G2J5S7_MAIZE Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G2J5S7, Species MAIZE (Zea mays, Maize), Gene LOC100275344, Length 698 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	37.8	Very low	36.6	Very low	226 Å²	226	143.7 Å²	143.7	100%	1.113	84%	0.837	S	S	*	*				0	100.6	0	-71.7	-175.9	-176.3	0	0	105.3	F3	M1-F3 HydrophobicContact CB-CE2 4.47Å
2	D	34.3	Very low	36.7	Very low	171 Å²	171	141.5 Å²	141.5	91%	0.914	84%	0.836	S	S	*	*			trans	-97.3	112.1	-173.1	-150.3	2.1	0	0	0	106.1
3	F	40.8	Very low	36.3	Very low	189 Å²	189	143.8 Å²	143.8	83%	0.829	84%	0.842	S	S	*	*			trans	-96.6	106.3	178.1	-82.3	-85.5	0	0	0	107.7	M1	M1-F3 HydrophobicContact CB-CE2 4.47Å
4	G	31.4	Very low	36.4	Very low	64 Å²	64	140 Å²	140	66%	0.66	84%	0.835	S	S	*	*			trans	-69	146.4	157.7	0	0	0	0	0	110
5	D	41.7	Very low	36.5	Very low	166 Å²	166	142.9 Å²	142.9	89%	0.888	84%	0.837	S	S	*	*			trans	-154.5	122.9	135.7	-101.1	-22.7	0	0	0	109.1
6	D	37	Very low	36.5	Very low	150 Å²	150	149.4 Å²	149.4	80%	0.802	84%	0.843	S	S	*	*			trans	-65.6	131.8	172.4	-73.5	-63.6	0	0	0	111
7	V	45.3	Very low	36.6	Very low	143 Å²	143	154.5 Å²	154.5	87%	0.867	85%	0.846	S	S	*	*			trans	-126.7	101.4	152.7	-174.2	0	0	0	0	108.3
8	M	34.8	Very low	36.8	Very low	174 Å²	174	156.7 Å²	156.7	86%	0.857	85%	0.845	S	S	*	*			trans	-75.1	122.2	161.1	-74.9	-98.1	169.8	0	0	109.2
9	D	37.8	Very low	37.2	Very low	160 Å²	160	158.8 Å²	158.8	86%	0.856	85%	0.846	S	S	*	*			trans	-152.5	132.8	138.9	-165.2	15.7	0	0	0	110.4
10	G	28.4	Very low	37.6	Very low	70 Å²	70	162.8 Å²	162.8	72%	0.722	85%	0.849	S	S	*	*			trans	-89.7	142.2	-173.8	0	0	0	0	0	112
11	G	33.6	Very low	38.4	Very low	68 Å²	68	165.8 Å²	165.8	70%	0.701	85%	0.85	S	S	*	*			trans	-158.7	77.2	177.4	0	0	0	0	0	112.7
12	S	37.8	Very low	39.8	Very low	117 Å²	117	160.6 Å²	160.6	82%	0.818	82%	0.823	S	S	*	*			trans	44.3	113.5	148.4	60.2	0	0	0	0	120.1	A14	S12-A14 PolarHBondContact O-N 3.02Å
13	D	31.9	Very low	42	Very low	171 Å²	171	163.5 Å²	163.5	91%	0.914	82%	0.821	S	S	*	*			trans	-41.5	126	155.1	-86.3	-55.4	0	0	0	114.7
14	A	37.9	Very low	44.2	Very low	91 Å²	91	156.5 Å²	156.5	75%	0.752	79%	0.791	S	S	*	*			trans	-159.1	90.1	145.1	0	0	0	0	0	111.1	S12	S12-A14 PolarHBondContact O-N 3.02Å
15	Q	36.8	Very low	47	Very low	183 Å²	183	156.4 Å²	156.4	86%	0.855	78%	0.778	S	S	*	*			trans	46.4	90.8	147.8	-71.3	167	-15.4	0	0	117.2	R17	Q15-R17 VanDerWaalsContact C-N 3.29Å; Q15-R17 PolarHBondContact O-N 3.47Å
16	R	37.6	Very low	49.3	Very low	247 Å²	247	153.4 Å²	153.4	93%	0.932	77%	0.767	S	S	*	*			trans	-44.7	87.6	153.6	-75.4	169.4	148.5	-174.6	-6	111.3	K18	R16-K18 PolarHBondContact O-N 3.39Å
17	R	38.1	Very low	51.9	Low	237 Å²	237	154.8 Å²	154.8	89%	0.894	76%	0.761	S	S	*	*			trans	-63.2	91.4	158.6	-79.9	-176.4	167.7	-174	-2.6	106.8	Q15 K19	Q15-R17 VanDerWaalsContact C-N 3.29Å; Q15-R17 PolarHBondContact O-N 3.47Å; R17-K19 PolarHBondContact O-N 3.46Å
18	K	39.6	Very low	54	Low	194 Å²	194	149 Å²	149	84%	0.843	73%	0.725	S	S	*	*			trans	-50.4	108.2	169.2	-76.1	179.5	177.9	175.8	0	106.9	R16 R20	R16-K18 PolarHBondContact O-N 3.39Å; K18-R20 VanDerWaalsContact C-N 3.34Å; K18-R20 PolarHBondContact O-N 3.15Å
19	K	44.5	Very low	56.8	Low	196 Å²	196	143.4 Å²	143.4	85%	0.852	70%	0.698	S	S	*	*			trans	-57.2	99.4	175.8	-75.6	-179.3	179	175.8	0	107.2	R17 Y21	R17-K19 PolarHBondContact O-N 3.46Å; K19-Y21 PolarHBondContact O-N 2.75Å
20	R	44.3	Very low	59.4	Low	239 Å²	239	142.3 Å²	142.3	90%	0.902	69%	0.688	S	S	*	*			trans	-61.7	107.9	176.3	-164.1	177.5	-175.7	-169.9	1.5	105.8	K18 H22	K18-R20 VanDerWaalsContact C-N 3.34Å; K18-R20 PolarHBondContact O-N 3.15Å; R20-H22 PolarHBondContact O-N 3.5Å
21	Y	54.3	Low	62.4	Low	226 Å²	226	142.1 Å²	142.1	89%	0.886	67%	0.668	S	S	*	*			trans	-53.8	106.8	175	-83.2	-99.9	0	0	0	107.7	K19 R23	K19-Y21 PolarHBondContact O-N 2.75Å; Y21-R23 PolarHBondContact O-N 2.93Å
22	H	68.7	Low	65.3	Low	117 Å²	117	138.9 Å²	138.9	54%	0.542	64%	0.635	S	S	.	*			trans	-76.6	95.3	179	-167.1	73.9	0	0	0	107.3	R20	R20-H22 PolarHBondContact O-N 3.5Å
23	R	79.5	Confident	68	Low	231 Å²	231	136.9 Å²	136.9	87%	0.872	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-72.3	127.4	173.1	-156.8	176.1	-170.4	-163.8	2	107.5	Y21 T25	Y21-R23 PolarHBondContact O-N 2.93Å; R23-T25 PolarHBondContact O-N 2.9Å
24	H	88	Confident	70.9	Confident	42 Å²	42	131.2 Å²	131.2	19%	0.194	59%	0.589	C	S	.	*	P	Polyproline II helix	trans	-55.3	139.2	176.8	-59.1	106.2	0	0	0	110.6	Q28 I29 W64	H24-Q28 HydrophobicContact CB-CB 4.23Å; H24-I29 HydrophobicContact CB-CD1 4.35Å; H24-I29 HydrophobicContact CB-CG1 3.82Å; H24-W64 AromaticContact CE1-CD1 3.84Å; H24-W64 AromaticContact ND1-CD1 3.82Å
25	T	89.1	Confident	73.4	Confident	63 Å²	63	128.9 Å²	128.9	39%	0.387	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-66.4	155.3	174.7	63.3	0	0	0	0	110.5	R23 R27 Q28 I29	R23-T25 PolarHBondContact O-N 2.9Å; T25-R27 PolarHBondContact O-N 2.92Å; T25-Q28 WeakPolarHBondContact O-CB 3.49Å; T25-Q28 PolarHBondContact O-N 3.3Å; T25-Q28 WeakPolarHBondContact OG1-CB 3.27Å; T25-Q28 VanDerWaalsContact OG1-CG 3.25Å; T25-Q28 WeakPolarHBondContact OG1-CG 3.26Å; T25-Q28 PolarHBondContact OG1-N 2.79Å; T25-Q28 PolarHBondContact OG1-OE1 3.23Å; T25-I29 WeakPolarHBondContact O-CG1 3.36Å; T25-I29 PolarHBondContact O-N 3.45Å
26	P	89.8	Confident	76.1	Confident	103 Å²	103	121 Å²	121	67%	0.669	53%	0.526	S	S	*	.	H	α-helix	trans	-54.1	-36.7	176.2	-27.6	35.4	0	0	0	113.4	I29 Q30	P26-I29 PolarHBondContact O-N 2.85Å; P26-Q30 WeakPolarHBondContact O-CG 3.36Å; P26-Q30 PolarHBondContact O-N 3Å
27	R	91.1	Very high	78.7	Confident	179 Å²	179	117.7 Å²	117.7	68%	0.675	52%	0.518	S	S	*	.	H	α-helix	trans	-63.9	-45.6	175.2	-176.9	-179.1	173.1	-179.6	-0.1	112.2	T25 I29 Q30 Q31	T25-R27 PolarHBondContact O-N 2.92Å; R27-I29 VanDerWaalsContact C-N 3.32Å; R27-I29 PolarHBondContact O-N 3.45Å; R27-Q30 PolarHBondContact O-N 2.94Å; R27-Q31 PolarHBondContact O-N 2.76Å; R27-Q31 VanDerWaalsContact O-N 3.12Å
28	Q	90.9	Very high	81.2	Confident	20 Å²	20	113.9 Å²	113.9	9%	0.093	51%	0.511	C	S	.	.	H	α-helix	trans	-61.7	-41.7	175.8	-74.3	166	-28.5	0	0	111.3	H24 T25 Q31 L32 L54 L56	H24-Q28 HydrophobicContact CB-CB 4.23Å; T25-Q28 WeakPolarHBondContact O-CB 3.49Å; T25-Q28 PolarHBondContact O-N 3.3Å; T25-Q28 WeakPolarHBondContact OG1-CB 3.27Å; T25-Q28 VanDerWaalsContact OG1-CG 3.25Å; T25-Q28 WeakPolarHBondContact OG1-CG 3.26Å; T25-Q28 PolarHBondContact OG1-N 2.79Å; T25-Q28 PolarHBondContact OG1-OE1 3.23Å; Q28-Q31 PolarHBondContact O-N 3.09Å; Q28-L32 WeakPolarHBondContact O-CB 3.36Å; Q28-L32 WeakPolarHBondContact O-CD1 3.22Å; Q28-L32 WeakPolarHBondContact O-CG 3.43Å; Q28-L32 PolarHBondContact O-N 2.97Å; Q28-L54 HydrophobicContact CG-CB 4.33Å; Q28-L54 HydrophobicContact CG-CD2 4.22Å; Q28-L54 PolarHBondContact NE2-O 3.28Å; Q28-L56 HydrophobicContact CG-CD1 4.37Å
29	I	92.5	Very high	83.6	Confident	58 Å²	58	106.3 Å²	106.3	30%	0.297	48%	0.482	S	S	.	.	H	α-helix	trans	-62.4	-47	176.8	-64.3	170.1	0	0	0	110.6	H24 T25 P26 R27 Q31 L32 E33	H24-I29 HydrophobicContact CB-CD1 4.35Å; H24-I29 HydrophobicContact CB-CG1 3.82Å; T25-I29 WeakPolarHBondContact O-CG1 3.36Å; T25-I29 PolarHBondContact O-N 3.45Å; P26-I29 PolarHBondContact O-N 2.85Å; R27-I29 VanDerWaalsContact C-N 3.32Å; R27-I29 PolarHBondContact O-N 3.45Å; I29-Q31 VanDerWaalsContact C-N 3.35Å; I29-Q31 PolarHBondContact O-N 2.85Å; I29-L32 PolarHBondContact O-N 2.89Å; I29-E33 HydrophobicContact CG2-CG 4.13Å; I29-E33 WeakPolarHBondContact O-CB 3.48Å; I29-E33 VanDerWaalsContact O-CG 3.32Å; I29-E33 WeakPolarHBondContact O-CG 3.48Å; I29-E33 PolarHBondContact O-N 3.13Å
30	Q	92.8	Very high	85.8	Confident	137 Å²	137	99.2 Å²	99.2	64%	0.64	46%	0.456	S	S	*	.	H	α-helix	trans	-58.4	-43.4	178.6	-80.6	-179	-8.4	0	0	112.9	P26 R27 E33 A34	P26-Q30 WeakPolarHBondContact O-CG 3.36Å; P26-Q30 PolarHBondContact O-N 3Å; R27-Q30 PolarHBondContact O-N 2.94Å; Q30-E33 PolarHBondContact O-N 2.97Å; Q30-A34 WeakPolarHBondContact O-CB 3.41Å; Q30-A34 PolarHBondContact O-N 3.47Å
31	Q	91.9	Very high	88	Confident	66 Å²	66	94.1 Å²	94.1	31%	0.308	44%	0.442	S	S	.	.	H	α-helix	trans	-69.3	-40.3	178.4	-73.6	-178.4	-68.9	0	0	112.2	R27 Q28 I29 E33 A34 M35 L54	R27-Q31 PolarHBondContact O-N 2.76Å; R27-Q31 VanDerWaalsContact O-N 3.12Å; Q28-Q31 PolarHBondContact O-N 3.09Å; I29-Q31 VanDerWaalsContact C-N 3.35Å; I29-Q31 PolarHBondContact O-N 2.85Å; Q31-E33 VanDerWaalsContact C-N 3.34Å; Q31-A34 PolarHBondContact O-N 3.02Å; Q31-M35 PolarHBondContact O-N 3.01Å; Q31-L54 HydrophobicContact CB-CD2 3.85Å; Q31-L54 HydrophobicContact CG-CD2 4.34Å
