; V234-Y435 HydrophobicContact CG1-CE2 3.51Å; V234-Y435 HydrophobicContact CG1-CG 4.05Å; V234-Y435 HydrophobicContact CG2-CD1 3.62Å; V234-Y435 HydrophobicContact CG2-CE1 3.57Å; V234-Y435 HydrophobicContact CG2-CG 4.27Å; P433-Y435 HydrophobicContact CB-CD1 4.13Å; P433-Y435 HydrophobicContact CB-CE1 3.95Å; P433-Y435 HydrophobicContact CG-CE1 4.09Å; P433-Y435 VanDerWaalsContact O-CD2 3.32Å; P433-Y435 WeakPolarHBondContact O-CD2 3.33Å; P433-Y435 PolarHBondContact O-N 3.26Å; P433-Y435 VanDerWaalsContact O-N 3.12Å; Y435-E457 VanDerWaalsContact CE1-O 3.26Å; Y435-E457 WeakPolarHBondContact CE1-O 3.34Å; Y435-E457 PolarHBondContact OH-O 2.86Å; Y435-S461 WeakPolarHBondContact OH-CB 3.33Å; Y435-S461 PolarHBondContact OH-N 3.27Å; Y435-S461 VanDerWaalsContact OH-N 3.14Å
436	G	87.4	Confident	90	Very high	22 Å²	22	46.5 Å²	46.5	23%	0.227	27%	0.266	C	S	.	.			trans	-142.6	147.5	173.6	0	0	0	0	0	112	S438	G436-S438 PolarHBondContact O-N 2.96Å
437	S	82.1	Confident	89.9	Confident	32 Å²	32	45.1 Å²	45.1	22%	0.224	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.2	-176.9	-56.8	0	0	0	0	114.4	R195	R195-S437 WeakPolarHBondContact CA-O 3.48Å; R195-S437 WeakPolarHBondContact O-CB 3.22Å
438	S	76.1	Confident	89.8	Confident	117 Å²	117	47.2 Å²	47.2	82%	0.818	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-6.9	-179.5	56.3	0	0	0	0	114	G436	G436-S438 PolarHBondContact O-N 2.96Å
439	Q	78.5	Confident	89.8	Confident	65 Å²	65	42 Å²	42	30%	0.304	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-92.1	134.2	-176.4	-71.5	161.9	-19.6	0	0	110.3	H434	H434-Q439 PolarHBondContact O-OE1 2.97Å
440	G	84.1	Confident	90.1	Very high	55 Å²	55	40 Å²	40	57%	0.567	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-71.7	160	171.9	0	0	0	0	0	111.9
441	L	91.6	Very high	90.5	Very high	26 Å²	26	36.1 Å²	36.1	14%	0.136	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-80.3	134.3	174.2	-57.2	178.4	0	0	0	109.7	V178 E179 L182 T194 W458 A459	V178-L441 HydrophobicContact CB-CB 4.16Å; V178-L441 HydrophobicContact CB-CD1 4.02Å; V178-L441 HydrophobicContact CG1-CD1 3.71Å; E179-L441 HydrophobicContact CG-CB 4.17Å; E179-L441 HydrophobicContact CG-CD1 3.89Å; E179-L441 HydrophobicContact CG-CG 4.27Å; L182-L441 HydrophobicContact CD1-CD1 3.75Å; T194-L441 HydrophobicContact CG2-CD1 4.24Å; L441-W458 HydrophobicContact CD2-CB 3.85Å; L441-A459 HydrophobicContact CD1-CB 4.41Å; L441-A459 HydrophobicContact CD2-CB 4.32Å
442	P	89.9	Confident	91.1	Very high	12 Å²	12	35.9 Å²	35.9	8%	0.078	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-62	148.7	176.1	-23.4	34.2	0	0	0	112.3	Y452 W458	P442-Y452 HydrophobicContact CB-CD1 4.1Å; P442-Y452 HydrophobicContact CB-CE1 3.93Å; P442-Y452 HydrophobicContact CG-CE1 4.4Å; P442-W458 VanDerWaalsContact CD-CG 3.47Å; P442-W458 VanDerWaalsContact CG-CD1 3.47Å; P442-W458 HydrophobicContact CG-CD2 4.26Å; P442-W458 HydrophobicContact CG-CG 3.81Å
443	P	89.5	Confident	91.3	Very high	54 Å²	54	33.8 Å²	33.8	35%	0.351	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-67.4	156	175.3	28.7	-34.1	0	0	0	111.7	L446	P443-L446 HydrophobicContact CG-CD2 4.05Å
444	V	95.3	Very high	91.4	Very high	9 Å²	9	34 Å²	34	6%	0.055	21%	0.21	C	C	.	.	S	Bend	trans	-85.7	-35.7	174.1	175.2	0	0	0	0	110.8	S176 V178 Y451 Y452 I473 L476	S176-V444 WeakPolarHBondContact O-CB 3.2Å; S176-V444 PolarHBondContact O-N 2.68Å; V178-V444 HydrophobicContact CG2-CG2 3.93Å; V444-Y451 CarbonylContact O-C 3.58Å; V444-Y451 VanDerWaalsContact O-CA 3.26Å; V444-Y451 WeakPolarHBondContact O-CA 3.2Å; V444-Y452 PolarHBondContact O-N 3Å; V444-I473 HydrophobicContact CG1-CD1 4.1Å; V444-I473 HydrophobicContact CG1-CG1 3.56Å; V444-L476 HydrophobicContact CG1-CD2 4.17Å
445	E	94.2	Very high	91.4	Very high	44 Å²	44	29.7 Å²	29.7	21%	0.206	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116.1	174.5	-172.2	168	-166.7	0	0	109.2	Y451 R480	E445-Y451 HydrophobicContact CB-CD1 4.12Å; E445-Y451 HydrophobicContact CB-CE1 4.12Å; E445-Y451 HydrophobicContact CG-CD1 4.23Å; E445-Y451 HydrophobicContact CG-CE1 3.89Å; E445-R480 IonicContact OE1-NE 2.96Å; E445-R480 IonicContact OE2-CZ 3.86Å; E445-R480 IonicContact OE2-NE 2.78Å; E445-R480 PolarHBondContact OE2-NE 3.26Å; E445-R480 VanDerWaalsContact OE2-NE 3.16Å; E445-R480 IonicContact OE2-NH2 2.68Å; E445-R480 PolarHBondContact OE2-NH2 3.08Å
446	L	93.4	Very high	91.6	Very high	31 Å²	31	29.4 Å²	29.4	16%	0.162	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-36.9	-178.9	-66.7	-175.5	0	0	0	112.3	L307 L311 F328 P443 L450 Y452	L307-L446 HydrophobicContact CD1-CD1 3.9Å; L311-L446 HydrophobicContact CD1-CD1 3.89Å; F328-L446 HydrophobicContact CE2-CB 3.98Å; F328-L446 HydrophobicContact CE2-CD1 3.84Å; F328-L446 HydrophobicContact CE2-CD2 4.02Å; F328-L446 HydrophobicContact CE2-CG 4.16Å; F328-L446 HydrophobicContact CZ-CD1 3.8Å; F328-L446 HydrophobicContact CZ-CD2 4.06Å; F328-L446 HydrophobicContact CZ-CG 4.4Å; P443-L446 HydrophobicContact CG-CD2 4.05Å; L446-L450 HydrophobicContact CB-CD2 4.18Å; L446-L450 HydrophobicContact CB-CG 4.16Å; L446-L450 HydrophobicContact CD1-CG 4.5Å; L446-L450 PolarHBondContact N-O 2.88Å; L446-Y452 HydrophobicContact CD1-CG 4.45Å
447	H	94.2	Very high	92	Very high	45 Å²	45	28.4 Å²	28.4	21%	0.208	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	158.3	176.8	-170.9	-99	0	0	0	106.2	Y287 F324 N449 L450	Y287-H447 AromaticContact CZ-ND1 3.73Å; Y287-H447 PolarHBondContact OH-ND1 3.39Å; F324-H447 HydrophobicContact CE1-CB 4.12Å; H447-N449 PolarHBondContact O-N 2.8Å; H447-L450 HydrophobicContact CB-CB 4.08Å; H447-L450 HydrophobicContact CB-CD2 4.1Å; H447-L450 PolarHBondContact N-O 3.49Å; H447-L450 WeakPolarHBondContact O-CA 3.27Å; H447-L450 PolarHBondContact O-N 3.41Å; H447-L450 VanDerWaalsContact O-O 3.11Å
448	P	93.8	Very high	92.6	Very high	69 Å²	69	27.6 Å²	27.6	45%	0.448	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	125.9	178.1	-32.4	36.8	0	0	0	112.8	L285 Y287 L450	L285-P448 HydrophobicContact CD2-CB 3.94Å; L285-P448 WeakPolarHBondContact CD2-O 3.23Å; Y287-P448 PolarHBondContact OH-O 2.74Å; P448-L450 PolarHBondContact O-N 2.89Å
449	N	95.6	Very high	93.5	Very high	26 Å²	26	22 Å²	22	14%	0.139	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	11.8	-175.5	-55.1	-25.6	0	0	0	116.1	Y287 D303 I304 V305 H447	Y287-N449 HydrophobicContact CE2-CB 4.25Å; D303-N449 VanDerWaalsContact O-CB 3.3Å; D303-N449 WeakPolarHBondContact O-CB 3.36Å; I304-N449 WeakPolarHBondContact CA-O 3.41Å; I304-N449 HydrophobicContact CG1-CB 4.15Å; V305-N449 PolarHBondContact N-O 3.08Å; H447-N449 PolarHBondContact O-N 2.8Å
450	L	97.2	Very high	94.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	110.3	172.5	176	66.3	0	0	0	110.1	Y287 V305 L307 F321 F324 L446 H447 P448	Y287-L450 HydrophobicContact CE1-CB 4.13Å; Y287-L450 HydrophobicContact CE1-CD2 4.14Å; Y287-L450 HydrophobicContact CE2-CB 4.17Å; Y287-L450 VanDerWaalsContact OH-CB 3.29Å; Y287-L450 WeakPolarHBondContact OH-CB 3.31Å; V305-L450 HydrophobicContact CB-CD1 3.63Å; V305-L450 HydrophobicContact CG1-CD1 3.62Å; V305-L450 WeakPolarHBondContact O-CA 3.35Å; L307-L450 HydrophobicContact CD1-CD1 4.05Å; L307-L450 HydrophobicContact CG-CD1 4.05Å; F321-L450 HydrophobicContact CE1-CD2 4.15Å; F324-L450 HydrophobicContact CE1-CD2 3.95Å; F324-L450 HydrophobicContact CZ-CD2 3.88Å; L446-L450 HydrophobicContact CB-CD2 4.18Å; L446-L450 HydrophobicContact CB-CG 4.16Å; L446-L450 HydrophobicContact CD1-CG 4.5Å; L446-L450 PolarHBondContact N-O 2.88Å; H447-L450 HydrophobicContact CB-CB 4.08Å; H447-L450 HydrophobicContact CB-CD2 4.1Å; H447-L450 PolarHBondContact N-O 3.49Å; H447-L450 WeakPolarHBondContact O-CA 3.27Å; H447-L450 PolarHBondContact O-N 3.41Å; H447-L450 VanDerWaalsContact O-O 3.11Å; P448-L450 PolarHBondContact O-N 2.89Å
451	Y	98.1	Very high	94.7	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	146.4	-172.6	-56.7	-77.3	0	0	0	112.4	I304 V305 V306 L307 V444 E445 I473 L476 A477	I304-Y451 HydrophobicContact CG2-CD2 4.01Å; I304-Y451 HydrophobicContact CG2-CE2 3.86Å; V305-Y451 PolarHBondContact O-N 3.13Å; V306-Y451 HydrophobicContact CG2-CD2 4.3Å; L307-Y451 PolarHBondContact N-O 2.94Å; V444-Y451 CarbonylContact O-C 3.58Å; V444-Y451 VanDerWaalsContact O-CA 3.26Å; V444-Y451 WeakPolarHBondContact O-CA 3.2Å; E445-Y451 HydrophobicContact CB-CD1 4.12Å; E445-Y451 HydrophobicContact CB-CE1 4.12Å; E445-Y451 HydrophobicContact CG-CD1 4.23Å; E445-Y451 HydrophobicContact CG-CE1 3.89Å; Y451-I473 HydrophobicContact CD2-CG2 4.12Å; Y451-I473 HydrophobicContact CG-CG2 3.88Å; Y451-L476 HydrophobicContact CD1-CD2 3.95Å; Y451-L476 HydrophobicContact CE1-CD2 3.63Å; Y451-L476 HydrophobicContact CE1-CG 3.88Å; Y451-A477 HydrophobicContact CD2-CB 4.34Å; Y451-A477 HydrophobicContact CE2-CB 3.64Å
452	Y	97.4	Very high	94.9	Very high	1 Å²	1	17.3 Å²	17.3	0%	0.004	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	113.6	176.6	-179.3	-136.3	0	0	0	111.6	L307 T309 L311 Q312 L331 P442 V444 L446 N454 G455	L307-Y452 HydrophobicContact CB-CD2 4.19Å; T309-Y452 WeakPolarHBondContact O-CE2 3.37Å; L311-Y452 HydrophobicContact CB-CE2 4.37Å; L311-Y452 HydrophobicContact CD1-CD2 3.69Å; L311-Y452 HydrophobicContact CD1-CE2 3.78Å; L311-Y452 HydrophobicContact CD1-CG 4.17Å; L311-Y452 HydrophobicContact CG-CD2 4.08Å; L311-Y452 HydrophobicContact CG-CE2 3.68Å; L311-Y452 PolarHBondContact N-OH 3.49Å; Q312-Y452 PolarHBondContact OE1-OH 3.27Å; L331-Y452 HydrophobicContact CD1-CD1 3.85Å; L331-Y452 HydrophobicContact CD1-CE1 3.54Å; P442-Y452 HydrophobicContact CB-CD1 4.1Å; P442-Y452 HydrophobicContact CB-CE1 3.93Å; P442-Y452 HydrophobicContact CG-CE1 4.4Å; V444-Y452 PolarHBondContact O-N 3Å; L446-Y452 HydrophobicContact CD1-CG 4.45Å; Y452-N454 HydrophobicContact CE2-CB 3.65Å; Y452-G455 VanDerWaalsContact CE1-N 3.25Å
453	L	97.9	Very high	95.3	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.01	10%	0.102	C	C	.	.	S	Bend	trans	-79.5	-45.3	-176.7	-174.4	151.4	0	0	0	112.2	G44 T48 V306 L307 A308 G455 I456 A469 A470 I473	G44-L453 VanDerWaalsContact C-CD1 3.46Å; T48-L453 VanDerWaalsContact OG1-CD1 3.23Å; T48-L453 WeakPolarHBondContact OG1-CD1 3.45Å; V306-L453 HydrophobicContact CG1-CB 4.48Å; L307-L453 WeakPolarHBondContact O-CB 3.47Å; L307-L453 PolarHBondContact O-N 3.41Å; A308-L453 HydrophobicContact CB-CB 4.34Å; A308-L453 HydrophobicContact CB-CD1 4.24Å; L453-G455 PolarHBondContact O-N 2.83Å; L453-I456 WeakPolarHBondContact O-CG2 3.28Å; L453-I456 PolarHBondContact O-N 3.48Å; L453-A469 HydrophobicContact CG-CB 4.24Å; L453-A470 HydrophobicContact CD1-CB 4.08Å; L453-I473 HydrophobicContact CB-CD1 3.75Å; L453-I473 HydrophobicContact CD1-CD1 4.49Å; L453-I473 HydrophobicContact CG-CD1 4.23Å
454	N	95.6	Very high	95.7	Very high	4 Å²	4	15.3 Å²	15.3	2%	0.021	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-72.3	-0.7	-171.9	-52.5	78.3	0	0	0	113.4	A308 T309 Y452 I456 E457	A308-N454 WeakPolarHBondContact CA-OD1 3.27Å; A308-N454 PolarHBondContact O-OD1 3.09Å; T309-N454 VanDerWaalsContact C-OD1 3.22Å; T309-N454 WeakPolarHBondContact CA-OD1 3.4Å; T309-N454 PolarHBondContact N-OD1 3.28Å; T309-N454 PolarHBondContact O-OD1 3.05Å; Y452-N454 HydrophobicContact CE2-CB 3.65Å; N454-I456 PolarHBondContact O-N 2.87Å; N454-E457 HydrophobicContact CB-CG 4.4Å; N454-E457 PolarHBondContact ND2-OE1 3.43Å; N454-E457 WeakPolarHBondContact O-CB 3.43Å; N454-E457 PolarHBondContact O-N 3.49Å; N454-E457 VanDerWaalsContact O-N 3.14Å