32	L	94.8	Very high	89.7	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-63.9	-39.4	174.5	-71.3	168.8	0	0	0	111.7	Q28 I29 F36 L50 L54 L56 I61 W64 F65	Q28-L32 WeakPolarHBondContact O-CB 3.36Å; Q28-L32 WeakPolarHBondContact O-CD1 3.22Å; Q28-L32 WeakPolarHBondContact O-CG 3.43Å; Q28-L32 PolarHBondContact O-N 2.97Å; I29-L32 PolarHBondContact O-N 2.89Å; L32-F36 WeakPolarHBondContact O-CB 3.06Å; L32-F36 PolarHBondContact O-N 2.97Å; L32-L50 HydrophobicContact CD2-CD1 4.39Å; L32-L54 HydrophobicContact CD1-CD1 4.34Å; L32-L54 HydrophobicContact CD2-CD1 3.65Å; L32-L54 HydrophobicContact CG-CD1 3.71Å; L32-L56 HydrophobicContact CD1-CD1 4.32Å; L32-I61 HydrophobicContact CD2-CG1 4.42Å; L32-I61 HydrophobicContact CD2-CG2 4.19Å; L32-W64 VanDerWaalsContact C-CH2 3.46Å; L32-W64 HydrophobicContact CB-CD2 3.96Å; L32-W64 HydrophobicContact CB-CE3 3.84Å; L32-W64 HydrophobicContact CB-CH2 3.58Å; L32-W64 HydrophobicContact CB-CZ2 3.66Å; L32-W64 HydrophobicContact CB-CZ3 3.67Å; L32-W64 HydrophobicContact CD1-CD2 3.83Å; L32-W64 HydrophobicContact CD1-CE3 4.37Å; L32-W64 HydrophobicContact CD1-CG 3.89Å; L32-W64 HydrophobicContact CD2-CE3 4.3Å; L32-W64 HydrophobicContact CG-CD2 4.33Å; L32-W64 HydrophobicContact CG-CE3 4.41Å; L32-W64 WeakPolarHBondContact O-CH2 3.46Å; L32-W64 WeakPolarHBondContact O-CZ3 3.25Å; L32-F65 HydrophobicContact CD2-CE2 3.8Å
33	E	93.8	Very high	90.8	Very high	75 Å²	75	81.7 Å²	81.7	35%	0.35	40%	0.395	S	S	.	.	H	α-helix	trans	-68.4	-38.8	175.2	-75.3	-179.5	171.4	0	0	112.8	I29 Q30 Q31 F36 K37 W64	I29-E33 HydrophobicContact CG2-CG 4.13Å; I29-E33 WeakPolarHBondContact O-CB 3.48Å; I29-E33 VanDerWaalsContact O-CG 3.32Å; I29-E33 WeakPolarHBondContact O-CG 3.48Å; I29-E33 PolarHBondContact O-N 3.13Å; Q30-E33 PolarHBondContact O-N 2.97Å; Q31-E33 VanDerWaalsContact C-N 3.34Å; E33-F36 PolarHBondContact O-N 2.82Å; E33-K37 WeakPolarHBondContact O-CG 3.5Å; E33-K37 PolarHBondContact O-N 2.91Å; E33-W64 HydrophobicContact CG-CH2 3.95Å; E33-W64 HydrophobicContact CG-CZ2 3.98Å
34	A	91.9	Very high	91.3	Very high	51 Å²	51	77.2 Å²	77.2	42%	0.421	38%	0.384	S	S	.	.	H	α-helix	trans	-60.7	-49.7	173.8	0	0	0	0	0	110.7	Q30 Q31 F36 K37 E38	Q30-A34 WeakPolarHBondContact O-CB 3.41Å; Q30-A34 PolarHBondContact O-N 3.47Å; Q31-A34 PolarHBondContact O-N 3.02Å; A34-F36 VanDerWaalsContact C-N 3.31Å; A34-F36 PolarHBondContact O-N 3.25Å; A34-K37 PolarHBondContact O-N 3.04Å; A34-E38 PolarHBondContact O-N 3.19Å
35	M	91.4	Very high	91.5	Very high	43 Å²	43	81.1 Å²	81.1	21%	0.212	41%	0.406	C	S	.	.	H	α-helix	trans	-64.1	-35.2	176.3	-175.3	61.5	64.6	0	0	112.4	Q31 K37 E38 C39 L50 F65	Q31-M35 PolarHBondContact O-N 3.01Å; M35-K37 VanDerWaalsContact C-N 3.27Å; M35-K37 PolarHBondContact O-N 3.16Å; M35-E38 PolarHBondContact O-N 3.48Å; M35-E38 VanDerWaalsContact O-N 3.16Å; M35-C39 CarbonylContact O-C 3.53Å; M35-C39 PolarHBondContact O-N 3.39Å; M35-L50 HydrophobicContact CE-CD2 4.41Å; M35-L50 HydrophobicContact CG-CD1 4.08Å; M35-F65 HydrophobicContact CB-CZ 4.1Å; M35-F65 HydrophobicContact CG-CE1 4.47Å; M35-F65 HydrophobicContact CG-CZ 3.87Å
36	F	94	Very high	91.6	Very high	16 Å²	16	81.1 Å²	81.1	7%	0.07	40%	0.402	C	S	.	.	H	α-helix	trans	-62.2	-33.8	176.9	-173.3	-90.3	0	0	0	113.1	L32 E33 A34 E38 P40 W64 F65 R68 R69 M72	L32-F36 WeakPolarHBondContact O-CB 3.06Å; L32-F36 PolarHBondContact O-N 2.97Å; E33-F36 PolarHBondContact O-N 2.82Å; A34-F36 VanDerWaalsContact C-N 3.31Å; A34-F36 PolarHBondContact O-N 3.25Å; F36-E38 VanDerWaalsContact C-N 3.33Å; F36-P40 HydrophobicContact CE2-CB 4.11Å; F36-P40 HydrophobicContact CZ-CB 4.17Å; F36-P40 WeakPolarHBondContact O-CG 3.26Å; F36-W64 HydrophobicContact CB-CH2 4.31Å; F36-W64 HydrophobicContact CB-CZ3 4.12Å; F36-W64 HydrophobicContact CD2-CZ3 4.25Å; F36-W64 HydrophobicContact CG-CZ3 4.5Å; F36-F65 HydrophobicContact CB-CE1 4.03Å; F36-F65 AromaticContact CD2-CD1 3.66Å; F36-F65 HydrophobicContact CD2-CD1 3.66Å; F36-F65 AromaticContact CD2-CE1 3.91Å; F36-F65 HydrophobicContact CD2-CE1 3.91Å; F36-F65 HydrophobicContact CE2-CD1 4.39Å; F36-F65 HydrophobicContact CG-CE1 4.46Å; F36-R68 HydrophobicContact CD1-CG 4.19Å; F36-R68 HydrophobicContact CD2-CB 4.16Å; F36-R68 HydrophobicContact CD2-CG 3.7Å; F36-R68 HydrophobicContact CE1-CG 4.1Å; F36-R68 HydrophobicContact CE2-CB 3.93Å; F36-R68 HydrophobicContact CE2-CG 3.59Å; F36-R68 HydrophobicContact CG-CG 4.01Å; F36-R68 HydrophobicContact CZ-CB 4.47Å; F36-R68 HydrophobicContact CZ-CG 3.81Å; F36-R69 HydrophobicContact CE2-CG 3.7Å; F36-R69 HydrophobicContact CZ-CG 3.98Å; F36-M72 HydrophobicContact CE1-SD 3.84Å; F36-M72 HydrophobicContact CZ-CE 4.38Å; F36-M72 HydrophobicContact CZ-SD 4.1Å
37	K	91	Very high	91.8	Very high	179 Å²	179	78.9 Å²	78.9	78%	0.778	38%	0.38	S	S	*	.	H	α-helix	trans	-68.3	-33.9	175.6	-69.5	175.6	-177.4	-179.9	0	112.2	E33 A34 M35	E33-K37 WeakPolarHBondContact O-CG 3.5Å; E33-K37 PolarHBondContact O-N 2.91Å; A34-K37 PolarHBondContact O-N 3.04Å; M35-K37 VanDerWaalsContact C-N 3.27Å; M35-K37 PolarHBondContact O-N 3.16Å
38	E	90.4	Very high	91.8	Very high	157 Å²	157	74 Å²	74	73%	0.734	37%	0.366	S	S	*	.	H	α-helix	trans	-81.6	-47.8	178.9	-66.4	179.8	-174	0	0	111.9	A34 M35 F36	A34-E38 PolarHBondContact O-N 3.19Å; M35-E38 PolarHBondContact O-N 3.48Å; M35-E38 VanDerWaalsContact O-N 3.16Å; F36-E38 VanDerWaalsContact C-N 3.33Å
39	C	90	Very high	91.9	Very high	34 Å²	34	78.3 Å²	78.3	23%	0.23	39%	0.386	C	S	.	.			trans	-140.4	97.8	-178.8	-168.4	0	0	0	0	111.4	M35 H41 F65	M35-C39 CarbonylContact O-C 3.53Å; M35-C39 PolarHBondContact O-N 3.39Å; C39-H41 PolarHBondContact O-N 3.46Å; C39-H41 VanDerWaalsContact O-N 3.15Å; C39-H41 VanDerWaalsContact SG-C 3.59Å; C39-H41 PolarHBondContact SG-O 3.12Å; C39-F65 WeakPolarHBondContact O-CE1 3.41Å
40	P	90.5	Very high	91.9	Very high	48 Å²	48	75.8 Å²	75.8	31%	0.312	37%	0.373	S	S	.	.	S	Bend	trans	-64.3	-16.6	176.1	-22.8	32.5	0	0	0	114.3	F36 R69	F36-P40 HydrophobicContact CE2-CB 4.11Å; F36-P40 HydrophobicContact CZ-CB 4.17Å; F36-P40 WeakPolarHBondContact O-CG 3.26Å; P40-R69 PolarHBondContact O-NH1 3.38Å
41	H	92.5	Very high	91.9	Very high	132 Å²	132	70 Å²	70	61%	0.611	35%	0.348	S	S	*	.	S	Bend	trans	-125.9	70.1	-177.5	-69.2	-89.8	0	0	0	111.4	C39 D43 R69	C39-H41 PolarHBondContact O-N 3.46Å; C39-H41 VanDerWaalsContact O-N 3.15Å; C39-H41 VanDerWaalsContact SG-C 3.59Å; C39-H41 PolarHBondContact SG-O 3.12Å; H41-D43 PolarHBondContact O-N 3.35Å; H41-R69 WeakPolarHBondContact CE1-CD 3.31Å; H41-R69 PolarHBondContact CE1-NE 2.75Å; H41-R69 WeakPolarHBondContact NE2-CD 3.27Å
42	P	89.5	Confident	91.9	Very high	8 Å²	8	76.8 Å²	76.8	5%	0.052	37%	0.371	C	S	.	.			trans	-67	134.8	-176.2	27.7	-35.7	0	0	0	111.6	Q46 R47 F65	P42-Q46 HydrophobicContact CB-CB 4.04Å; P42-R47 HydrophobicContact CB-CG 4.27Å; P42-R47 HydrophobicContact CG-CG 4.23Å; P42-R47 PolarHBondContact O-NH1 3Å; P42-F65 HydrophobicContact CG-CB 4.41Å; P42-F65 HydrophobicContact CG-CD1 3.56Å; P42-F65 HydrophobicContact CG-CD2 3.82Å; P42-F65 HydrophobicContact CG-CE1 3.63Å; P42-F65 HydrophobicContact CG-CE2 3.9Å; P42-F65 HydrophobicContact CG-CG 3.66Å; P42-F65 HydrophobicContact CG-CZ 3.81Å
43	D	91.2	Very high	91.8	Very high	74 Å²	74	81.7 Å²	81.7	40%	0.396	39%	0.394	S	S	.	.			trans	-72.5	-177.8	178.6	76.2	5.3	0	0	0	112.2	H41 N45 Q46 R47	H41-D43 PolarHBondContact O-N 3.35Å; D43-N45 PolarHBondContact OD1-N 3.38Å; D43-N45 VanDerWaalsContact OD1-N 3.09Å; D43-Q46 VanDerWaalsContact OD1-CB 3.29Å; D43-Q46 WeakPolarHBondContact OD1-CB 3.25Å; D43-Q46 WeakPolarHBondContact OD1-CG 3.49Å; D43-Q46 PolarHBondContact OD1-N 2.98Å; D43-R47 WeakPolarHBondContact O-CB 3.49Å; D43-R47 VanDerWaalsContact O-CG 3.22Å; D43-R47 WeakPolarHBondContact O-CG 3.48Å; D43-R47 PolarHBondContact O-N 3.45Å; D43-R47 VanDerWaalsContact O-N 3.09Å; D43-R47 PolarHBondContact O-NH1 3.01Å
44	E	91.1	Very high	91.6	Very high	136 Å²	136	78.8 Å²	78.8	64%	0.636	38%	0.38	S	S	*	.	H	α-helix	trans	-65.5	-39	-179	-169.3	162.6	-167.5	0	0	113.3	R47 M48	E44-R47 VanDerWaalsContact CA-NH2 3.35Å; E44-R47 PolarHBondContact O-N 3.28Å; E44-M48 WeakPolarHBondContact O-CB 3.2Å; E44-M48 VanDerWaalsContact O-CG 3.26Å; E44-M48 WeakPolarHBondContact O-CG 3.48Å; E44-M48 PolarHBondContact O-N 2.86Å
45	N	92	Very high	91.6	Very high	124 Å²	124	79.6 Å²	79.6	66%	0.663	39%	0.394	S	S	*	.	H	α-helix	trans	-67.3	-45.3	-179.4	-68.1	-36.5	0	0	0	111.4	D43 R47 M48 Q49	D43-N45 PolarHBondContact OD1-N 3.38Å; D43-N45 VanDerWaalsContact OD1-N 3.09Å; N45-R47 VanDerWaalsContact C-N 3.34Å; N45-R47 PolarHBondContact O-N 3.39Å; N45-M48 CarbonylContact O-C 3.51Å; N45-M48 WeakPolarHBondContact O-CB 3.39Å; N45-M48 PolarHBondContact O-N 3.03Å; N45-M48 VanDerWaalsContact O-N 3.13Å; N45-Q49 PolarHBondContact O-N 3.09Å
46	Q	90.4	Very high	91.5	Very high	64 Å²	64	77.9 Å²	77.9	30%	0.299	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-40.8	176.2	-70.2	169.7	-17.4	0	0	111.4	P42 D43 M48 Q49 L50	P42-Q46 HydrophobicContact CB-CB 4.04Å; D43-Q46 VanDerWaalsContact OD1-CB 3.29Å; D43-Q46 WeakPolarHBondContact OD1-CB 3.25Å; D43-Q46 WeakPolarHBondContact OD1-CG 3.49Å; D43-Q46 PolarHBondContact OD1-N 2.98Å; Q46-M48 VanDerWaalsContact C-N 3.31Å; Q46-M48 PolarHBondContact O-N 2.99Å; Q46-Q49 PolarHBondContact O-N 3.4Å; Q46-L50 WeakPolarHBondContact O-CB 3.4Å; Q46-L50 WeakPolarHBondContact O-CG 3.42Å; Q46-L50 PolarHBondContact O-N 3.44Å