455	G	94.6	Very high	95.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-55.6	-34.3	167	0	0	0	0	0	112.4	Y452 L453 E457 W458	Y452-G455 VanDerWaalsContact CE1-N 3.25Å; L453-G455 PolarHBondContact O-N 2.83Å; G455-E457 PolarHBondContact O-N 2.88Å; G455-W458 WeakPolarHBondContact O-CB 3.36Å; G455-W458 PolarHBondContact O-N 3.25Å
456	I	96.6	Very high	95.9	Very high	4 Å²	4	13.4 Å²	13.4	2%	0.021	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-61.6	-26.3	178.1	-163.6	59.3	0	0	0	113.3	V178 L453 N454 W458 A459 G460 M465 A469	V178-I456 HydrophobicContact CG1-CD1 3.64Å; V178-I456 HydrophobicContact CG2-CD1 4.24Å; L453-I456 WeakPolarHBondContact O-CG2 3.28Å; L453-I456 PolarHBondContact O-N 3.48Å; N454-I456 PolarHBondContact O-N 2.87Å; I456-W458 PolarHBondContact O-N 3.29Å; I456-A459 WeakPolarHBondContact O-CB 3.42Å; I456-A459 PolarHBondContact O-N 2.99Å; I456-G460 PolarHBondContact O-N 2.96Å; I456-G460 VanDerWaalsContact O-N 3.15Å; I456-M465 HydrophobicContact CD1-CE 3.97Å; I456-M465 HydrophobicContact CG1-CB 4.22Å; I456-M465 HydrophobicContact CG1-CE 4Å; I456-A469 HydrophobicContact CB-CB 3.75Å; I456-A469 HydrophobicContact CG1-CB 4.05Å; I456-A469 HydrophobicContact CG2-CB 3.63Å
457	E	95.8	Very high	96.2	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-66.3	-22.4	-177.1	-61.9	-170.7	-153	0	0	112.7	R73 P433 Y435 N454 G455 A459 G460 S461	R73-E457 IonicContact CZ-OE1 2.83Å; R73-E457 IonicContact CZ-OE2 3.75Å; R73-E457 IonicContact NH1-OE1 3.59Å; R73-E457 IonicContact NH1-OE2 3.47Å; R73-E457 PolarHBondContact NH1-OE2 2.88Å; R73-E457 IonicContact NH2-OE1 2.89Å; R73-E457 PolarHBondContact NH2-OE1 2.92Å; R73-E457 IonicContact NH2-OE2 3.76Å; R73-E457 PolarHBondContact NH2-OE2 2.88Å; P433-E457 HydrophobicContact CG-CB 4.02Å; Y435-E457 VanDerWaalsContact CE1-O 3.26Å; Y435-E457 WeakPolarHBondContact CE1-O 3.34Å; Y435-E457 PolarHBondContact OH-O 2.86Å; N454-E457 HydrophobicContact CB-CG 4.4Å; N454-E457 PolarHBondContact ND2-OE1 3.43Å; N454-E457 WeakPolarHBondContact O-CB 3.43Å; N454-E457 PolarHBondContact O-N 3.49Å; N454-E457 VanDerWaalsContact O-N 3.14Å; G455-E457 PolarHBondContact O-N 2.88Å; E457-A459 VanDerWaalsContact C-N 3.33Å; E457-G460 CarbonylContact O-C 3.56Å; E457-G460 PolarHBondContact O-N 3.01Å; E457-S461 PolarHBondContact O-N 3.15Å; E457-S461 PolarHBondContact OE2-OG 2.64Å
458	W	95	Very high	96.4	Very high	15 Å²	15	9.8 Å²	9.8	6%	0.057	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-71.4	-27.9	175.3	-68.7	80	0	0	0	112.5	Q312 Y335 P433 L441 P442 G455 I456	Q312-W458 HydrophobicContact CG-CZ2 3.84Å; Q312-W458 VanDerWaalsContact NE2-CZ2 3.26Å; Y335-W458 HydrophobicContact CE2-CZ2 4.12Å; P433-W458 HydrophobicContact CB-CD2 3.8Å; P433-W458 HydrophobicContact CB-CE3 3.84Å; P433-W458 HydrophobicContact CB-CG 4.37Å; P433-W458 HydrophobicContact CB-CH2 3.9Å; P433-W458 HydrophobicContact CB-CZ2 3.9Å; P433-W458 HydrophobicContact CB-CZ3 3.88Å; P433-W458 HydrophobicContact CG-CD2 3.94Å; P433-W458 HydrophobicContact CG-CE3 4.46Å; P433-W458 HydrophobicContact CG-CG 4.03Å; P433-W458 HydrophobicContact CG-CZ2 4.33Å; L441-W458 HydrophobicContact CD2-CB 3.85Å; P442-W458 VanDerWaalsContact CD-CG 3.47Å; P442-W458 VanDerWaalsContact CG-CD1 3.47Å; P442-W458 HydrophobicContact CG-CD2 4.26Å; P442-W458 HydrophobicContact CG-CG 3.81Å; G455-W458 WeakPolarHBondContact O-CB 3.36Å; G455-W458 PolarHBondContact O-N 3.25Å; I456-W458 PolarHBondContact O-N 3.29Å
459	A	94.9	Very high	96.6	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-32.5	168.1	0	0	0	0	0	111.4	V178 L182 F233 V234 L441 I456 E457 M465	V178-A459 HydrophobicContact CG1-CB 3.78Å; L182-A459 HydrophobicContact CD1-CB 3.92Å; F233-A459 HydrophobicContact CD1-CB 4.43Å; F233-A459 VanDerWaalsContact CD1-O 3.3Å; F233-A459 WeakPolarHBondContact CD1-O 3.41Å; V234-A459 WeakPolarHBondContact CG2-O 3.41Å; L441-A459 HydrophobicContact CD1-CB 4.41Å; L441-A459 HydrophobicContact CD2-CB 4.32Å; I456-A459 WeakPolarHBondContact O-CB 3.42Å; I456-A459 PolarHBondContact O-N 2.99Å; E457-A459 VanDerWaalsContact C-N 3.33Å; A459-M465 HydrophobicContact CB-CE 4.36Å
460	G	94.3	Very high	96.8	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	4%	0.035	C	C	.	.			trans	167.9	130	173.2	0	0	0	0	0	110.3	I456 E457 M465	I456-G460 PolarHBondContact O-N 2.96Å; I456-G460 VanDerWaalsContact O-N 3.15Å; E457-G460 CarbonylContact O-C 3.56Å; E457-G460 PolarHBondContact O-N 3.01Å; G460-M465 VanDerWaalsContact O-CB 3.29Å; G460-M465 WeakPolarHBondContact O-CB 3.36Å; G460-M465 VanDerWaalsContact O-CG 3.3Å; G460-M465 WeakPolarHBondContact O-CG 3.24Å
461	S	94.9	Very high	96.9	Very high	14 Å²	14	6.8 Å²	6.8	10%	0.098	4%	0.04	C	C	.	.			trans	-93.4	113.3	-178	-168.8	0	0	0	0	110.8	Y224 Y435 E457	Y224-S461 PolarHBondContact OH-O 3.23Å; Y435-S461 WeakPolarHBondContact OH-CB 3.33Å; Y435-S461 PolarHBondContact OH-N 3.27Å; Y435-S461 VanDerWaalsContact OH-N 3.14Å; E457-S461 PolarHBondContact O-N 3.15Å; E457-S461 PolarHBondContact OE2-OG 2.64Å
462	A	95.8	Very high	96.9	Very high	33 Å²	33	6.9 Å²	6.9	27%	0.273	4%	0.041	S	C	.	.			trans	-151.4	162.7	171.5	0	0	0	0	0	109.7	V237 E464 M465 S466	V237-A462 HydrophobicContact CG1-CB 4.21Å; A462-E464 VanDerWaalsContact C-N 3.27Å; A462-E464 PolarHBondContact O-N 3.07Å; A462-M465 HydrophobicContact CB-CB 4.36Å; A462-M465 HydrophobicContact CB-CG 4Å; A462-M465 PolarHBondContact O-N 2.93Å; A462-S466 PolarHBondContact O-N 3.37Å; A462-S466 VanDerWaalsContact O-N 3.09Å; A462-S466 PolarHBondContact O-OG 3.41Å
463	M	97.1	Very high	96.9	Very high	20 Å²	20	6.8 Å²	6.8	10%	0.099	4%	0.041	C	C	.	.	H	α-helix	trans	-53.1	-48.8	173.7	-74.8	179.5	-97.5	0	0	111	I43 L74 I90 I91 M98 N253 M465 S466 S467	I43-M463 HydrophobicContact CG2-CG 4.4Å; L74-M463 HydrophobicContact CD1-CG 4.17Å; L74-M463 HydrophobicContact CD1-SD 3.82Å; L74-M463 HydrophobicContact CD2-CE 4.24Å; L74-M463 HydrophobicContact CD2-CG 3.78Å; L74-M463 HydrophobicContact CD2-SD 3.56Å; L74-M463 VanDerWaalsContact CD2-SD 3.56Å; L74-M463 HydrophobicContact CG-SD 4.36Å; I90-M463 WeakPolarHBondContact O-CE 3.4Å; I91-M463 HydrophobicContact CD1-CE 4.37Å; I91-M463 HydrophobicContact CD1-SD 4.18Å; I91-M463 HydrophobicContact CG1-CE 3.51Å; I91-M463 HydrophobicContact CG1-SD 3.86Å; M98-M463 HydrophobicContact CE-SD 3.94Å; M98-M463 HydrophobicContact CG-CB 4.17Å; M98-M463 HydrophobicContact SD-CB 4.09Å; N253-M463 HydrophobicContact CB-SD 4.42Å; M463-M465 PolarHBondContact O-N 2.89Å; M463-S466 WeakPolarHBondContact O-CB 3.31Å; M463-S466 PolarHBondContact O-N 3.49Å; M463-S467 PolarHBondContact O-N 3.25Å; M463-S467 PolarHBondContact O-OG 3.39Å; M463-S467 VanDerWaalsContact O-OG 3.14Å
464	E	97.2	Very high	97	Very high	5 Å²	5	6.7 Å²	6.7	2%	0.023	4%	0.04	C	C	.	.	H	α-helix	trans	-65.5	-40.5	-178.7	-168.3	62.7	-161.6	0	0	112.7	N95 L96 H97 M98 Y166 A462 S466 S467 V468	N95-E464 VanDerWaalsContact C-OE2 3.28Å; N95-E464 VanDerWaalsContact CA-CD 3.46Å; N95-E464 WeakPolarHBondContact CA-OE2 3.25Å; N95-E464 HydrophobicContact CB-CB 3.89Å; N95-E464 HydrophobicContact CB-CG 3.91Å; N95-E464 VanDerWaalsContact CB-OE2 3.26Å; N95-E464 WeakPolarHBondContact CB-OE2 3.45Å; L96-E464 PolarHBondContact N-OE1 3.44Å; H97-E464 VanDerWaalsContact CB-OE1 3.23Å; H97-E464 WeakPolarHBondContact CB-OE1 3.39Å; H97-E464 IonicContact CD2-OE1 3.79Å; H97-E464 PolarHBondContact CD2-OE1 3.38Å; H97-E464 IonicContact CG-OE1 2.64Å; H97-E464 PolarHBondContact N-OE1 3.39Å; M98-E464 WeakPolarHBondContact CG-OE2 3.39Å; M98-E464 PolarHBondContact N-OE2 2.79Å; M98-E464 VanDerWaalsContact N-OE2 3.15Å; Y166-E464 VanDerWaalsContact CE1-OE1 3.24Å; Y166-E464 WeakPolarHBondContact CE1-OE1 3.3Å; Y166-E464 WeakPolarHBondContact OH-CG 3.44Å; Y166-E464 PolarHBondContact OH-OE1 2.79Å; A462-E464 VanDerWaalsContact C-N 3.27Å; A462-E464 PolarHBondContact O-N 3.07Å; E464-S466 VanDerWaalsContact C-N 3.26Å; E464-S466 PolarHBondContact O-N 3.06Å; E464-S467 CarbonylContact O-C 3.56Å; E464-S467 PolarHBondContact O-N 3.01Å; E464-S467 VanDerWaalsContact O-N 3.08Å; E464-V468 HydrophobicContact CG-CG2 4.36Å; E464-V468 WeakPolarHBondContact O-CB 3.34Å; E464-V468 WeakPolarHBondContact O-CG2 3.42Å; E464-V468 PolarHBondContact O-N 3.38Å
465	M	97.6	Very high	97.1	Very high	6 Å²	6	6.7 Å²	6.7	3%	0.03	4%	0.04	C	C	.	.	H	α-helix	trans	-59.5	-40.8	176.8	-66.1	-65	-75.3	0	0	111	F162 F233 V237 I456 A459 G460 A462 M463 V468 A469	F162-M465 HydrophobicContact CE1-SD 4.3Å; F162-M465 HydrophobicContact CE2-CE 4.2Å; F162-M465 HydrophobicContact CE2-SD 3.73Å; F162-M465 HydrophobicContact CZ-CE 4.37Å; F162-M465 HydrophobicContact CZ-SD 3.37Å; F162-M465 WeakPolarHBondContact CZ-SD 3.46Å; F233-M465 HydrophobicContact CE1-CE 4.22Å; V237-M465 HydrophobicContact CG1-CG 4.48Å; I456-M465 HydrophobicContact CD1-CE 3.97Å; I456-M465 HydrophobicContact CG1-CB 4.22Å; I456-M465 HydrophobicContact CG1-CE 4Å; A459-M465 HydrophobicContact CB-CE 4.36Å; G460-M465 VanDerWaalsContact O-CB 3.29Å; G460-M465 WeakPolarHBondContact O-CB 3.36Å; G460-M465 VanDerWaalsContact O-CG 3.3Å; G460-M465 WeakPolarHBondContact O-CG 3.24Å; A462-M465 HydrophobicContact CB-CB 4.36Å; A462-M465 HydrophobicContact CB-CG 4Å; A462-M465 PolarHBondContact O-N 2.93Å; M463-M465 PolarHBondContact O-N 2.89Å; M465-V468 PolarHBondContact O-N 2.72Å; M465-A469 WeakPolarHBondContact O-CB 3.46Å; M465-A469 PolarHBondContact O-N 2.93Å
466	S	98.1	Very high	97.3	Very high	7 Å²	7	6.7 Å²	6.7	5%	0.049	4%	0.04	C	C	.	.	H	α-helix	trans	-65.8	-38.9	174.8	-58.4	0	0	0	0	112.4	A462 M463 E464 A469 A470	A462-S466 PolarHBondContact O-N 3.37Å; A462-S466 VanDerWaalsContact O-N 3.09Å; A462-S466 PolarHBondContact O-OG 3.41Å; M463-S466 WeakPolarHBondContact O-CB 3.31Å; M463-S466 PolarHBondContact O-N 3.49Å; E464-S466 VanDerWaalsContact C-N 3.26Å; E464-S466 PolarHBondContact O-N 3.06Å; S466-A469 PolarHBondContact O-N 3.3Å; S466-A470 WeakPolarHBondContact O-CB 3.43Å; S466-A470 PolarHBondContact O-N 3.49Å
467	S	98.6	Very high	97.3	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-70.6	-37.2	177.2	-58	0	0	0	0	112.8	M463 E464 A470 K471	M463-S467 PolarHBondContact O-N 3.25Å; M463-S467 PolarHBondContact O-OG 3.39Å; M463-S467 VanDerWaalsContact O-OG 3.14Å; E464-S467 CarbonylContact O-C 3.56Å; E464-S467 PolarHBondContact O-N 3.01Å; E464-S467 VanDerWaalsContact O-N 3.08Å; S467-A470 WeakPolarHBondContact O-CB 2.82Å; S467-A470 PolarHBondContact O-N 2.67Å; S467-K471 PolarHBondContact O-N 2.67Å
468	V	98.6	Very high	97.4	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.3	-48.1	171.6	166.3	0	0	0	0	110.1	F162 I165 Q169 L181 E464 M465 A470 K471 N472	F162-V468 HydrophobicContact CE1-CG2 4.46Å; F162-V468 HydrophobicContact CZ-CG2 4.39Å; I165-V468 HydrophobicContact CD1-CG1 4.37Å; I165-V468 HydrophobicContact CG1-CG1 3.64Å; I165-V468 HydrophobicContact CG2-CG2 4.33Å; Q169-V468 PolarHBondContact NE2-O 2.68Å; L181-V468 HydrophobicContact CD1-CG1 4.3Å; E464-V468 HydrophobicContact CG-CG2 4.36Å; E464-V468 WeakPolarHBondContact O-CB 3.34Å; E464-V468 WeakPolarHBondContact O-CG2 3.42Å; E464-V468 PolarHBondContact O-N 3.38Å; M465-V468 PolarHBondContact O-N 2.72Å; V468-A470 VanDerWaalsContact C-N 3.31Å; V468-A470 PolarHBondContact O-N 3.34Å; V468-K471 PolarHBondContact O-N 2.9Å; V468-N472 WeakPolarHBondContact O-CB 3.41Å; V468-N472 PolarHBondContact O-N 3.09Å