47	R	93	Very high	91.4	Very high	56 Å²	56	83.1 Å²	83.1	21%	0.211	41%	0.41	C	S	.	.	H	α-helix	trans	-63.5	-37	173.5	-72.2	-174.6	-51.9	-103.6	5.3	112.3	P42 D43 E44 N45 S51 I61	P42-R47 HydrophobicContact CB-CG 4.27Å; P42-R47 HydrophobicContact CG-CG 4.23Å; P42-R47 PolarHBondContact O-NH1 3Å; D43-R47 WeakPolarHBondContact O-CB 3.49Å; D43-R47 VanDerWaalsContact O-CG 3.22Å; D43-R47 WeakPolarHBondContact O-CG 3.48Å; D43-R47 PolarHBondContact O-N 3.45Å; D43-R47 VanDerWaalsContact O-N 3.09Å; D43-R47 PolarHBondContact O-NH1 3.01Å; E44-R47 VanDerWaalsContact CA-NH2 3.35Å; E44-R47 PolarHBondContact O-N 3.28Å; N45-R47 VanDerWaalsContact C-N 3.34Å; N45-R47 PolarHBondContact O-N 3.39Å; R47-S51 WeakPolarHBondContact O-CB 3.17Å; R47-S51 PolarHBondContact O-N 2.78Å; R47-I61 HydrophobicContact CG-CG2 4.2Å
48	M	92.6	Very high	91.3	Very high	77 Å²	77	77 Å²	77	38%	0.379	39%	0.389	S	S	.	.	H	α-helix	trans	-72.7	-29.7	176	-71.8	-61.9	-71.1	0	0	113	E44 N45 Q46 S51 R52 P58	E44-M48 WeakPolarHBondContact O-CB 3.2Å; E44-M48 VanDerWaalsContact O-CG 3.26Å; E44-M48 WeakPolarHBondContact O-CG 3.48Å; E44-M48 PolarHBondContact O-N 2.86Å; N45-M48 CarbonylContact O-C 3.51Å; N45-M48 WeakPolarHBondContact O-CB 3.39Å; N45-M48 PolarHBondContact O-N 3.03Å; N45-M48 VanDerWaalsContact O-N 3.13Å; Q46-M48 VanDerWaalsContact C-N 3.31Å; Q46-M48 PolarHBondContact O-N 2.99Å; M48-S51 WeakPolarHBondContact CA-OG 3.22Å; M48-S51 PolarHBondContact O-OG 3.38Å; M48-R52 WeakPolarHBondContact O-CG 3.2Å; M48-R52 PolarHBondContact O-N 3.48Å; M48-P58 HydrophobicContact SD-CB 4.07Å; M48-P58 HydrophobicContact SD-CG 3.43Å; M48-P58 WeakPolarHBondContact SD-CG 3.5Å
49	Q	92.5	Very high	91.3	Very high	110 Å²	110	77.7 Å²	77.7	51%	0.514	39%	0.385	S	S	.	.	H	α-helix	trans	-70.2	-50.5	172.2	179.8	174.4	-4	0	0	110.7	N45 Q46 S51 R52 E53	N45-Q49 PolarHBondContact O-N 3.09Å; Q46-Q49 PolarHBondContact O-N 3.4Å; Q49-S51 VanDerWaalsContact C-N 3.26Å; Q49-S51 PolarHBondContact O-N 3.46Å; Q49-R52 WeakPolarHBondContact O-CB 3.46Å; Q49-R52 PolarHBondContact O-N 2.95Å; Q49-R52 VanDerWaalsContact O-N 3.15Å; Q49-E53 VanDerWaalsContact CG-OE1 3.26Å; Q49-E53 WeakPolarHBondContact CG-OE1 3.4Å; Q49-E53 PolarHBondContact NE2-OE1 2.83Å; Q49-E53 WeakPolarHBondContact O-CG 3.49Å; Q49-E53 PolarHBondContact O-N 3.45Å
50	L	91.8	Very high	91.4	Very high	4 Å²	4	79.1 Å²	79.1	2%	0.021	39%	0.388	C	S	.	.	H	α-helix	trans	-59.9	-35.1	176.5	-74.8	174.7	0	0	0	112.7	L32 M35 Q46 R52 E53 L54 I61 F65	L32-L50 HydrophobicContact CD2-CD1 4.39Å; M35-L50 HydrophobicContact CE-CD2 4.41Å; M35-L50 HydrophobicContact CG-CD1 4.08Å; Q46-L50 WeakPolarHBondContact O-CB 3.4Å; Q46-L50 WeakPolarHBondContact O-CG 3.42Å; Q46-L50 PolarHBondContact O-N 3.44Å; L50-R52 VanDerWaalsContact C-N 3.31Å; L50-R52 PolarHBondContact O-N 2.9Å; L50-E53 PolarHBondContact O-N 3.28Å; L50-L54 HydrophobicContact CB-CD1 4.46Å; L50-L54 HydrophobicContact CD2-CD1 4.35Å; L50-L54 VanDerWaalsContact O-CB 3.22Å; L50-L54 WeakPolarHBondContact O-CB 3.37Å; L50-L54 VanDerWaalsContact O-CG 3.27Å; L50-L54 WeakPolarHBondContact O-CG 3.32Å; L50-L54 PolarHBondContact O-N 3.21Å; L50-I61 HydrophobicContact CB-CD1 3.7Å; L50-I61 HydrophobicContact CD1-CG2 3.95Å; L50-F65 HydrophobicContact CD1-CE2 3.97Å; L50-F65 HydrophobicContact CD1-CZ 4.24Å
51	S	93	Very high	91.4	Very high	15 Å²	15	76.8 Å²	76.8	11%	0.105	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-40.9	177.8	69.3	0	0	0	0	111.7	R47 M48 Q49 G55 L56 I61	R47-S51 WeakPolarHBondContact O-CB 3.17Å; R47-S51 PolarHBondContact O-N 2.78Å; M48-S51 WeakPolarHBondContact CA-OG 3.22Å; M48-S51 PolarHBondContact O-OG 3.38Å; Q49-S51 VanDerWaalsContact C-N 3.26Å; Q49-S51 PolarHBondContact O-N 3.46Å; S51-G55 WeakPolarHBondContact O-CA 3.48Å; S51-G55 PolarHBondContact O-N 3.45Å; S51-L56 VanDerWaalsContact CA-O 3.25Å; S51-L56 WeakPolarHBondContact CA-O 3.48Å; S51-L56 WeakPolarHBondContact CB-O 3.29Å; S51-L56 PolarHBondContact O-N 3.39Å; S51-I61 VanDerWaalsContact CA-CD1 3.47Å; S51-I61 VanDerWaalsContact N-CD1 3.29Å
52	R	92.3	Very high	91.5	Very high	209 Å²	209	76.6 Å²	76.6	79%	0.789	37%	0.37	S	S	*	.	H	α-helix	trans	-68.3	-44.2	175.7	-67	172.6	-176.2	-172.4	2.1	111.8	M48 Q49 L50	M48-R52 WeakPolarHBondContact O-CG 3.2Å; M48-R52 PolarHBondContact O-N 3.48Å; Q49-R52 WeakPolarHBondContact O-CB 3.46Å; Q49-R52 PolarHBondContact O-N 2.95Å; Q49-R52 VanDerWaalsContact O-N 3.15Å; L50-R52 VanDerWaalsContact C-N 3.31Å; L50-R52 PolarHBondContact O-N 2.9Å
53	E	92.1	Very high	91.6	Very high	103 Å²	103	81 Å²	81	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-69.3	-36.6	-178.1	-70.7	175.9	-168	0	0	113	Q49 L50	Q49-E53 VanDerWaalsContact CG-OE1 3.26Å; Q49-E53 WeakPolarHBondContact CG-OE1 3.4Å; Q49-E53 PolarHBondContact NE2-OE1 2.83Å; Q49-E53 WeakPolarHBondContact O-CG 3.49Å; Q49-E53 PolarHBondContact O-N 3.45Å; L50-E53 PolarHBondContact O-N 3.28Å
54	L	91.3	Very high	91.8	Very high	14 Å²	14	79.2 Å²	79.2	7%	0.073	38%	0.376	C	S	.	.	H	α-helix	trans	-98.3	-11.2	-174.3	-59.6	179.6	0	0	0	114.1	Q28 Q31 L32 L50 L56	Q28-L54 HydrophobicContact CG-CB 4.33Å; Q28-L54 HydrophobicContact CG-CD2 4.22Å; Q28-L54 PolarHBondContact NE2-O 3.28Å; Q31-L54 HydrophobicContact CB-CD2 3.85Å; Q31-L54 HydrophobicContact CG-CD2 4.34Å; L32-L54 HydrophobicContact CD1-CD1 4.34Å; L32-L54 HydrophobicContact CD2-CD1 3.65Å; L32-L54 HydrophobicContact CG-CD1 3.71Å; L50-L54 HydrophobicContact CB-CD1 4.46Å; L50-L54 HydrophobicContact CD2-CD1 4.35Å; L50-L54 VanDerWaalsContact O-CB 3.22Å; L50-L54 WeakPolarHBondContact O-CB 3.37Å; L50-L54 VanDerWaalsContact O-CG 3.27Å; L50-L54 WeakPolarHBondContact O-CG 3.32Å; L50-L54 PolarHBondContact O-N 3.21Å; L54-L56 VanDerWaalsContact C-N 3.25Å; L54-L56 HydrophobicContact CB-CB 4.33Å; L54-L56 HydrophobicContact CB-CD1 3.85Å; L54-L56 HydrophobicContact CB-CG 3.88Å; L54-L56 HydrophobicContact CD1-CD1 3.99Å; L54-L56 PolarHBondContact O-N 3.2Å
55	G	90.1	Very high	92	Very high	69 Å²	69	72.8 Å²	72.8	71%	0.711	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	31.2	-171.6	0	0	0	0	0	113	S51	S51-G55 WeakPolarHBondContact O-CA 3.48Å; S51-G55 PolarHBondContact O-N 3.45Å
56	L	91	Very high	92.1	Very high	7 Å²	7	71 Å²	71	4%	0.037	33%	0.334	C	S	.	.			trans	-109.2	148.9	-178.9	-66.1	175	0	0	0	110.5	Q28 L32 S51 L54 I61	Q28-L56 HydrophobicContact CG-CD1 4.37Å; L32-L56 HydrophobicContact CD1-CD1 4.32Å; S51-L56 VanDerWaalsContact CA-O 3.25Å; S51-L56 WeakPolarHBondContact CA-O 3.48Å; S51-L56 WeakPolarHBondContact CB-O 3.29Å; S51-L56 PolarHBondContact O-N 3.39Å; L54-L56 VanDerWaalsContact C-N 3.25Å; L54-L56 HydrophobicContact CB-CB 4.33Å; L54-L56 HydrophobicContact CB-CD1 3.85Å; L54-L56 HydrophobicContact CB-CG 3.88Å; L54-L56 HydrophobicContact CD1-CD1 3.99Å; L54-L56 PolarHBondContact O-N 3.2Å; L56-I61 HydrophobicContact CB-CD1 4.22Å; L56-I61 HydrophobicContact CB-CG1 4.14Å; L56-I61 HydrophobicContact CD1-CG1 4.41Å
57	E	90.4	Very high	92.3	Very high	126 Å²	126	73 Å²	73	59%	0.589	35%	0.347	S	S	*	.			trans	-66	139.8	172.7	-71.7	-173.6	169.6	0	0	110.6	R59 Q60 I61	E57-R59 PolarHBondContact O-N 3.33Å; E57-Q60 HydrophobicContact CB-CG 4.18Å; E57-Q60 WeakPolarHBondContact O-CB 3.46Å; E57-Q60 PolarHBondContact O-N 2.99Å; E57-I61 PolarHBondContact O-N 3.1Å
58	P	89.7	Confident	92.4	Very high	49 Å²	49	73.6 Å²	73.6	32%	0.318	35%	0.349	S	S	.	.	H	α-helix	trans	-51.8	-31.2	176.9	-26.6	32.7	0	0	0	113.6	M48 I61 K62	M48-P58 HydrophobicContact SD-CB 4.07Å; M48-P58 HydrophobicContact SD-CG 3.43Å; M48-P58 WeakPolarHBondContact SD-CG 3.5Å; P58-I61 PolarHBondContact O-N 2.87Å; P58-K62 PolarHBondContact O-N 3.31Å
59	R	90.6	Very high	92.6	Very high	172 Å²	172	72.2 Å²	72.2	65%	0.649	34%	0.34	S	S	*	.	H	α-helix	trans	-67.3	-39.1	176	-171.2	174.9	-178.6	-132.5	-0.4	112.7	E57 I61 K62 F63	E57-R59 PolarHBondContact O-N 3.33Å; R59-I61 VanDerWaalsContact C-N 3.33Å; R59-K62 PolarHBondContact O-N 3.38Å; R59-F63 HydrophobicContact CG-CD2 3.88Å; R59-F63 HydrophobicContact CG-CE2 3.56Å; R59-F63 WeakPolarHBondContact O-CD2 3.35Å; R59-F63 PolarHBondContact O-N 2.89Å
60	Q	90.8	Very high	92.6	Very high	64 Å²	64	70.8 Å²	70.8	30%	0.299	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-40.6	175.9	-67.2	176.9	-58.2	0	0	110.9	E57 F63 W64	E57-Q60 HydrophobicContact CB-CG 4.18Å; E57-Q60 WeakPolarHBondContact O-CB 3.46Å; E57-Q60 PolarHBondContact O-N 2.99Å; Q60-F63 PolarHBondContact O-N 2.79Å; Q60-W64 WeakPolarHBondContact O-CB 3.4Å; Q60-W64 PolarHBondContact O-N 3.15Å