469	A	98.6	Very high	97.4	Very high	7 Å²	7	9.5 Å²	9.5	6%	0.058	5%	0.051	C	C	.	.	H	α-helix	trans	-62.6	-38.8	176.2	0	0	0	0	0	112.2	L453 I456 M465 S466 N472 I473	L453-A469 HydrophobicContact CG-CB 4.24Å; I456-A469 HydrophobicContact CB-CB 3.75Å; I456-A469 HydrophobicContact CG1-CB 4.05Å; I456-A469 HydrophobicContact CG2-CB 3.63Å; M465-A469 WeakPolarHBondContact O-CB 3.46Å; M465-A469 PolarHBondContact O-N 2.93Å; S466-A469 PolarHBondContact O-N 3.3Å; A469-N472 WeakPolarHBondContact O-CB 3.28Å; A469-N472 PolarHBondContact O-N 3.21Å; A469-I473 WeakPolarHBondContact O-CG1 3.38Å; A469-I473 PolarHBondContact O-N 3.32Å
470	A	98.8	Very high	97.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60	-47.3	175.2	0	0	0	0	0	112.4	G44 A47 T48 F51 L453 S466 S467 V468 N472 I473 A474	G44-A470 WeakPolarHBondContact O-CB 3.35Å; A47-A470 HydrophobicContact CB-CB 3.69Å; T48-A470 WeakPolarHBondContact OG1-CA 3.48Å; T48-A470 VanDerWaalsContact OG1-CB 3.25Å; T48-A470 WeakPolarHBondContact OG1-CB 3.42Å; F51-A470 HydrophobicContact CD2-CB 4.15Å; F51-A470 HydrophobicContact CE2-CB 4.44Å; L453-A470 HydrophobicContact CD1-CB 4.08Å; S466-A470 WeakPolarHBondContact O-CB 3.43Å; S466-A470 PolarHBondContact O-N 3.49Å; S467-A470 WeakPolarHBondContact O-CB 2.82Å; S467-A470 PolarHBondContact O-N 2.67Å; V468-A470 VanDerWaalsContact C-N 3.31Å; V468-A470 PolarHBondContact O-N 3.34Å; A470-N472 VanDerWaalsContact C-N 3.33Å; A470-I473 PolarHBondContact O-N 3.39Å; A470-A474 WeakPolarHBondContact O-CB 3.35Å; A470-A474 PolarHBondContact O-N 3.36Å
471	K	98.8	Very high	97.4	Very high	24 Å²	24	15.7 Å²	15.7	10%	0.104	8%	0.075	C	C	.	.	H	α-helix	trans	-64.5	-40.3	176.2	-175.7	60.8	173	-175.4	0	111.5	F51 H55 Q169 S467 V468 A474 L475	F51-K471 HydrophobicContact CB-CD 4.16Å; F51-K471 HydrophobicContact CD1-CD 3.56Å; F51-K471 HydrophobicContact CD2-CB 3.75Å; F51-K471 HydrophobicContact CD2-CD 3.99Å; F51-K471 HydrophobicContact CD2-CG 4.48Å; F51-K471 HydrophobicContact CE1-CD 3.79Å; F51-K471 HydrophobicContact CE2-CB 3.61Å; F51-K471 HydrophobicContact CE2-CD 4.19Å; F51-K471 HydrophobicContact CE2-CG 4.41Å; F51-K471 HydrophobicContact CG-CB 4.31Å; F51-K471 HydrophobicContact CG-CD 3.65Å; F51-K471 HydrophobicContact CZ-CB 4.07Å; F51-K471 HydrophobicContact CZ-CD 4.08Å; F51-K471 HydrophobicContact CZ-CG 4.46Å; H55-K471 PolarHBondContact NE2-NZ 2.96Å; H55-K471 VanDerWaalsContact NE2-NZ 3.19Å; Q169-K471 HydrophobicContact CB-CG 4Å; Q169-K471 HydrophobicContact CG-CG 4.11Å; S467-K471 PolarHBondContact O-N 2.67Å; V468-K471 PolarHBondContact O-N 2.9Å; K471-A474 PolarHBondContact O-N 3.19Å; K471-L475 HydrophobicContact CG-CD1 4.19Å; K471-L475 WeakPolarHBondContact O-CG 3.31Å; K471-L475 PolarHBondContact O-N 3.32Å
472	N	98.6	Very high	97.3	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.011	8%	0.084	C	C	.	.	H	α-helix	trans	-60.2	-48.6	176.5	-175.8	70.2	0	0	0	111.7	A174 F175 V468 A469 A470 A474 L475 L476	A174-N472 WeakPolarHBondContact CA-OD1 3.31Å; F175-N472 WeakPolarHBondContact CD2-OD1 3.42Å; F175-N472 PolarHBondContact N-OD1 3.28Å; F175-N472 PolarHBondContact O-ND2 3.5Å; V468-N472 WeakPolarHBondContact O-CB 3.41Å; V468-N472 PolarHBondContact O-N 3.09Å; A469-N472 WeakPolarHBondContact O-CB 3.28Å; A469-N472 PolarHBondContact O-N 3.21Å; A470-N472 VanDerWaalsContact C-N 3.33Å; N472-A474 PolarHBondContact O-N 2.98Å; N472-L475 PolarHBondContact O-N 3.5Å; N472-L476 VanDerWaalsContact O-CB 3.29Å; N472-L476 WeakPolarHBondContact O-CB 3.46Å; N472-L476 PolarHBondContact O-N 3.38Å
473	I	98.7	Very high	97.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63	-42.3	178.5	-73.4	169.5	0	0	0	111.1	V306 V444 Y451 L453 A469 A470 L475 L476 A477	V306-I473 HydrophobicContact CG1-CD1 4.12Å; V306-I473 HydrophobicContact CG1-CG2 3.97Å; V306-I473 HydrophobicContact CG2-CG2 3.74Å; V444-I473 HydrophobicContact CG1-CD1 4.1Å; V444-I473 HydrophobicContact CG1-CG1 3.56Å; Y451-I473 HydrophobicContact CD2-CG2 4.12Å; Y451-I473 HydrophobicContact CG-CG2 3.88Å; L453-I473 HydrophobicContact CB-CD1 3.75Å; L453-I473 HydrophobicContact CD1-CD1 4.49Å; L453-I473 HydrophobicContact CG-CD1 4.23Å; A469-I473 WeakPolarHBondContact O-CG1 3.38Å; A469-I473 PolarHBondContact O-N 3.32Å; A470-I473 PolarHBondContact O-N 3.39Å; I473-L475 VanDerWaalsContact C-N 3.33Å; I473-L475 PolarHBondContact O-N 2.98Å; I473-L476 PolarHBondContact O-N 2.76Å; I473-A477 WeakPolarHBondContact O-CB 3.5Å; I473-A477 PolarHBondContact O-N 2.52Å
474	A	98.5	Very high	96.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.1	-40.3	179.1	0	0	0	0	0	112.2	F51 L52 A470 K471 N472 Y478	F51-A474 HydrophobicContact CB-CB 3.5Å; F51-A474 VanDerWaalsContact CB-CB 3.5Å; L52-A474 HydrophobicContact CD2-CB 4.08Å; L52-A474 HydrophobicContact CG-CB 4.23Å; A470-A474 WeakPolarHBondContact O-CB 3.35Å; A470-A474 PolarHBondContact O-N 3.36Å; K471-A474 PolarHBondContact O-N 3.19Å; N472-A474 PolarHBondContact O-N 2.98Å; A474-Y478 WeakPolarHBondContact O-CB 3.4Å; A474-Y478 PolarHBondContact O-N 3.36Å; A474-Y478 VanDerWaalsContact O-N 3.15Å
475	L	98.4	Very high	96.5	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-66.2	-50.2	172.5	-73.5	166.5	0	0	0	111.4	H55 Q169 Y173 A174 K471 N472 I473 A477 Y478 H479	H55-L475 WeakPolarHBondContact CE1-CD2 3.19Å; H55-L475 WeakPolarHBondContact NE2-CD2 3.47Å; Q169-L475 HydrophobicContact CB-CD1 4.09Å; Q169-L475 HydrophobicContact CG-CD1 4.17Å; Y173-L475 WeakPolarHBondContact O-CD1 3.31Å; A174-L475 HydrophobicContact CB-CB 3.79Å; K471-L475 HydrophobicContact CG-CD1 4.19Å; K471-L475 WeakPolarHBondContact O-CG 3.31Å; K471-L475 PolarHBondContact O-N 3.32Å; N472-L475 PolarHBondContact O-N 3.5Å; I473-L475 VanDerWaalsContact C-N 3.33Å; I473-L475 PolarHBondContact O-N 2.98Å; L475-A477 VanDerWaalsContact C-N 3.34Å; L475-A477 PolarHBondContact O-N 2.87Å; L475-Y478 WeakPolarHBondContact O-CB 3.41Å; L475-Y478 PolarHBondContact O-N 2.91Å; L475-Y478 VanDerWaalsContact O-N 3.11Å; L475-H479 PolarHBondContact O-CD2 3.21Å; L475-H479 PolarHBondContact O-N 3.41Å