61	I	92.5	Very high	92.8	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-48.5	175.6	-63.2	165.1	0	0	0	110.1	L32 R47 L50 S51 L56 E57 P58 R59 F63 W64 F65	L32-I61 HydrophobicContact CD2-CG1 4.42Å; L32-I61 HydrophobicContact CD2-CG2 4.19Å; R47-I61 HydrophobicContact CG-CG2 4.2Å; L50-I61 HydrophobicContact CB-CD1 3.7Å; L50-I61 HydrophobicContact CD1-CG2 3.95Å; S51-I61 VanDerWaalsContact CA-CD1 3.47Å; S51-I61 VanDerWaalsContact N-CD1 3.29Å; L56-I61 HydrophobicContact CB-CD1 4.22Å; L56-I61 HydrophobicContact CB-CG1 4.14Å; L56-I61 HydrophobicContact CD1-CG1 4.41Å; E57-I61 PolarHBondContact O-N 3.1Å; P58-I61 PolarHBondContact O-N 2.87Å; R59-I61 VanDerWaalsContact C-N 3.33Å; I61-F63 VanDerWaalsContact C-N 3.31Å; I61-F63 PolarHBondContact O-N 3.16Å; I61-W64 PolarHBondContact O-N 3.35Å; I61-W64 VanDerWaalsContact O-N 3.1Å; I61-F65 HydrophobicContact CG2-CD2 3.76Å; I61-F65 HydrophobicContact CG2-CE2 3.75Å; I61-F65 WeakPolarHBondContact O-CD2 3.3Å; I61-F65 PolarHBondContact O-N 2.99Å
62	K	92.8	Very high	92.9	Very high	127 Å²	127	78.4 Å²	78.4	55%	0.552	37%	0.374	S	S	*	.	H	α-helix	trans	-53.5	-47.4	175.9	-175.5	-179.9	178.7	178.3	0	112	P58 R59 Q66	P58-K62 PolarHBondContact O-N 3.31Å; R59-K62 PolarHBondContact O-N 3.38Å; K62-Q66 WeakPolarHBondContact O-CB 3.37Å; K62-Q66 PolarHBondContact O-N 3.06Å
63	F	92.9	Very high	92.9	Very high	101 Å²	101	74.9 Å²	74.9	44%	0.443	36%	0.364	S	S	.	.	H	α-helix	trans	-67.6	-37.1	177.9	-76.2	-55	0	0	0	113	R59 Q60 I61 Q66 N67	R59-F63 HydrophobicContact CG-CD2 3.88Å; R59-F63 HydrophobicContact CG-CE2 3.56Å; R59-F63 WeakPolarHBondContact O-CD2 3.35Å; R59-F63 PolarHBondContact O-N 2.89Å; Q60-F63 PolarHBondContact O-N 2.79Å; I61-F63 VanDerWaalsContact C-N 3.31Å; I61-F63 PolarHBondContact O-N 3.16Å; F63-Q66 PolarHBondContact O-N 3.33Å; F63-N67 WeakPolarHBondContact O-CB 3.33Å; F63-N67 PolarHBondContact O-N 3.43Å; F63-N67 PolarHBondContact O-ND2 3.34Å
64	W	94.3	Very high	93	Very high	36 Å²	36	71.5 Å²	71.5	14%	0.136	35%	0.353	C	S	.	.	H	α-helix	trans	-61.3	-48.8	176.5	-173.5	97	0	0	0	111.2	H24 L32 E33 F36 Q60 I61 Q66 N67 R68	H24-W64 AromaticContact CE1-CD1 3.84Å; H24-W64 AromaticContact ND1-CD1 3.82Å; L32-W64 VanDerWaalsContact C-CH2 3.46Å; L32-W64 HydrophobicContact CB-CD2 3.96Å; L32-W64 HydrophobicContact CB-CE3 3.84Å; L32-W64 HydrophobicContact CB-CH2 3.58Å; L32-W64 HydrophobicContact CB-CZ2 3.66Å; L32-W64 HydrophobicContact CB-CZ3 3.67Å; L32-W64 HydrophobicContact CD1-CD2 3.83Å; L32-W64 HydrophobicContact CD1-CE3 4.37Å; L32-W64 HydrophobicContact CD1-CG 3.89Å; L32-W64 HydrophobicContact CD2-CE3 4.3Å; L32-W64 HydrophobicContact CG-CD2 4.33Å; L32-W64 HydrophobicContact CG-CE3 4.41Å; L32-W64 WeakPolarHBondContact O-CH2 3.46Å; L32-W64 WeakPolarHBondContact O-CZ3 3.25Å; E33-W64 HydrophobicContact CG-CH2 3.95Å; E33-W64 HydrophobicContact CG-CZ2 3.98Å; F36-W64 HydrophobicContact CB-CH2 4.31Å; F36-W64 HydrophobicContact CB-CZ3 4.12Å; F36-W64 HydrophobicContact CD2-CZ3 4.25Å; F36-W64 HydrophobicContact CG-CZ3 4.5Å; Q60-W64 WeakPolarHBondContact O-CB 3.4Å; Q60-W64 PolarHBondContact O-N 3.15Å; I61-W64 PolarHBondContact O-N 3.35Å; I61-W64 VanDerWaalsContact O-N 3.1Å; W64-Q66 PolarHBondContact O-N 3.47Å; W64-N67 PolarHBondContact O-N 3.37Å; W64-R68 HydrophobicContact CE3-CB 4.31Å; W64-R68 HydrophobicContact CH2-CB 4.33Å; W64-R68 HydrophobicContact CH2-CG 4.02Å; W64-R68 HydrophobicContact CZ3-CB 4.12Å; W64-R68 HydrophobicContact CZ3-CG 4.15Å; W64-R68 VanDerWaalsContact O-CB 3.3Å; W64-R68 WeakPolarHBondContact O-CB 3.46Å; W64-R68 PolarHBondContact O-N 3.46Å
65	F	95.7	Very high	93.2	Very high	2 Å²	2	76.4 Å²	76.4	1%	0.009	38%	0.376	C	S	.	.	H	α-helix	trans	-63.6	-40.9	177.6	-85.8	-95.8	0	0	0	112.1	L32 M35 F36 C39 P42 L50 I61 R68 R69	L32-F65 HydrophobicContact CD2-CE2 3.8Å; M35-F65 HydrophobicContact CB-CZ 4.1Å; M35-F65 HydrophobicContact CG-CE1 4.47Å; M35-F65 HydrophobicContact CG-CZ 3.87Å; F36-F65 HydrophobicContact CB-CE1 4.03Å; F36-F65 AromaticContact CD2-CD1 3.66Å; F36-F65 HydrophobicContact CD2-CD1 3.66Å; F36-F65 AromaticContact CD2-CE1 3.91Å; F36-F65 HydrophobicContact CD2-CE1 3.91Å; F36-F65 HydrophobicContact CE2-CD1 4.39Å; F36-F65 HydrophobicContact CG-CE1 4.46Å; C39-F65 WeakPolarHBondContact O-CE1 3.41Å; P42-F65 HydrophobicContact CG-CB 4.41Å; P42-F65 HydrophobicContact CG-CD1 3.56Å; P42-F65 HydrophobicContact CG-CD2 3.82Å; P42-F65 HydrophobicContact CG-CE1 3.63Å; P42-F65 HydrophobicContact CG-CE2 3.9Å; P42-F65 HydrophobicContact CG-CG 3.66Å; P42-F65 HydrophobicContact CG-CZ 3.81Å; L50-F65 HydrophobicContact CD1-CE2 3.97Å; L50-F65 HydrophobicContact CD1-CZ 4.24Å; I61-F65 HydrophobicContact CG2-CD2 3.76Å; I61-F65 HydrophobicContact CG2-CE2 3.75Å; I61-F65 WeakPolarHBondContact O-CD2 3.3Å; I61-F65 PolarHBondContact O-N 2.99Å; F65-R68 PolarHBondContact O-N 2.89Å; F65-R69 WeakPolarHBondContact O-CG 3.44Å; F65-R69 PolarHBondContact O-N 3.04Å
66	Q	94.3	Very high	93.3	Very high	87 Å²	87	77.6 Å²	77.6	41%	0.407	36%	0.363	S	S	.	.	H	α-helix	trans	-60.7	-49.8	175.3	-176.6	59.7	53.8	0	0	111.7	K62 F63 W64 R68 R69 T70	K62-Q66 WeakPolarHBondContact O-CB 3.37Å; K62-Q66 PolarHBondContact O-N 3.06Å; F63-Q66 PolarHBondContact O-N 3.33Å; W64-Q66 PolarHBondContact O-N 3.47Å; Q66-R68 VanDerWaalsContact C-N 3.31Å; Q66-R68 PolarHBondContact O-N 3.18Å; Q66-R69 PolarHBondContact O-N 3.41Å; Q66-T70 PolarHBondContact O-N 3.39Å; Q66-T70 PolarHBondContact O-OG1 2.85Å
67	N	94.9	Very high	93.4	Very high	106 Å²	106	81.7 Å²	81.7	57%	0.567	38%	0.382	S	S	*	.	H	α-helix	trans	-63.6	-38.1	178.8	-71.5	-16.5	0	0	0	111.7	F63 W64 T70 Q71	F63-N67 WeakPolarHBondContact O-CB 3.33Å; F63-N67 PolarHBondContact O-N 3.43Å; F63-N67 PolarHBondContact O-ND2 3.34Å; W64-N67 PolarHBondContact O-N 3.37Å; N67-T70 PolarHBondContact O-N 3.18Å; N67-Q71 WeakPolarHBondContact O-CB 3.18Å; N67-Q71 PolarHBondContact O-N 2.79Å
68	R	95.1	Very high	93.6	Very high	67 Å²	67	84.5 Å²	84.5	25%	0.253	39%	0.387	S	S	.	.	H	α-helix	trans	-64.4	-42.6	177.4	-174	58.5	175.4	160.5	-0.2	111.9	F36 W64 F65 Q66 Q71 M72	F36-R68 HydrophobicContact CD1-CG 4.19Å; F36-R68 HydrophobicContact CD2-CB 4.16Å; F36-R68 HydrophobicContact CD2-CG 3.7Å; F36-R68 HydrophobicContact CE1-CG 4.1Å; F36-R68 HydrophobicContact CE2-CB 3.93Å; F36-R68 HydrophobicContact CE2-CG 3.59Å; F36-R68 HydrophobicContact CG-CG 4.01Å; F36-R68 HydrophobicContact CZ-CB 4.47Å; F36-R68 HydrophobicContact CZ-CG 3.81Å; W64-R68 HydrophobicContact CE3-CB 4.31Å; W64-R68 HydrophobicContact CH2-CB 4.33Å; W64-R68 HydrophobicContact CH2-CG 4.02Å; W64-R68 HydrophobicContact CZ3-CB 4.12Å; W64-R68 HydrophobicContact CZ3-CG 4.15Å; W64-R68 VanDerWaalsContact O-CB 3.3Å; W64-R68 WeakPolarHBondContact O-CB 3.46Å; W64-R68 PolarHBondContact O-N 3.46Å; F65-R68 PolarHBondContact O-N 2.89Å; Q66-R68 VanDerWaalsContact C-N 3.31Å; Q66-R68 PolarHBondContact O-N 3.18Å; R68-Q71 PolarHBondContact O-N 3.04Å; R68-M72 WeakPolarHBondContact O-CB 3.42Å; R68-M72 PolarHBondContact O-N 3.05Å
69	R	96.2	Very high	93.9	Very high	48 Å²	48	88 Å²	88	18%	0.181	40%	0.399	C	S	.	.	H	α-helix	trans	-61.8	-46.2	173.1	-71.4	-168.8	-60.9	-91.9	0.7	112	F36 P40 H41 F65 Q66 Q71 M72 K73	F36-R69 HydrophobicContact CE2-CG 3.7Å; F36-R69 HydrophobicContact CZ-CG 3.98Å; P40-R69 PolarHBondContact O-NH1 3.38Å; H41-R69 WeakPolarHBondContact CE1-CD 3.31Å; H41-R69 PolarHBondContact CE1-NE 2.75Å; H41-R69 WeakPolarHBondContact NE2-CD 3.27Å; F65-R69 WeakPolarHBondContact O-CG 3.44Å; F65-R69 PolarHBondContact O-N 3.04Å; Q66-R69 PolarHBondContact O-N 3.41Å; R69-Q71 VanDerWaalsContact C-N 3.3Å; R69-Q71 PolarHBondContact O-N 3.12Å; R69-M72 PolarHBondContact O-N 3.39Å; R69-K73 WeakPolarHBondContact O-CB 3.41Å; R69-K73 PolarHBondContact O-N 2.99Å
70	T	93.9	Very high	94	Very high	81 Å²	81	84.3 Å²	84.3	50%	0.497	39%	0.392	S	S	.	.	H	α-helix	trans	-60.2	-41	176.8	-59.7	0	0	0	0	111.5	Q66 N67 A74	Q66-T70 PolarHBondContact O-N 3.39Å; Q66-T70 PolarHBondContact O-OG1 2.85Å; N67-T70 PolarHBondContact O-N 3.18Å; T70-A74 WeakPolarHBondContact O-CB 3.49Å; T70-A74 PolarHBondContact O-N 3.11Å
71	Q	94.8	Very high	94.2	Very high	109 Å²	109	85.4 Å²	85.4	51%	0.509	40%	0.4	S	S	.	.	H	α-helix	trans	-64.1	-45.4	175.7	-174.4	-174.5	30.2	0	0	112.4	N67 R68 R69 A74 Q75	N67-Q71 WeakPolarHBondContact O-CB 3.18Å; N67-Q71 PolarHBondContact O-N 2.79Å; R68-Q71 PolarHBondContact O-N 3.04Å; R69-Q71 VanDerWaalsContact C-N 3.3Å; R69-Q71 PolarHBondContact O-N 3.12Å; Q71-A74 PolarHBondContact O-N 3.16Å; Q71-Q75 WeakPolarHBondContact O-CB 3.4Å; Q71-Q75 PolarHBondContact O-N 2.83Å
72	M	94.2	Very high	94.3	Very high	70 Å²	70	89.6 Å²	89.6	35%	0.345	43%	0.429	S	S	.	.	H	α-helix	trans	-62.3	-43.8	178.1	-173.4	-178.5	76	0	0	111.2	F36 R68 R69 Q75 H76	F36-M72 HydrophobicContact CE1-SD 3.84Å; F36-M72 HydrophobicContact CZ-CE 4.38Å; F36-M72 HydrophobicContact CZ-SD 4.1Å; R68-M72 WeakPolarHBondContact O-CB 3.42Å; R68-M72 PolarHBondContact O-N 3.05Å; R69-M72 PolarHBondContact O-N 3.39Å; M72-Q75 PolarHBondContact O-N 2.8Å; M72-H76 PolarHBondContact O-N 2.94Å
73	K	94.1	Very high	94.4	Very high	135 Å²	135	90.2 Å²	90.2	59%	0.587	43%	0.432	S	S	*	.	H	α-helix	trans	-58.2	-49.6	174.5	-171.1	-177.7	-174.9	-161.7	0	111.4	R69 Q75 H76 E77	R69-K73 WeakPolarHBondContact O-CB 3.41Å; R69-K73 PolarHBondContact O-N 2.99Å; K73-Q75 VanDerWaalsContact C-N 3.26Å; K73-Q75 PolarHBondContact O-N 3.26Å; K73-H76 PolarHBondContact O-N 3.28Å; K73-E77 WeakPolarHBondContact CE-OE1 3.38Å; K73-E77 HydrophobicContact CG-CG 4.47Å; K73-E77 IonicContact NZ-OE1 3.44Å; K73-E77 WeakPolarHBondContact O-CB 3.24Å; K73-E77 WeakPolarHBondContact O-CG 3.27Å; K73-E77 PolarHBondContact O-N 3.01Å
74	A	94.3	Very high	94.5	Very high	31 Å²	31	90.5 Å²	90.5	26%	0.256	44%	0.437	S	S	.	.	H	α-helix	trans	-63.4	-30.2	178	0	0	0	0	0	113.1	T70 Q71 R78	T70-A74 WeakPolarHBondContact O-CB 3.49Å; T70-A74 PolarHBondContact O-N 3.11Å; Q71-A74 PolarHBondContact O-N 3.16Å; A74-R78 WeakPolarHBondContact O-CB 3.48Å; A74-R78 WeakPolarHBondContact O-CD 3.16Å; A74-R78 WeakPolarHBondContact O-CG 3.44Å; A74-R78 PolarHBondContact O-N 2.72Å
75	Q	93.9	Very high	94.5	Very high	117 Å²	117	97.1 Å²	97.1	55%	0.547	46%	0.462	S	S	.	.	H	α-helix	trans	-71.9	-45.8	175.5	-175.7	176	-8.7	0	0	111.7	Q71 M72 K73 R78 Q79	Q71-Q75 WeakPolarHBondContact O-CB 3.4Å; Q71-Q75 PolarHBondContact O-N 2.83Å; M72-Q75 PolarHBondContact O-N 2.8Å; K73-Q75 VanDerWaalsContact C-N 3.26Å; K73-Q75 PolarHBondContact O-N 3.26Å; Q75-R78 PolarHBondContact O-N 2.59Å; Q75-Q79 PolarHBondContact O-N 2.71Å
76	H	93.1	Very high	94.4	Very high	94 Å²	94	100 Å²	100	44%	0.435	49%	0.486	S	S	.	.	H	α-helix	trans	-61.8	-47.6	174.2	-69.7	169	0	0	0	111.3	M72 K73 R78 Q79 D80	M72-H76 PolarHBondContact O-N 2.94Å; K73-H76 PolarHBondContact O-N 3.28Å; H76-R78 VanDerWaalsContact C-N 3.25Å; H76-R78 PolarHBondContact O-N 3.35Å; H76-Q79 WeakPolarHBondContact O-CB 3.43Å; H76-Q79 PolarHBondContact O-N 3.06Å; H76-D80 VanDerWaalsContact O-CG 3.25Å; H76-D80 PolarHBondContact O-N 3.41Å
77	E	93.7	Very high	94.5	Very high	94 Å²	94	99.1 Å²	99.1	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-57.4	-37.7	177.6	-74.6	173	177.2	0	0	112.6	K73 N81	K73-E77 WeakPolarHBondContact CE-OE1 3.38Å; K73-E77 HydrophobicContact CG-CG 4.47Å; K73-E77 IonicContact NZ-OE1 3.44Å; K73-E77 WeakPolarHBondContact O-CB 3.24Å; K73-E77 WeakPolarHBondContact O-CG 3.27Å; K73-E77 PolarHBondContact O-N 3.01Å; E77-N81 WeakPolarHBondContact O-CB 3.48Å; E77-N81 PolarHBondContact O-N 2.89Å; E77-N81 PolarHBondContact O-ND2 3.36Å
78	R	94.2	Very high	94.6	Very high	185 Å²	185	98 Å²	98	70%	0.698	48%	0.476	S	S	*	.	H	α-helix	trans	-68.2	-42.5	174.5	-76.1	172.5	-170.8	178.1	2.8	112	A74 Q75 H76 N81 C82	A74-R78 WeakPolarHBondContact O-CB 3.48Å; A74-R78 WeakPolarHBondContact O-CD 3.16Å; A74-R78 WeakPolarHBondContact O-CG 3.44Å; A74-R78 PolarHBondContact O-N 2.72Å; Q75-R78 PolarHBondContact O-N 2.59Å; H76-R78 VanDerWaalsContact C-N 3.25Å; H76-R78 PolarHBondContact O-N 3.35Å; R78-N81 PolarHBondContact O-N 3.32Å; R78-C82 PolarHBondContact O-N 3.07Å; R78-C82 PolarHBondContact O-SG 3.17Å; R78-C82 VanDerWaalsContact O-SG 3.41Å
79	Q	95.1	Very high	94.6	Very high	123 Å²	123	98.8 Å²	98.8	58%	0.575	49%	0.485	S	S	*	.	H	α-helix	trans	-63.7	-45	177.9	-175.8	174.3	4	0	0	111.2	Q75 H76 C82 F83	Q75-Q79 PolarHBondContact O-N 2.71Å; H76-Q79 WeakPolarHBondContact O-CB 3.43Å; H76-Q79 PolarHBondContact O-N 3.06Å; Q79-C82 WeakPolarHBondContact O-CB 3.26Å; Q79-C82 PolarHBondContact O-N 3.22Å; Q79-F83 PolarHBondContact O-N 3.44Å
80	D	93.5	Very high	94.5	Very high	94 Å²	94	101.3 Å²	101.3	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-43.4	176.1	-64.1	-16.3	0	0	0	110.8	H76 C82 F83 L84	H76-D80 VanDerWaalsContact O-CG 3.25Å; H76-D80 PolarHBondContact O-N 3.41Å; D80-C82 PolarHBondContact O-N 3.16Å; D80-F83 PolarHBondContact O-N 3.19Å; D80-L84 WeakPolarHBondContact O-CB 3.39Å; D80-L84 VanDerWaalsContact O-CG 3.26Å; D80-L84 WeakPolarHBondContact O-CG 3.31Å; D80-L84 PolarHBondContact O-N 3.37Å
81	N	94.6	Very high	94.6	Very high	86 Å²	86	100.9 Å²	100.9	46%	0.46	49%	0.491	S	S	.	.	H	α-helix	trans	-62.4	-39.2	174	-91.4	-83.5	0	0	0	113	E77 R78 R85	E77-N81 WeakPolarHBondContact O-CB 3.48Å; E77-N81 PolarHBondContact O-N 2.89Å; E77-N81 PolarHBondContact O-ND2 3.36Å; R78-N81 PolarHBondContact O-N 3.32Å; N81-R85 WeakPolarHBondContact O-CB 3.36Å; N81-R85 WeakPolarHBondContact O-CG 3.48Å; N81-R85 PolarHBondContact O-N 3.03Å
82	C	95	Very high	94.5	Very high	89 Å²	89	102.5 Å²	102.5	60%	0.601	49%	0.493	S	S	*	.	H	α-helix	trans	-63.5	-42.9	174.4	-78.5	0	0	0	0	111.4	R78 Q79 D80 A86	R78-C82 PolarHBondContact O-N 3.07Å; R78-C82 PolarHBondContact O-SG 3.17Å; R78-C82 VanDerWaalsContact O-SG 3.41Å; Q79-C82 WeakPolarHBondContact O-CB 3.26Å; Q79-C82 PolarHBondContact O-N 3.22Å; D80-C82 PolarHBondContact O-N 3.16Å; C82-A86 PolarHBondContact O-N 2.94Å; C82-A86 VanDerWaalsContact O-N 3.14Å
83	F	94.5	Very high	94.4	Very high	140 Å²	140	103.2 Å²	103.2	61%	0.614	50%	0.504	S	S	*	.	H	α-helix	trans	-64.3	-48.7	176.2	179.6	-96.8	0	0	0	111.9	Q79 D80 R85 A86 E87	Q79-F83 PolarHBondContact O-N 3.44Å; D80-F83 PolarHBondContact O-N 3.19Å; F83-R85 VanDerWaalsContact C-N 3.29Å; F83-R85 PolarHBondContact O-N 3.48Å; F83-A86 PolarHBondContact O-N 3.08Å; F83-A86 VanDerWaalsContact O-N 3.15Å; F83-E87 PolarHBondContact O-N 3.22Å
84	L	94.6	Very high	94.4	Very high	106 Å²	106	101.1 Å²	101.1	56%	0.555	50%	0.496	S	S	*	.	H	α-helix	trans	-60.9	-36.9	178.3	-72.5	172.9	0	0	0	112.3	D80 E87 N88	D80-L84 WeakPolarHBondContact O-CB 3.39Å; D80-L84 VanDerWaalsContact O-CG 3.26Å; D80-L84 WeakPolarHBondContact O-CG 3.31Å; D80-L84 PolarHBondContact O-N 3.37Å; L84-E87 PolarHBondContact O-N 2.87Å; L84-N88 WeakPolarHBondContact O-CB 3.22Å; L84-N88 PolarHBondContact O-N 2.8Å
85	R	94.7	Very high	94.1	Very high	176 Å²	176	102.7 Å²	102.7	66%	0.664	50%	0.5	S	S	*	.	H	α-helix	trans	-64.4	-45.6	174.2	-76.9	171.2	-177.2	-104.8	0.1	111.8	N81 F83 E87 N88 D89	N81-R85 WeakPolarHBondContact O-CB 3.36Å; N81-R85 WeakPolarHBondContact O-CG 3.48Å; N81-R85 PolarHBondContact O-N 3.03Å; F83-R85 VanDerWaalsContact C-N 3.29Å; F83-R85 PolarHBondContact O-N 3.48Å; R85-E87 VanDerWaalsContact C-N 3.33Å; R85-E87 PolarHBondContact O-N 2.71Å; R85-N88 PolarHBondContact O-N 3.28Å; R85-D89 PolarHBondContact O-N 2.89Å
86	A	94.7	Very high	93.9	Very high	61 Å²	61	101.3 Å²	101.3	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-42.2	177	0	0	0	0	0	111.7	C82 F83 D89 K90	C82-A86 PolarHBondContact O-N 2.94Å; C82-A86 VanDerWaalsContact O-N 3.14Å; F83-A86 PolarHBondContact O-N 3.08Å; F83-A86 VanDerWaalsContact O-N 3.15Å; A86-D89 PolarHBondContact O-N 2.94Å; A86-K90 PolarHBondContact O-N 2.9Å
87	E	96.3	Very high	93.7	Very high	70 Å²	70	99.5 Å²	99.5	33%	0.327	50%	0.496	S	S	.	.	H	α-helix	trans	-68.6	-37.9	176.5	-163	64.4	-169.2	0	0	111.8	F83 L84 R85 D89 K90 I91	F83-E87 PolarHBondContact O-N 3.22Å; L84-E87 PolarHBondContact O-N 2.87Å; R85-E87 VanDerWaalsContact C-N 3.33Å; R85-E87 PolarHBondContact O-N 2.71Å; E87-D89 VanDerWaalsContact C-N 3.33Å; E87-D89 PolarHBondContact O-N 2.81Å; E87-K90 PolarHBondContact O-N 2.84Å; E87-K90 IonicContact OE1-NZ 2.89Å; E87-I91 HydrophobicContact CG-CD1 4.15Å; E87-I91 WeakPolarHBondContact O-CB 3.42Å; E87-I91 VanDerWaalsContact O-CG1 3.27Å; E87-I91 WeakPolarHBondContact O-CG1 3.5Å; E87-I91 PolarHBondContact O-N 3.37Å
88	N	95.5	Very high	93.4	Very high	82 Å²	82	100 Å²	100	44%	0.439	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-40.6	174.7	-141.9	-91.4	0	0	0	111.6	L84 R85 I91 R92	L84-N88 WeakPolarHBondContact O-CB 3.22Å; L84-N88 PolarHBondContact O-N 2.8Å; R85-N88 PolarHBondContact O-N 3.28Å; N88-I91 PolarHBondContact O-N 2.65Å; N88-R92 WeakPolarHBondContact O-CB 3.4Å; N88-R92 WeakPolarHBondContact O-CD 3.49Å; N88-R92 WeakPolarHBondContact O-CG 3.31Å; N88-R92 PolarHBondContact O-N 3.2Å; N88-R92 PolarHBondContact OD1-NE 3.34Å
89	D	94.8	Very high	92.6	Very high	83 Å²	83	97.2 Å²	97.2	44%	0.444	49%	0.49	S	S	.	.	H	α-helix	trans	-67.4	-38.9	176.6	-71.5	-24	0	0	0	111.6	R85 A86 E87 R92 C93	R85-D89 PolarHBondContact O-N 2.89Å; A86-D89 PolarHBondContact O-N 2.94Å; E87-D89 VanDerWaalsContact C-N 3.33Å; E87-D89 PolarHBondContact O-N 2.81Å; D89-R92 WeakPolarHBondContact O-CB 3.29Å; D89-R92 PolarHBondContact O-N 2.88Å; D89-R92 IonicContact OD1-NH1 3.25Å; D89-C93 PolarHBondContact O-N 3.01Å; D89-C93 PolarHBondContact O-SG 2.74Å; D89-C93 VanDerWaalsContact O-SG 3.39Å
90	K	95.9	Very high	92	Very high	101 Å²	101	97.2 Å²	97.2	44%	0.439	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-49.2	172.3	-177.2	-173.5	167.1	-152.7	0	111.9	A86 E87 R92 C93 E94	A86-K90 PolarHBondContact O-N 2.9Å; E87-K90 PolarHBondContact O-N 2.84Å; E87-K90 IonicContact OE1-NZ 2.89Å; K90-R92 VanDerWaalsContact C-N 3.25Å; K90-R92 PolarHBondContact O-N 2.95Å; K90-C93 WeakPolarHBondContact O-CB 3.12Å; K90-C93 PolarHBondContact O-N 2.88Å; K90-C93 VanDerWaalsContact O-N 3.12Å; K90-E94 WeakPolarHBondContact CE-OE1 3.47Å; K90-E94 WeakPolarHBondContact O-CG 3.45Å; K90-E94 PolarHBondContact O-N 3.29Å