476	L	97.8	Very high	96.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.1	-47.6	-179.2	-176.9	62.8	0	0	0	111.4	A174 V444 Y451 N472 I473 Y478 H479 R480 V488	A174-L476 HydrophobicContact CB-CB 3.99Å; A174-L476 HydrophobicContact CB-CD1 4.42Å; V444-L476 HydrophobicContact CG1-CD2 4.17Å; Y451-L476 HydrophobicContact CD1-CD2 3.95Å; Y451-L476 HydrophobicContact CE1-CD2 3.63Å; Y451-L476 HydrophobicContact CE1-CG 3.88Å; N472-L476 VanDerWaalsContact O-CB 3.29Å; N472-L476 WeakPolarHBondContact O-CB 3.46Å; N472-L476 PolarHBondContact O-N 3.38Å; I473-L476 PolarHBondContact O-N 2.76Å; L476-Y478 VanDerWaalsContact C-N 3.34Å; L476-Y478 PolarHBondContact O-N 3.44Å; L476-H479 PolarHBondContact O-N 3.06Å; L476-R480 HydrophobicContact CD1-CG 4.17Å; L476-R480 HydrophobicContact CG-CG 4.35Å; L476-R480 WeakPolarHBondContact O-CB 3.26Å; L476-R480 WeakPolarHBondContact O-CG 3.33Å; L476-R480 PolarHBondContact O-N 3.03Å; L476-V488 HydrophobicContact CD1-CB 4.48Å; L476-V488 HydrophobicContact CD1-CG1 3.64Å; L476-V488 HydrophobicContact CD1-CG2 3.92Å
477	A	97.7	Very high	96	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.1	-45.2	176.1	0	0	0	0	0	111.5	L52 F56 I304 Y451 I473 L475 W481	L52-A477 HydrophobicContact CD2-CB 4.4Å; F56-A477 HydrophobicContact CE2-CB 4.37Å; F56-A477 HydrophobicContact CZ-CB 4.47Å; I304-A477 HydrophobicContact CD1-CB 4.37Å; I304-A477 HydrophobicContact CG2-CB 4.48Å; Y451-A477 HydrophobicContact CD2-CB 4.34Å; Y451-A477 HydrophobicContact CE2-CB 3.64Å; I473-A477 WeakPolarHBondContact O-CB 3.5Å; I473-A477 PolarHBondContact O-N 2.52Å; L475-A477 VanDerWaalsContact C-N 3.34Å; L475-A477 PolarHBondContact O-N 2.87Å; A477-W481 WeakPolarHBondContact O-CB 3.47Å; A477-W481 PolarHBondContact O-N 2.95Å
478	Y	97.1	Very high	95.8	Very high	68 Å²	68	36.5 Å²	36.5	27%	0.267	17%	0.174	S	C	.	.	H	α-helix	trans	-61.9	-45.4	176.9	-178.6	-93.2	0	0	0	112.4	H55 F56 A474 L475 L476 N482	H55-Y478 HydrophobicContact CB-CD2 3.9Å; H55-Y478 HydrophobicContact CB-CG 4.2Å; H55-Y478 WeakPolarHBondContact O-CE2 3.48Å; F56-Y478 HydrophobicContact CD1-CD2 4.08Å; F56-Y478 AromaticContact CE1-CD2 3.97Å; F56-Y478 HydrophobicContact CE1-CD2 3.97Å; F56-Y478 HydrophobicContact CG-CD2 4.49Å; F56-Y478 HydrophobicContact CZ-CD2 4.26Å; A474-Y478 WeakPolarHBondContact O-CB 3.4Å; A474-Y478 PolarHBondContact O-N 3.36Å; A474-Y478 VanDerWaalsContact O-N 3.15Å; L475-Y478 WeakPolarHBondContact O-CB 3.41Å; L475-Y478 PolarHBondContact O-N 2.91Å; L475-Y478 VanDerWaalsContact O-N 3.11Å; L476-Y478 VanDerWaalsContact C-N 3.34Å; L476-Y478 PolarHBondContact O-N 3.44Å; Y478-N482 VanDerWaalsContact CE2-ND2 3.35Å; Y478-N482 WeakPolarHBondContact CE2-ND2 3.48Å; Y478-N482 WeakPolarHBondContact O-CB 3.5Å; Y478-N482 PolarHBondContact O-N 2.91Å; Y478-N482 PolarHBondContact O-ND2 2.93Å
479	H	96.3	Very high	95.5	Very high	9 Å²	9	38.6 Å²	38.6	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-68.2	-42.1	179.3	-64.8	-46.8	0	0	0	112.6	G172 L475 L476 N482 K483 Q484 V488	G172-H479 PolarHBondContact O-CE1 2.98Å; G172-H479 PolarHBondContact O-NE2 3.26Å; L475-H479 PolarHBondContact O-CD2 3.21Å; L475-H479 PolarHBondContact O-N 3.41Å; L476-H479 PolarHBondContact O-N 3.06Å; H479-N482 CarbonylContact O-C 3.49Å; H479-N482 PolarHBondContact O-N 3.5Å; H479-K483 CarbonylContact O-C 3.53Å; H479-K483 PolarHBondContact O-N 3.28Å; H479-Q484 HydrophobicContact CB-CB 4.11Å; H479-Q484 PolarHBondContact ND1-OE1 3.1Å; H479-Q484 PolarHBondContact O-N 3.3Å; H479-V488 HydrophobicContact CB-CG2 3.83Å
480	R	94.8	Very high	95.1	Very high	91 Å²	91	40.2 Å²	40.2	34%	0.343	19%	0.192	S	C	.	.	H	α-helix	trans	-61.2	-46.1	175.8	-72	-68.2	-165.4	-142.3	-4	111	E445 L476 N482 K483	E445-R480 IonicContact OE1-NE 2.96Å; E445-R480 IonicContact OE2-CZ 3.86Å; E445-R480 IonicContact OE2-NE 2.78Å; E445-R480 PolarHBondContact OE2-NE 3.26Å; E445-R480 VanDerWaalsContact OE2-NE 3.16Å; E445-R480 IonicContact OE2-NH2 2.68Å; E445-R480 PolarHBondContact OE2-NH2 3.08Å; L476-R480 HydrophobicContact CD1-CG 4.17Å; L476-R480 HydrophobicContact CG-CG 4.35Å; L476-R480 WeakPolarHBondContact O-CB 3.26Å; L476-R480 WeakPolarHBondContact O-CG 3.33Å; L476-R480 PolarHBondContact O-N 3.03Å; R480-N482 VanDerWaalsContact C-N 3.35Å; R480-N482 PolarHBondContact O-N 3.27Å; R480-K483 PolarHBondContact O-N 3.31Å
481	W	94.1	Very high	94.5	Very high	40 Å²	40	47.4 Å²	47.4	15%	0.152	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-43.6	178	-167.2	-92.8	0	0	0	112.5	H27 A31 P33 F56 D303 I304 A477 K483	H27-W481 AromaticContact CE1-CZ2 3.43Å; H27-W481 VanDerWaalsContact CE1-CZ2 3.43Å; H27-W481 WeakPolarHBondContact CE1-CZ2 3.44Å; H27-W481 AromaticContact NE2-CH2 3.88Å; H27-W481 AromaticContact NE2-CZ2 3.68Å; A31-W481 PolarHBondContact O-NE1 3.17Å; P33-W481 HydrophobicContact CB-CD2 4.21Å; P33-W481 HydrophobicContact CB-CE3 4.32Å; P33-W481 HydrophobicContact CB-CH2 3.77Å; P33-W481 HydrophobicContact CB-CZ2 3.6Å; P33-W481 HydrophobicContact CB-CZ3 4.12Å; P33-W481 HydrophobicContact CG-CD2 4.36Å; P33-W481 HydrophobicContact CG-CZ2 4.4Å; F56-W481 HydrophobicContact CE1-CB 4.13Å; F56-W481 HydrophobicContact CE1-CG 4.09Å; F56-W481 HydrophobicContact CZ-CB 4.29Å; D303-W481 HydrophobicContact CB-CH2 3.67Å; D303-W481 HydrophobicContact CB-CZ3 3.84Å; I304-W481 HydrophobicContact CD1-CD2 4.47Å; I304-W481 HydrophobicContact CD1-CE3 3.92Å; I304-W481 HydrophobicContact CD1-CZ3 4.44Å; I304-W481 HydrophobicContact CG1-CE3 4.11Å; I304-W481 HydrophobicContact CG1-CZ3 4.21Å; A477-W481 WeakPolarHBondContact O-CB 3.47Å; A477-W481 PolarHBondContact O-N 2.95Å; W481-K483 VanDerWaalsContact C-N 3.32Å; W481-K483 PolarHBondContact O-N 3.21Å