91	I	95.5	Very high	91.4	Very high	72 Å²	72	95 Å²	95	37%	0.369	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-36.9	176.5	-69	165.2	0	0	0	110.8	E87 N88 E94 N95	E87-I91 HydrophobicContact CG-CD1 4.15Å; E87-I91 WeakPolarHBondContact O-CB 3.42Å; E87-I91 VanDerWaalsContact O-CG1 3.27Å; E87-I91 WeakPolarHBondContact O-CG1 3.5Å; E87-I91 PolarHBondContact O-N 3.37Å; N88-I91 PolarHBondContact O-N 2.65Å; I91-E94 PolarHBondContact O-N 3.38Å; I91-N95 WeakPolarHBondContact CG2-ND2 3.1Å; I91-N95 WeakPolarHBondContact O-CB 3.35Å; I91-N95 PolarHBondContact O-N 2.98Å; I91-N95 PolarHBondContact O-ND2 3.31Å
92	R	91.9	Very high	90.5	Very high	144 Å²	144	96.6 Å²	96.6	54%	0.543	49%	0.492	S	S	.	.	H	α-helix	trans	-64.5	-45.5	174.2	-75.6	166.3	-178.2	-170	-6.5	111.7	N88 D89 K90 N95 I96	N88-R92 WeakPolarHBondContact O-CB 3.4Å; N88-R92 WeakPolarHBondContact O-CD 3.49Å; N88-R92 WeakPolarHBondContact O-CG 3.31Å; N88-R92 PolarHBondContact O-N 3.2Å; N88-R92 PolarHBondContact OD1-NE 3.34Å; D89-R92 WeakPolarHBondContact O-CB 3.29Å; D89-R92 PolarHBondContact O-N 2.88Å; D89-R92 IonicContact OD1-NH1 3.25Å; K90-R92 VanDerWaalsContact C-N 3.25Å; K90-R92 PolarHBondContact O-N 2.95Å; R92-N95 PolarHBondContact O-N 3.19Å; R92-I96 VanDerWaalsContact O-CG1 3.3Å; R92-I96 WeakPolarHBondContact O-CG1 3.23Å; R92-I96 PolarHBondContact O-N 2.94Å
93	C	92	Very high	89.4	Confident	85 Å²	85	99.2 Å²	99.2	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-60.6	-44.1	175.3	-71.8	0	0	0	0	111.9	D89 K90 I96 A97	D89-C93 PolarHBondContact O-N 3.01Å; D89-C93 PolarHBondContact O-SG 2.74Å; D89-C93 VanDerWaalsContact O-SG 3.39Å; K90-C93 WeakPolarHBondContact O-CB 3.12Å; K90-C93 PolarHBondContact O-N 2.88Å; K90-C93 VanDerWaalsContact O-N 3.12Å; C93-I96 PolarHBondContact O-N 2.9Å; C93-A97 PolarHBondContact O-N 2.92Å
94	E	94	Very high	88.3	Confident	91 Å²	91	96.7 Å²	96.7	43%	0.425	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-43.5	175.8	-71.9	173.4	-175.7	0	0	111.8	K90 I91 I96 A97 M98	K90-E94 WeakPolarHBondContact CE-OE1 3.47Å; K90-E94 WeakPolarHBondContact O-CG 3.45Å; K90-E94 PolarHBondContact O-N 3.29Å; I91-E94 PolarHBondContact O-N 3.38Å; E94-I96 VanDerWaalsContact C-N 3.33Å; E94-I96 PolarHBondContact O-N 3.12Å; E94-A97 PolarHBondContact O-N 3.28Å; E94-M98 HydrophobicContact CB-CE 4.48Å; E94-M98 WeakPolarHBondContact O-CB 3.36Å; E94-M98 WeakPolarHBondContact O-CG 3.4Å; E94-M98 PolarHBondContact O-N 3.22Å
95	N	89.3	Confident	87.3	Confident	63 Å²	63	96 Å²	96	34%	0.337	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-38	175.2	-81.7	-55.5	0	0	0	113	I91 R92 M98 R99	I91-N95 WeakPolarHBondContact CG2-ND2 3.1Å; I91-N95 WeakPolarHBondContact O-CB 3.35Å; I91-N95 PolarHBondContact O-N 2.98Å; I91-N95 PolarHBondContact O-ND2 3.31Å; R92-N95 PolarHBondContact O-N 3.19Å; N95-M98 WeakPolarHBondContact OD1-CE 3.21Å; N95-R99 WeakPolarHBondContact O-CB 3.28Å; N95-R99 VanDerWaalsContact O-CG 3.26Å; N95-R99 WeakPolarHBondContact O-CG 3.39Å; N95-R99 PolarHBondContact O-N 2.91Å; N95-R99 VanDerWaalsContact O-N 3.09Å
96	I	89.4	Confident	86.1	Confident	89 Å²	89	93 Å²	93	46%	0.456	49%	0.485	S	S	.	.	H	α-helix	trans	-64.1	-48.5	174.1	-68.8	164.7	0	0	0	109.9	R92 C93 E94 M98 R99 E100	R92-I96 VanDerWaalsContact O-CG1 3.3Å; R92-I96 WeakPolarHBondContact O-CG1 3.23Å; R92-I96 PolarHBondContact O-N 2.94Å; C93-I96 PolarHBondContact O-N 2.9Å; E94-I96 VanDerWaalsContact C-N 3.33Å; E94-I96 PolarHBondContact O-N 3.12Å; I96-M98 PolarHBondContact O-N 3.13Å; I96-R99 PolarHBondContact O-N 3.04Å; I96-E100 PolarHBondContact O-N 2.73Å
97	A	88.5	Confident	84.7	Confident	55 Å²	55	92.6 Å²	92.6	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-41.4	179	0	0	0	0	0	112.6	C93 E94 R99 E100 A101	C93-A97 PolarHBondContact O-N 2.92Å; E94-A97 PolarHBondContact O-N 3.28Å; A97-R99 PolarHBondContact O-N 2.81Å; A97-E100 PolarHBondContact O-N 3.26Å; A97-A101 WeakPolarHBondContact O-CB 3.48Å; A97-A101 PolarHBondContact O-N 3.12Å
98	M	86.8	Confident	83.4	Confident	104 Å²	104	95.6 Å²	95.6	51%	0.512	50%	0.503	S	S	.	.	H	α-helix	trans	-62.7	-41	175.3	-74.5	-171.8	-75.3	0	0	112	E94 N95 I96 A101 L102	E94-M98 HydrophobicContact CB-CE 4.48Å; E94-M98 WeakPolarHBondContact O-CB 3.36Å; E94-M98 WeakPolarHBondContact O-CG 3.4Å; E94-M98 PolarHBondContact O-N 3.22Å; N95-M98 WeakPolarHBondContact OD1-CE 3.21Å; I96-M98 PolarHBondContact O-N 3.13Å; M98-A101 PolarHBondContact O-N 3.23Å; M98-L102 WeakPolarHBondContact O-CG 3.47Å; M98-L102 PolarHBondContact O-N 3.18Å
99	R	78.9	Confident	82.1	Confident	128 Å²	128	98.1 Å²	98.1	48%	0.483	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-41.4	176.1	-73.4	172.5	-178.5	156.2	-0.2	112.2	N95 I96 A97 A101 L102 R103	N95-R99 WeakPolarHBondContact O-CB 3.28Å; N95-R99 VanDerWaalsContact O-CG 3.26Å; N95-R99 WeakPolarHBondContact O-CG 3.39Å; N95-R99 PolarHBondContact O-N 2.91Å; N95-R99 VanDerWaalsContact O-N 3.09Å; I96-R99 PolarHBondContact O-N 3.04Å; A97-R99 PolarHBondContact O-N 2.81Å; R99-A101 VanDerWaalsContact C-N 3.34Å; R99-L102 PolarHBondContact O-N 3.08Å; R99-R103 WeakPolarHBondContact O-CG 3.48Å; R99-R103 PolarHBondContact O-N 3.43Å
100	E	81.7	Confident	81	Confident	122 Å²	122	98.9 Å²	98.9	57%	0.57	53%	0.533	S	S	*	.	H	α-helix	trans	-62.7	-41.6	173.6	-75.4	180	174.3	0	0	111.8	I96 A97 R103 S104	I96-E100 PolarHBondContact O-N 2.73Å; A97-E100 PolarHBondContact O-N 3.26Å; E100-R103 PolarHBondContact O-N 2.54Å; E100-S104 PolarHBondContact O-N 3.45Å
101	A	79.9	Confident	79.3	Confident	49 Å²	49	96.6 Å²	96.6	41%	0.405	54%	0.538	S	S	.	.	H	α-helix	trans	-60.4	-48.4	174.3	0	0	0	0	0	111.2	A97 M98 R99 R103 S104 V105	A97-A101 WeakPolarHBondContact O-CB 3.48Å; A97-A101 PolarHBondContact O-N 3.12Å; M98-A101 PolarHBondContact O-N 3.23Å; R99-A101 VanDerWaalsContact C-N 3.34Å; A101-R103 VanDerWaalsContact C-N 3.27Å; A101-R103 PolarHBondContact O-N 2.72Å; A101-S104 PolarHBondContact O-N 3.33Å; A101-S104 PolarHBondContact O-OG 3.32Å; A101-V105 WeakPolarHBondContact O-CG2 3.22Å; A101-V105 PolarHBondContact O-N 2.82Å
102	L	76.9	Confident	77.5	Confident	118 Å²	118	94.4 Å²	94.4	62%	0.618	53%	0.533	S	S	*	.	H	α-helix	trans	-60	-34.3	178	-73.6	171.7	0	0	0	113	M98 R99 S104 V105	M98-L102 WeakPolarHBondContact O-CG 3.47Å; M98-L102 PolarHBondContact O-N 3.18Å; R99-L102 PolarHBondContact O-N 3.08Å; L102-S104 PolarHBondContact O-N 3.06Å; L102-V105 PolarHBondContact O-N 2.95Å
103	R	71.9	Confident	75.6	Confident	144 Å²	144	93.1 Å²	93.1	54%	0.543	54%	0.543	S	S	.	.	H	α-helix	trans	-65.9	-20.4	173.1	-74.5	175.8	179.6	173.2	-1.6	113.8	R99 E100 A101 P114 D117	R99-R103 WeakPolarHBondContact O-CG 3.48Å; R99-R103 PolarHBondContact O-N 3.43Å; E100-R103 PolarHBondContact O-N 2.54Å; A101-R103 VanDerWaalsContact C-N 3.27Å; A101-R103 PolarHBondContact O-N 2.72Å; R103-P114 WeakPolarHBondContact O-CB 3.24Å; R103-P114 WeakPolarHBondContact O-CG 3.31Å; R103-D117 IonicContact CZ-OD2 2.71Å; R103-D117 IonicContact NH2-OD1 3.26Å; R103-D117 IonicContact NH2-OD2 3.65Å; R103-D117 PolarHBondContact NH2-OD2 3.06Å
104	S	72.2	Confident	74	Confident	88 Å²	88	91.5 Å²	91.5	62%	0.615	53%	0.532	S	S	*	.	H	α-helix	trans	-97	-10	176.5	70.7	0	0	0	0	113.5	E100 A101 L102 I106	E100-S104 PolarHBondContact O-N 3.45Å; A101-S104 PolarHBondContact O-N 3.33Å; A101-S104 PolarHBondContact O-OG 3.32Å; L102-S104 PolarHBondContact O-N 3.06Å; S104-I106 PolarHBondContact O-N 3.13Å
105	V	73.2	Confident	72.3	Confident	90 Å²	90	92.7 Å²	92.7	55%	0.545	55%	0.545	S	S	.	.			trans	-77	111.3	-178.7	170	0	0	0	0	109.3	A101 L102	A101-V105 WeakPolarHBondContact O-CG2 3.22Å; A101-V105 PolarHBondContact O-N 2.82Å; L102-V105 PolarHBondContact O-N 2.95Å
106	I	69.6	Low	70.6	Confident	115 Å²	115	93.4 Å²	93.4	59%	0.59	56%	0.56	S	S	*	*			trans	-101.1	131.2	172.7	-57.4	170.9	0	0	0	107.8	S104 P108	S104-I106 PolarHBondContact O-N 3.13Å; I106-P108 VanDerWaalsContact O-CD 3.32Å; I106-P108 WeakPolarHBondContact O-CD 3.34Å
107	C	64.5	Low	68.9	Low	51 Å²	51	93 Å²	93	35%	0.345	56%	0.559	S	S	.	*			trans	-70.4	118.4	173.5	177.8	0	0	0	0	110	T109 C110 G111	C107-T109 PolarHBondContact O-N 3.27Å; C107-T109 VanDerWaalsContact O-N 3.15Å; C107-C110 VanDerWaalsContact CB-SG 3.59Å; C107-G111 WeakPolarHBondContact O-CA 3.33Å; C107-G111 PolarHBondContact O-N 2.87Å
108	P	70	Confident	67.3	Low	133 Å²	133	95.2 Å²	95.2	86%	0.864	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-13.9	-179.6	25.6	-32.4	0	0	0	113.7	I106	I106-P108 VanDerWaalsContact O-CD 3.32Å; I106-P108 WeakPolarHBondContact O-CD 3.34Å
109	T	67.5	Low	65.9	Low	135 Å²	135	97.7 Å²	97.7	83%	0.828	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-33.1	-177	-47.5	0	0	0	0	113.7	C107	C107-T109 PolarHBondContact O-N 3.27Å; C107-T109 VanDerWaalsContact O-N 3.15Å
110	C	71.3	Confident	64.6	Low	99 Å²	99	98.8 Å²	98.8	67%	0.669	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	-7.2	-178.8	65.3	0	0	0	0	114.6	C107 G112	C107-C110 VanDerWaalsContact CB-SG 3.59Å; C110-G112 PolarHBondContact O-N 2.96Å
111	G	61.1	Low	63.8	Low	54 Å²	54	96.5 Å²	96.5	56%	0.557	57%	0.568	S	S	*	*			trans	57.9	12.4	-177	0	0	0	0	0	114.1	C107	C107-G111 WeakPolarHBondContact O-CA 3.33Å; C107-G111 PolarHBondContact O-N 2.87Å
112	G	56.2	Low	63.3	Low	25 Å²	25	98.8 Å²	98.8	26%	0.258	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-62.9	139.4	-174.4	0	0	0	0	0	110.7	C110	C110-G112 PolarHBondContact O-N 2.96Å
113	P	53.4	Low	63.2	Low	117 Å²	117	98 Å²	98	76%	0.76	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-60.2	152.2	179.8	24.8	-31.9	0	0	0	110.5	V115	P113-V115 PolarHBondContact O-N 2.8Å
114	P	56.9	Low	63.4	Low	52 Å²	52	96.9 Å²	96.9	34%	0.338	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-54.9	132.8	179.1	-9.9	17.5	0	0	0	109.6	R103 A116	R103-P114 WeakPolarHBondContact O-CB 3.24Å; R103-P114 WeakPolarHBondContact O-CG 3.31Å; P114-A116 PolarHBondContact O-N 2.89Å
115	V	58.5	Low	63.9	Low	115 Å²	115	96.9 Å²	96.9	70%	0.697	56%	0.555	S	S	*	*			trans	-46.1	114.5	179.4	-177.9	0	0	0	0	108.7	P113 D118	P113-V115 PolarHBondContact O-N 2.8Å; V115-D118 WeakPolarHBondContact CG1-OD2 3.12Å
116	A	53.7	Low	64.3	Low	79 Å²	79	99.5 Å²	99.5	65%	0.653	56%	0.555	S	S	*	*			trans	-62.2	150.2	175.6	0	0	0	0	0	109.2	P114 D118	P114-A116 PolarHBondContact O-N 2.89Å; A116-D118 PolarHBondContact O-N 3.2Å
117	D	53.9	Low	64.9	Low	81 Å²	81	99.7 Å²	99.7	43%	0.433	56%	0.555	S	S	.	*			trans	-49.3	84.5	-170.6	-81.2	-50.5	0	0	0	114.8	R103 Y119 F120	R103-D117 IonicContact CZ-OD2 2.71Å; R103-D117 IonicContact NH2-OD1 3.26Å; R103-D117 IonicContact NH2-OD2 3.65Å; R103-D117 PolarHBondContact NH2-OD2 3.06Å; D117-Y119 PolarHBondContact O-N 2.78Å; D117-Y119 VanDerWaalsContact O-N 3.14Å; D117-F120 PolarHBondContact O-N 3.35Å
118	D	55.2	Low	65.9	Low	101 Å²	101	101.8 Å²	101.8	54%	0.54	56%	0.56	S	S	.	*	H	α-helix	trans	-64.2	-17.8	-178.6	-78.9	-18.8	0	0	0	113.9	V115 A116 F120 D121 E122	V115-D118 WeakPolarHBondContact CG1-OD2 3.12Å; A116-D118 PolarHBondContact O-N 3.2Å; D118-F120 VanDerWaalsContact C-N 3.31Å; D118-F120 PolarHBondContact O-N 3.48Å; D118-D121 WeakPolarHBondContact O-CA 3.4Å; D118-D121 PolarHBondContact O-N 2.86Å; D118-E122 PolarHBondContact O-N 3.05Å
119	Y	56.5	Low	66.9	Low	155 Å²	155	99.7 Å²	99.7	61%	0.608	54%	0.541	S	S	*	.	H	α-helix	trans	-66.6	-35.2	179.4	-170.9	-97.9	0	0	0	112	D117 D121	D117-Y119 PolarHBondContact O-N 2.78Å; D117-Y119 VanDerWaalsContact O-N 3.14Å; Y119-D121 VanDerWaalsContact C-N 3.29Å
120	F	51.4	Low	68	Low	152 Å²	152	95.6 Å²	95.6	67%	0.667	52%	0.521	S	S	*	.	H	α-helix	trans	-70.9	-29.7	171.5	-82.9	-75.5	0	0	0	111.4	D117 D118 K124	D117-F120 PolarHBondContact O-N 3.35Å; D118-F120 VanDerWaalsContact C-N 3.31Å; D118-F120 PolarHBondContact O-N 3.48Å; F120-K124 WeakPolarHBondContact O-CB 3.43Å; F120-K124 PolarHBondContact O-N 3.25Å
121	D	66	Low	68.9	Low	74 Å²	74	99.3 Å²	99.3	40%	0.396	52%	0.521	S	S	.	.	H	α-helix	trans	-70	-38.2	177.1	-90.7	-16.7	0	0	0	112.3	D118 Y119 Q123 K124 L125	D118-D121 WeakPolarHBondContact O-CA 3.4Å; D118-D121 PolarHBondContact O-N 2.86Å; Y119-D121 VanDerWaalsContact C-N 3.29Å; D121-Q123 PolarHBondContact O-N 3.44Å; D121-K124 PolarHBondContact O-N 3.18Å; D121-K124 IonicContact OD1-NZ 3.2Å; D121-L125 WeakPolarHBondContact O-CA 3.45Å; D121-L125 WeakPolarHBondContact O-CB 3.37Å; D121-L125 WeakPolarHBondContact O-CD1 3.45Å; D121-L125 WeakPolarHBondContact O-CG 3.41Å; D121-L125 PolarHBondContact O-N 2.83Å
122	E	69.5	Low	70.4	Confident	96 Å²	96	101.4 Å²	101.4	45%	0.449	52%	0.519	S	S	.	.	H	α-helix	trans	-66.9	-41.7	177	-155.6	-162.3	-179	0	0	112.3	D118 L125 R126	D118-E122 PolarHBondContact O-N 3.05Å; E122-L125 PolarHBondContact O-N 3.45Å; E122-R126 VanDerWaalsContact CD-CZ 3.47Å; E122-R126 VanDerWaalsContact CD-NH2 3.29Å; E122-R126 WeakPolarHBondContact O-CG 3.44Å; E122-R126 PolarHBondContact O-N 2.86Å; E122-R126 IonicContact OE1-CZ 2.76Å; E122-R126 VanDerWaalsContact OE1-CZ 3.25Å; E122-R126 IonicContact OE1-NH1 3.62Å; E122-R126 PolarHBondContact OE1-NH1 3.4Å; E122-R126 IonicContact OE1-NH2 3.42Å; E122-R126 PolarHBondContact OE1-NH2 3.35Å; E122-R126 IonicContact OE2-CZ 2.74Å; E122-R126 IonicContact OE2-NH1 3.49Å; E122-R126 PolarHBondContact OE2-NH1 3.22Å; E122-R126 IonicContact OE2-NH2 3.08Å
123	Q	74.7	Confident	71.8	Confident	102 Å²	102	106.6 Å²	106.6	48%	0.477	54%	0.535	S	S	.	.	H	α-helix	trans	-69.9	-36	175.7	-174.2	159.9	-16.2	0	0	112.1	D121 R126 M127	D121-Q123 PolarHBondContact O-N 3.44Å; Q123-R126 WeakPolarHBondContact O-CB 3.44Å; Q123-R126 PolarHBondContact O-N 2.88Å; Q123-M127 HydrophobicContact CG-CE 4.48Å; Q123-M127 WeakPolarHBondContact O-CG 3.29Å; Q123-M127 PolarHBondContact O-N 2.81Å
124	K	76.5	Confident	73.5	Confident	120 Å²	120	107.8 Å²	107.8	52%	0.522	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-41.5	172.8	-175.7	-175.2	176.7	-166	0	111.5	F120 D121 R126 M127 E128	F120-K124 WeakPolarHBondContact O-CB 3.43Å; F120-K124 PolarHBondContact O-N 3.25Å; D121-K124 PolarHBondContact O-N 3.18Å; D121-K124 IonicContact OD1-NZ 3.2Å; K124-R126 VanDerWaalsContact C-N 3.31Å; K124-R126 PolarHBondContact O-N 3.35Å; K124-M127 CarbonylContact O-C 3.59Å; K124-M127 PolarHBondContact O-N 3.2Å; K124-E128 VanDerWaalsContact O-CB 3.22Å; K124-E128 WeakPolarHBondContact O-CB 3.4Å; K124-E128 PolarHBondContact O-N 2.77Å
125	L	81.9	Confident	75	Confident	88 Å²	88	109 Å²	109	46%	0.461	53%	0.531	S	S	.	.	H	α-helix	trans	-64.4	-35	172.6	-75.1	168.9	0	0	0	111.2	D121 E122 N129	D121-L125 WeakPolarHBondContact O-CA 3.45Å; D121-L125 WeakPolarHBondContact O-CB 3.37Å; D121-L125 WeakPolarHBondContact O-CD1 3.45Å; D121-L125 WeakPolarHBondContact O-CG 3.41Å; D121-L125 PolarHBondContact O-N 2.83Å; E122-L125 PolarHBondContact O-N 3.45Å; L125-N129 WeakPolarHBondContact O-CB 3.24Å; L125-N129 PolarHBondContact O-N 3.47Å; L125-N129 PolarHBondContact O-ND2 3.24Å
126	R	81.4	Confident	76.4	Confident	145 Å²	145	109.3 Å²	109.3	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-45.2	171.1	-77.4	-176.9	-179.8	97.6	5.6	111.6	E122 Q123 K124 E128 A130	E122-R126 VanDerWaalsContact CD-CZ 3.47Å; E122-R126 VanDerWaalsContact CD-NH2 3.29Å; E122-R126 WeakPolarHBondContact O-CG 3.44Å; E122-R126 PolarHBondContact O-N 2.86Å; E122-R126 IonicContact OE1-CZ 2.76Å; E122-R126 VanDerWaalsContact OE1-CZ 3.25Å; E122-R126 IonicContact OE1-NH1 3.62Å; E122-R126 PolarHBondContact OE1-NH1 3.4Å; E122-R126 IonicContact OE1-NH2 3.42Å; E122-R126 PolarHBondContact OE1-NH2 3.35Å; E122-R126 IonicContact OE2-CZ 2.74Å; E122-R126 IonicContact OE2-NH1 3.49Å; E122-R126 PolarHBondContact OE2-NH1 3.22Å; E122-R126 IonicContact OE2-NH2 3.08Å; Q123-R126 WeakPolarHBondContact O-CB 3.44Å; Q123-R126 PolarHBondContact O-N 2.88Å; K124-R126 VanDerWaalsContact C-N 3.31Å; K124-R126 PolarHBondContact O-N 3.35Å; R126-E128 VanDerWaalsContact C-N 3.34Å; R126-A130 WeakPolarHBondContact O-CB 3.34Å; R126-A130 PolarHBondContact O-N 3.02Å
127	M	82.3	Confident	78	Confident	119 Å²	119	110.9 Å²	110.9	59%	0.586	53%	0.526	S	S	*	.	H	α-helix	trans	-65.2	-38.5	175.6	-70.9	-173.3	-65.5	0	0	111.9	Q123 K124 A130 R131	Q123-M127 HydrophobicContact CG-CE 4.48Å; Q123-M127 WeakPolarHBondContact O-CG 3.29Å; Q123-M127 PolarHBondContact O-N 2.81Å; K124-M127 CarbonylContact O-C 3.59Å; K124-M127 PolarHBondContact O-N 3.2Å; M127-A130 PolarHBondContact O-N 2.84Å; M127-R131 WeakPolarHBondContact O-CB 3.32Å; M127-R131 PolarHBondContact O-N 3.15Å
128	E	86.6	Confident	79.5	Confident	96 Å²	96	113.4 Å²	113.4	45%	0.449	53%	0.529	S	S	.	.	H	α-helix	trans	-69.6	-44.1	177.1	-174.6	168.4	-167.7	0	0	111.2	K124 R126 A130 R131 L132	K124-E128 VanDerWaalsContact O-CB 3.22Å; K124-E128 WeakPolarHBondContact O-CB 3.4Å; K124-E128 PolarHBondContact O-N 2.77Å; R126-E128 VanDerWaalsContact C-N 3.34Å; E128-A130 VanDerWaalsContact C-N 3.33Å; E128-A130 PolarHBondContact O-N 2.88Å; E128-R131 CarbonylContact O-C 3.59Å; E128-R131 PolarHBondContact O-N 3.21Å; E128-L132 HydrophobicContact CG-CD1 4.05Å; E128-L132 HydrophobicContact CG-CG 4.38Å; E128-L132 WeakPolarHBondContact O-CB 3.35Å; E128-L132 VanDerWaalsContact O-CG 3.27Å; E128-L132 WeakPolarHBondContact O-CG 3.43Å; E128-L132 PolarHBondContact O-N 2.94Å
129	N	89.1	Confident	80.7	Confident	88 Å²	88	111.5 Å²	111.5	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-62	-39.3	172.3	-86.6	-61.4	0	0	0	112.1	L125 L132 K133	L125-N129 WeakPolarHBondContact O-CB 3.24Å; L125-N129 PolarHBondContact O-N 3.47Å; L125-N129 PolarHBondContact O-ND2 3.24Å; N129-L132 PolarHBondContact O-N 2.69Å; N129-K133 WeakPolarHBondContact O-CB 3.42Å; N129-K133 WeakPolarHBondContact O-CG 3.49Å; N129-K133 PolarHBondContact O-N 2.82Å