482	N	93.3	Very high	93.6	Very high	53 Å²	53	52.5 Å²	52.5	28%	0.283	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	8.7	179.7	-66.8	-70.4	0	0	0	114.2	Y478 H479 R480 Q484	Y478-N482 VanDerWaalsContact CE2-ND2 3.35Å; Y478-N482 WeakPolarHBondContact CE2-ND2 3.48Å; Y478-N482 WeakPolarHBondContact O-CB 3.5Å; Y478-N482 PolarHBondContact O-N 2.91Å; Y478-N482 PolarHBondContact O-ND2 2.93Å; H479-N482 CarbonylContact O-C 3.49Å; H479-N482 PolarHBondContact O-N 3.5Å; R480-N482 VanDerWaalsContact C-N 3.35Å; R480-N482 PolarHBondContact O-N 3.27Å; N482-Q484 HydrophobicContact CB-CG 4.07Å; N482-Q484 PolarHBondContact O-N 3.19Å
483	K	92	Very high	92.8	Very high	150 Å²	150	52.6 Å²	52.6	65%	0.652	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	30.9	-179.1	-55	170.6	-177	165.6	0	114	D29 H479 R480 W481 T485	D29-K483 IonicContact OD1-NZ 2.97Å; D29-K483 PolarHBondContact OD1-NZ 2.85Å; H479-K483 CarbonylContact O-C 3.53Å; H479-K483 PolarHBondContact O-N 3.28Å; R480-K483 PolarHBondContact O-N 3.31Å; W481-K483 VanDerWaalsContact C-N 3.32Å; W481-K483 PolarHBondContact O-N 3.21Å; K483-T485 PolarHBondContact O-N 3.41Å
484	Q	91.3	Very high	91.7	Very high	70 Å²	70	55.1 Å²	55.1	33%	0.327	26%	0.264	S	S	.	.			trans	-88.2	80.2	179.4	-66.9	178.7	-24.3	0	0	111.7	H479 N482 D486	H479-Q484 HydrophobicContact CB-CB 4.11Å; H479-Q484 PolarHBondContact ND1-OE1 3.1Å; H479-Q484 PolarHBondContact O-N 3.3Å; N482-Q484 HydrophobicContact CB-CG 4.07Å; N482-Q484 PolarHBondContact O-N 3.19Å; Q484-D486 VanDerWaalsContact C-N 3.32Å; Q484-D486 PolarHBondContact O-N 3.47Å
485	T	88.8	Confident	90.6	Very high	103 Å²	103	61.2 Å²	61.2	63%	0.632	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-76.1	-18.4	-175.5	54.1	0	0	0	0	114.2	K483 M487 V488 Q490	K483-T485 PolarHBondContact O-N 3.41Å; T485-M487 PolarHBondContact O-N 3.33Å; T485-V488 PolarHBondContact O-N 2.87Å; T485-Q490 PolarHBondContact O-NE2 2.85Å
486	D	91.3	Very high	89.5	Confident	100 Å²	100	65.6 Å²	65.6	54%	0.535	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-73.6	-12	179.9	60.9	-38.4	0	0	0	114	Q484 Q490	Q484-D486 VanDerWaalsContact C-N 3.32Å; Q484-D486 PolarHBondContact O-N 3.47Å; D486-Q490 WeakPolarHBondContact O-CG 3.24Å; D486-Q490 PolarHBondContact O-NE2 3.08Å
487	M	93.4	Very high	88.5	Confident	35 Å²	35	65.6 Å²	65.6	17%	0.172	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-98.4	-7.2	177.5	-60	-54.2	-61.9	0	0	113.6	H171 G172 Y173 A174 T485	H171-M487 WeakPolarHBondContact O-CE 3.27Å; G172-M487 WeakPolarHBondContact O-CE 3.28Å; Y173-M487 WeakPolarHBondContact CA-O 3.29Å; Y173-M487 HydrophobicContact CD1-CE 3.9Å; Y173-M487 HydrophobicContact CE1-CE 3.94Å; Y173-M487 HydrophobicContact CE1-SD 4.31Å; Y173-M487 HydrophobicContact CG-CE 4.38Å; A174-M487 PolarHBondContact N-O 3.16Å; T485-M487 PolarHBondContact O-N 3.33Å
488	V	94.8	Very high	87.2	Confident	10 Å²	10	72.5 Å²	72.5	6%	0.061	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-109.2	135.7	-174	-176	0	0	0	0	110.6	A174 L476 H479 T485 Q490	A174-V488 WeakPolarHBondContact O-CA 3.49Å; L476-V488 HydrophobicContact CD1-CB 4.48Å; L476-V488 HydrophobicContact CD1-CG1 3.64Å; L476-V488 HydrophobicContact CD1-CG2 3.92Å; H479-V488 HydrophobicContact CB-CG2 3.83Å; T485-V488 PolarHBondContact O-N 2.87Å; V488-Q490 PolarHBondContact O-N 3.3Å; V488-Q490 VanDerWaalsContact O-N 3.14Å; V488-Q490 PolarHBondContact O-NE2 3.45Å
489	D	92.8	Very high	85.7	Confident	45 Å²	45	73.6 Å²	73.6	24%	0.241	35%	0.353	C	S	.	.	S	Bend	trans	50.6	38.6	174.6	-57.4	-34.6	0	0	0	114.3	A174 F175 S176	A174-D489 PolarHBondContact O-N 3.25Å; F175-D489 VanDerWaalsContact CA-OD1 3.27Å; F175-D489 WeakPolarHBondContact CA-OD1 3.48Å; S176-D489 WeakPolarHBondContact CB-OD2 3.38Å; S176-D489 PolarHBondContact N-OD1 2.97Å; S176-D489 VanDerWaalsContact OG-CG 3.27Å; S176-D489 PolarHBondContact OG-OD1 3.43Å; S176-D489 PolarHBondContact OG-OD2 2.97Å
490	Q	90.4	Very high	83.8	Confident	40 Å²	40	79.1 Å²	79.1	19%	0.187	38%	0.379	C	S	.	.			trans	-74	136.7	179	-64.6	-55.9	-56.4	0	0	111.4	Y173 T485 D486 V488 L493	Y173-Q490 HydrophobicContact CD1-CB 4.34Å; Y173-Q490 HydrophobicContact CD1-CG 4.14Å; Y173-Q490 HydrophobicContact CE1-CB 4.34Å; Y173-Q490 HydrophobicContact CE1-CG 4.07Å; T485-Q490 PolarHBondContact O-NE2 2.85Å; D486-Q490 WeakPolarHBondContact O-CG 3.24Å; D486-Q490 PolarHBondContact O-NE2 3.08Å; V488-Q490 PolarHBondContact O-N 3.3Å; V488-Q490 VanDerWaalsContact O-N 3.14Å; V488-Q490 PolarHBondContact O-NE2 3.45Å; Q490-L493 HydrophobicContact CB-CD2 3.67Å; Q490-L493 HydrophobicContact CB-CG 4.22Å; Q490-L493 WeakPolarHBondContact O-CG 3.29Å
491	K	85.1	Confident	81.3	Confident	152 Å²	152	82.5 Å²	82.5	66%	0.661	40%	0.403	S	S	*	.	S	Bend	trans	-87.3	155.8	176.1	-60.6	-172.1	179.2	-173.6	0	111.5	L493	K491-L493 PolarHBondContact O-N 2.88Å
492	D	79.7	Confident	80.7	Confident	131 Å²	131	84.7 Å²	84.7	70%	0.701	42%	0.415	S	S	*	.			trans	55.3	35	174.9	-58.4	-47.2	0	0	0	114.6	M494 H495 R496	D492-M494 VanDerWaalsContact C-N 3.25Å; D492-M494 PolarHBondContact O-N 3.43Å; D492-H495 HydrophobicContact CB-CB 4.48Å; D492-H495 WeakPolarHBondContact O-CB 3.41Å; D492-H495 PolarHBondContact O-N 3.47Å; D492-R496 PolarHBondContact O-N 2.91Å; D492-R496 VanDerWaalsContact O-N 3.09Å
493	L	83.3	Confident	80	Confident	4 Å²	4	86.3 Å²	86.3	2%	0.021	42%	0.422	C	S	.	.	H	α-helix	trans	-52.4	-40.2	-178.8	-75	176.2	0	0	0	113.3	Y168 Y173 F175 Q490 K491 H495 R496 I497	Y168-L493 HydrophobicContact CD1-CB 4.14Å; Y168-L493 HydrophobicContact CD1-CD1 4.26Å; Y168-L493 HydrophobicContact CD2-CD1 3.89Å; Y168-L493 HydrophobicContact CE1-CB 3.66Å; Y168-L493 HydrophobicContact CE1-CD1 4.4Å; Y168-L493 HydrophobicContact CE2-CB 4.34Å; Y168-L493 HydrophobicContact CE2-CD1 4.01Å; Y168-L493 HydrophobicContact CG-CD1 4.01Å; Y173-L493 HydrophobicContact CD1-CD2 3.57Å; Y173-L493 HydrophobicContact CD2-CD1 4.38Å; Y173-L493 HydrophobicContact CD2-CD2 3.66Å; Y173-L493 HydrophobicContact CE1-CD2 3.48Å; Y173-L493 VanDerWaalsContact CE1-CD2 3.48Å; Y173-L493 HydrophobicContact CE2-CD2 3.55Å; Y173-L493 HydrophobicContact CG-CD1 4.15Å; Y173-L493 HydrophobicContact CG-CD2 3.64Å; Y173-L493 VanDerWaalsContact CZ-CD2 3.45Å; F175-L493 HydrophobicContact CE1-CD1 4Å; F175-L493 HydrophobicContact CZ-CD1 3.84Å; Q490-L493 HydrophobicContact CB-CD2 3.67Å; Q490-L493 HydrophobicContact CB-CG 4.22Å; Q490-L493 WeakPolarHBondContact O-CG 3.29Å; K491-L493 PolarHBondContact O-N 2.88Å; L493-H495 PolarHBondContact O-N 2.96Å; L493-R496 PolarHBondContact O-N 3.31Å; L493-I497 HydrophobicContact CB-CD1 4.44Å; L493-I497 VanDerWaalsContact O-CG1 3.23Å; L493-I497 WeakPolarHBondContact O-CG1 3.38Å; L493-I497 PolarHBondContact O-N 3.46Å
494	M	74.8	Confident	79.3	Confident	52 Å²	52	82.8 Å²	82.8	26%	0.256	41%	0.41	S	S	.	.	H	α-helix	trans	-59.4	-36.2	177.1	-81.4	-53.5	-64.1	0	0	113.2	R164 Y168 D492 K498	R164-M494 HydrophobicContact CB-SD 4.41Å; R164-M494 HydrophobicContact CG-SD 3.89Å; Y168-M494 HydrophobicContact CE1-CG 4.41Å; Y168-M494 HydrophobicContact CE1-SD 3.98Å; Y168-M494 VanDerWaalsContact OH-CG 3.28Å; Y168-M494 WeakPolarHBondContact OH-CG 3.49Å; D492-M494 VanDerWaalsContact C-N 3.25Å; D492-M494 PolarHBondContact O-N 3.43Å; M494-K498 WeakPolarHBondContact O-CB 3.43Å; M494-K498 VanDerWaalsContact O-CG 3.27Å; M494-K498 WeakPolarHBondContact O-CG 3.33Å; M494-K498 PolarHBondContact O-N 2.82Å
495	H	74.6	Confident	78.6	Confident	129 Å²	129	83.5 Å²	83.5	60%	0.597	41%	0.414	S	S	*	.	H	α-helix	trans	-73.9	-48	177	-174.3	-77.4	0	0	0	109.9	D492 L493 I497 K498 T499	D492-H495 HydrophobicContact CB-CB 4.48Å; D492-H495 WeakPolarHBondContact O-CB 3.41Å; D492-H495 PolarHBondContact O-N 3.47Å; L493-H495 PolarHBondContact O-N 2.96Å; H495-I497 PolarHBondContact O-N 3.38Å; H495-K498 WeakPolarHBondContact O-CB 3.28Å; H495-K498 PolarHBondContact O-N 2.86Å; H495-T499 PolarHBondContact O-N 3.32Å; H495-T499 PolarHBondContact O-OG1 3.23Å; H495-T499 VanDerWaalsContact O-OG1 3.09Å
496	R	76.3	Confident	78	Confident	96 Å²	96	82.3 Å²	82.3	36%	0.362	40%	0.401	S	S	.	.	H	α-helix	trans	-56.4	-49.3	-179.7	-69.6	-171.5	179.7	-171.9	5.5	112.6	D492 L493 K498 T499 E500	D492-R496 PolarHBondContact O-N 2.91Å; D492-R496 VanDerWaalsContact O-N 3.09Å; L493-R496 PolarHBondContact O-N 3.31Å; R496-K498 PolarHBondContact O-N 3.15Å; R496-T499 WeakPolarHBondContact CA-OG1 3.49Å; R496-T499 PolarHBondContact O-N 2.78Å; R496-T499 PolarHBondContact O-OG1 2.68Å; R496-E500 WeakPolarHBondContact O-CB 3.09Å; R496-E500 WeakPolarHBondContact O-CG 3.31Å; R496-E500 PolarHBondContact O-N 2.81Å
497	I	76.8	Confident	77.1	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-71.8	-17.9	-178.8	-49	161.5	0	0	0	111.9	K167 Y168 H171 Y173 L493 H495 L501	K167-I497 HydrophobicContact CD-CG2 4.24Å; K167-I497 HydrophobicContact CG-CD1 4.43Å; Y168-I497 HydrophobicContact CD1-CD1 3.51Å; Y168-I497 HydrophobicContact CE1-CD1 3.82Å; H171-I497 WeakPolarHBondContact NE2-CG2 3.31Å; Y173-I497 HydrophobicContact CD2-CD1 4.29Å; Y173-I497 HydrophobicContact CE2-CD1 3.91Å; Y173-I497 HydrophobicContact CE2-CG1 3.88Å; L493-I497 HydrophobicContact CB-CD1 4.44Å; L493-I497 VanDerWaalsContact O-CG1 3.23Å; L493-I497 WeakPolarHBondContact O-CG1 3.38Å; L493-I497 PolarHBondContact O-N 3.46Å; H495-I497 PolarHBondContact O-N 3.38Å; I497-L501 HydrophobicContact CG2-CD1 4.05Å; I497-L501 WeakPolarHBondContact O-CD1 3.3Å; I497-L501 WeakPolarHBondContact O-CG 3.48Å
498	K	71.2	Confident	76	Confident	145 Å²	145	84.4 Å²	84.4	63%	0.63	41%	0.408	S	S	*	.	H	α-helix	trans	-82	-22.4	170.8	-80.4	-178.3	179.3	-175.8	0	112.9	M494 H495 R496	M494-K498 WeakPolarHBondContact O-CB 3.43Å; M494-K498 VanDerWaalsContact O-CG 3.27Å; M494-K498 WeakPolarHBondContact O-CG 3.33Å; M494-K498 PolarHBondContact O-N 2.82Å; H495-K498 WeakPolarHBondContact O-CB 3.28Å; H495-K498 PolarHBondContact O-N 2.86Å; R496-K498 PolarHBondContact O-N 3.15Å
499	T	64.7	Low	74.5	Confident	90 Å²	90	90.2 Å²	90.2	55%	0.552	43%	0.434	S	S	*	.	H	α-helix	trans	-95.3	-22.3	178.8	47.4	0	0	0	0	113.5	H495 R496	H495-T499 PolarHBondContact O-N 3.32Å; H495-T499 PolarHBondContact O-OG1 3.23Å; H495-T499 VanDerWaalsContact O-OG1 3.09Å; R496-T499 WeakPolarHBondContact CA-OG1 3.49Å; R496-T499 PolarHBondContact O-N 2.78Å; R496-T499 PolarHBondContact O-OG1 2.68Å
500	E	56.7	Low	73	Confident	125 Å²	125	93.9 Å²	93.9	58%	0.584	45%	0.45	S	S	*	.			trans	-85.9	-11.1	175.9	-70.6	170.9	-170.9	0	0	113.2	R496	R496-E500 WeakPolarHBondContact O-CB 3.09Å; R496-E500 WeakPolarHBondContact O-CG 3.31Å; R496-E500 PolarHBondContact O-N 2.81Å
501	L	42.5	Very low	71.4	Confident	163 Å²	163	98.8 Å²	98.8	85%	0.853	47%	0.474	S	S	*	.			trans	-107.6	0	170.1	-68.3	171.8	0	0	0	109.5	I497	I497-L501 HydrophobicContact CG2-CD1 4.05Å; I497-L501 WeakPolarHBondContact O-CD1 3.3Å; I497-L501 WeakPolarHBondContact O-CG 3.48Å

Retrieved 501 of 501 residues in 493.2 ms (Link to these results)

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