130	A	90.6	Very high	81.9	Confident	50 Å²	50	105.5 Å²	105.5	41%	0.413	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-44.9	174.1	0	0	0	0	0	111.2	R126 M127 E128 K133 E134	R126-A130 WeakPolarHBondContact O-CB 3.34Å; R126-A130 PolarHBondContact O-N 3.02Å; M127-A130 PolarHBondContact O-N 2.84Å; E128-A130 VanDerWaalsContact C-N 3.33Å; E128-A130 PolarHBondContact O-N 2.88Å; A130-K133 WeakPolarHBondContact O-CB 3.33Å; A130-K133 PolarHBondContact O-N 2.86Å; A130-E134 PolarHBondContact O-N 3.41Å
131	R	90.9	Very high	83.3	Confident	176 Å²	176	101 Å²	101	66%	0.664	49%	0.49	S	S	*	.	H	α-helix	trans	-64	-43.8	175.3	-178.4	-175	168.1	-174	-3.7	112.6	M127 E128 K133 E134 E135	M127-R131 WeakPolarHBondContact O-CB 3.32Å; M127-R131 PolarHBondContact O-N 3.15Å; E128-R131 CarbonylContact O-C 3.59Å; E128-R131 PolarHBondContact O-N 3.21Å; R131-K133 VanDerWaalsContact C-N 3.27Å; R131-K133 PolarHBondContact O-N 3.08Å; R131-E134 PolarHBondContact O-N 3.38Å; R131-E135 PolarHBondContact O-N 2.87Å
132	L	93	Very high	83.8	Confident	99 Å²	99	101.2 Å²	101.2	52%	0.518	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-33.6	177.8	-73.3	171	0	0	0	111.4	E128 N129 E135 L136	E128-L132 HydrophobicContact CG-CD1 4.05Å; E128-L132 HydrophobicContact CG-CG 4.38Å; E128-L132 WeakPolarHBondContact O-CB 3.35Å; E128-L132 VanDerWaalsContact O-CG 3.27Å; E128-L132 WeakPolarHBondContact O-CG 3.43Å; E128-L132 PolarHBondContact O-N 2.94Å; N129-L132 PolarHBondContact O-N 2.69Å; L132-E135 PolarHBondContact O-N 3.25Å; L132-L136 WeakPolarHBondContact O-CB 3.3Å; L132-L136 PolarHBondContact O-N 3.35Å
133	K	84.7	Confident	84	Confident	133 Å²	133	98 Å²	98	58%	0.578	48%	0.477	S	S	*	.	H	α-helix	trans	-64.9	-47	171.4	-76.8	172.1	179.5	-175.7	0	111.9	N129 A130 R131 E135 L136 D137	N129-K133 WeakPolarHBondContact O-CB 3.42Å; N129-K133 WeakPolarHBondContact O-CG 3.49Å; N129-K133 PolarHBondContact O-N 2.82Å; A130-K133 WeakPolarHBondContact O-CB 3.33Å; A130-K133 PolarHBondContact O-N 2.86Å; R131-K133 VanDerWaalsContact C-N 3.27Å; R131-K133 PolarHBondContact O-N 3.08Å; K133-E135 VanDerWaalsContact C-N 3.28Å; K133-E135 PolarHBondContact O-N 2.98Å; K133-L136 PolarHBondContact O-N 3.43Å; K133-D137 WeakPolarHBondContact O-CB 3.4Å; K133-D137 PolarHBondContact O-N 2.69Å
134	E	89.8	Confident	83.9	Confident	143 Å²	143	94.9 Å²	94.9	67%	0.668	47%	0.466	S	S	*	.	H	α-helix	trans	-59.7	-39.7	174.4	-73.1	179.2	-179.5	0	0	111.7	A130 R131 D137 R138	A130-E134 PolarHBondContact O-N 3.41Å; R131-E134 PolarHBondContact O-N 3.38Å; E134-D137 PolarHBondContact O-N 2.84Å; E134-R138 VanDerWaalsContact O-CB 3.28Å; E134-R138 WeakPolarHBondContact O-CB 3.48Å; E134-R138 PolarHBondContact O-N 3.27Å
135	E	88.2	Confident	83.7	Confident	78 Å²	78	97.3 Å²	97.3	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-67.4	-40.7	176.7	-158.7	69.4	-144.8	0	0	111.7	R131 L132 K133 R138 V139	R131-E135 PolarHBondContact O-N 2.87Å; L132-E135 PolarHBondContact O-N 3.25Å; K133-E135 VanDerWaalsContact C-N 3.28Å; K133-E135 PolarHBondContact O-N 2.98Å; E135-R138 PolarHBondContact O-N 3.17Å; E135-R138 IonicContact OE1-CZ 2.77Å; E135-R138 IonicContact OE1-NE 3.73Å; E135-R138 PolarHBondContact OE1-NE 3.36Å; E135-R138 VanDerWaalsContact OE1-NE 3.08Å; E135-R138 IonicContact OE1-NH2 2.85Å; E135-R138 PolarHBondContact OE1-NH2 2.98Å; E135-V139 WeakPolarHBondContact O-CB 3.32Å; E135-V139 VanDerWaalsContact O-CG2 3.28Å; E135-V139 WeakPolarHBondContact O-CG2 3.47Å; E135-V139 PolarHBondContact O-N 3Å
136	L	87.6	Confident	83.2	Confident	120 Å²	120	102.3 Å²	102.3	63%	0.628	49%	0.491	S	S	*	.	H	α-helix	trans	-63.8	-43.9	175	-178.1	64.9	0	0	0	111.4	L132 K133 R138 V139 S140	L132-L136 WeakPolarHBondContact O-CB 3.3Å; L132-L136 PolarHBondContact O-N 3.35Å; K133-L136 PolarHBondContact O-N 3.43Å; L136-R138 VanDerWaalsContact C-N 3.35Å; L136-V139 PolarHBondContact O-N 3.02Å; L136-S140 WeakPolarHBondContact O-CB 3.46Å; L136-S140 PolarHBondContact O-N 2.82Å
137	D	87.7	Confident	82.4	Confident	112 Å²	112	101.7 Å²	101.7	60%	0.599	50%	0.498	S	S	*	.	H	α-helix	trans	-64.3	-41	176	-77.1	-19.7	0	0	0	111.1	K133 E134 S140 S141	K133-D137 WeakPolarHBondContact O-CB 3.4Å; K133-D137 PolarHBondContact O-N 2.69Å; E134-D137 PolarHBondContact O-N 2.84Å; D137-S140 PolarHBondContact O-N 2.95Å; D137-S141 VanDerWaalsContact O-CB 3.26Å; D137-S141 WeakPolarHBondContact O-CB 3.41Å; D137-S141 PolarHBondContact O-N 2.9Å; D137-S141 PolarHBondContact O-OG 3.42Å
138	R	85.1	Confident	81	Confident	134 Å²	134	99 Å²	99	51%	0.506	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-48.1	175.3	-165.8	-174.2	74.5	77.9	0.7	111.3	E134 E135 L136 S141 L142	E134-R138 VanDerWaalsContact O-CB 3.28Å; E134-R138 WeakPolarHBondContact O-CB 3.48Å; E134-R138 PolarHBondContact O-N 3.27Å; E135-R138 PolarHBondContact O-N 3.17Å; E135-R138 IonicContact OE1-CZ 2.77Å; E135-R138 IonicContact OE1-NE 3.73Å; E135-R138 PolarHBondContact OE1-NE 3.36Å; E135-R138 VanDerWaalsContact OE1-NE 3.08Å; E135-R138 IonicContact OE1-NH2 2.85Å; E135-R138 PolarHBondContact OE1-NH2 2.98Å; L136-R138 VanDerWaalsContact C-N 3.35Å; R138-S141 PolarHBondContact O-N 3.08Å; R138-S141 PolarHBondContact O-OG 3.36Å; R138-L142 WeakPolarHBondContact O-CB 3.21Å; R138-L142 PolarHBondContact O-N 3.19Å
139	V	81.5	Confident	79.5	Confident	62 Å²	62	103.9 Å²	103.9	38%	0.376	52%	0.515	S	S	.	.	H	α-helix	trans	-65.6	-46	177.7	172.1	0	0	0	0	110.7	E135 L136 S141 L142 T143	E135-V139 WeakPolarHBondContact O-CB 3.32Å; E135-V139 VanDerWaalsContact O-CG2 3.28Å; E135-V139 WeakPolarHBondContact O-CG2 3.47Å; E135-V139 PolarHBondContact O-N 3Å; L136-V139 PolarHBondContact O-N 3.02Å; V139-S141 VanDerWaalsContact C-N 3.3Å; V139-S141 PolarHBondContact O-N 3.21Å; V139-L142 PolarHBondContact O-N 2.82Å; V139-L142 VanDerWaalsContact O-N 3.14Å; V139-T143 WeakPolarHBondContact O-CB 3.32Å; V139-T143 PolarHBondContact O-N 2.97Å; V139-T143 PolarHBondContact O-OG1 3.47Å
140	S	81.6	Confident	77.4	Confident	29 Å²	29	102.1 Å²	102.1	20%	0.203	51%	0.509	C	S	.	.	H	α-helix	trans	-59.1	-39.7	177	-176.8	0	0	0	0	112	L136 D137 S144	L136-S140 WeakPolarHBondContact O-CB 3.46Å; L136-S140 PolarHBondContact O-N 2.82Å; D137-S140 PolarHBondContact O-N 2.95Å; S140-S144 VanDerWaalsContact O-CB 3.26Å; S140-S144 WeakPolarHBondContact O-CB 3.48Å; S140-S144 PolarHBondContact O-N 2.97Å; S140-S144 PolarHBondContact O-OG 3.41Å
141	S	79.5	Confident	75.6	Confident	58 Å²	58	104.4 Å²	104.4	41%	0.406	51%	0.513	S	S	.	.	H	α-helix	trans	-68.9	-38.7	175.7	77.9	0	0	0	0	112.6	D137 R138 V139 S144 K145	D137-S141 VanDerWaalsContact O-CB 3.26Å; D137-S141 WeakPolarHBondContact O-CB 3.41Å; D137-S141 PolarHBondContact O-N 2.9Å; D137-S141 PolarHBondContact O-OG 3.42Å; R138-S141 PolarHBondContact O-N 3.08Å; R138-S141 PolarHBondContact O-OG 3.36Å; V139-S141 VanDerWaalsContact C-N 3.3Å; V139-S141 PolarHBondContact O-N 3.21Å; S141-S144 PolarHBondContact O-N 2.89Å; S141-K145 WeakPolarHBondContact O-CG 3.2Å; S141-K145 PolarHBondContact O-N 3.46Å; S141-K145 VanDerWaalsContact O-N 3.09Å
142	L	78.4	Confident	74	Confident	78 Å²	78	101.9 Å²	101.9	41%	0.408	52%	0.517	S	S	.	.	H	α-helix	trans	-67.2	-47.4	176.1	-169.3	66.9	0	0	0	110.4	R138 V139 S144 K145 Y146	R138-L142 WeakPolarHBondContact O-CB 3.21Å; R138-L142 PolarHBondContact O-N 3.19Å; V139-L142 PolarHBondContact O-N 2.82Å; V139-L142 VanDerWaalsContact O-N 3.14Å; L142-S144 VanDerWaalsContact C-N 3.33Å; L142-S144 PolarHBondContact O-N 3.02Å; L142-K145 WeakPolarHBondContact O-CB 3.29Å; L142-K145 PolarHBondContact O-N 2.84Å; L142-K145 VanDerWaalsContact O-N 3.13Å; L142-Y146 HydrophobicContact CD1-CD2 4.21Å; L142-Y146 HydrophobicContact CD1-CE2 3.62Å; L142-Y146 HydrophobicContact CG-CD2 4.06Å; L142-Y146 HydrophobicContact CG-CE2 3.85Å; L142-Y146 WeakPolarHBondContact O-CD2 3.28Å; L142-Y146 PolarHBondContact O-N 3.49Å; L142-Y146 VanDerWaalsContact O-N 3.15Å
143	T	72.4	Confident	71.5	Confident	27 Å²	27	104.4 Å²	104.4	17%	0.166	53%	0.526	C	S	.	.	H	α-helix	trans	-59.6	-43.3	174.9	-63.3	0	0	0	0	110.9	V139 K145 Y146 L147 I151	V139-T143 WeakPolarHBondContact O-CB 3.32Å; V139-T143 PolarHBondContact O-N 2.97Å; V139-T143 PolarHBondContact O-OG1 3.47Å; T143-K145 VanDerWaalsContact C-N 3.28Å; T143-K145 PolarHBondContact O-N 3.35Å; T143-Y146 PolarHBondContact O-N 2.93Å; T143-Y146 VanDerWaalsContact O-N 3.1Å; T143-L147 HydrophobicContact CG2-CB 4.4Å; T143-L147 HydrophobicContact CG2-CD1 3.49Å; T143-L147 VanDerWaalsContact CG2-CD1 3.49Å; T143-L147 WeakPolarHBondContact O-CB 3.5Å; T143-L147 PolarHBondContact O-N 2.93Å; T143-I151 HydrophobicContact CG2-CD1 3.63Å; T143-I151 HydrophobicContact CG2-CG1 3.96Å
144	S	72.1	Confident	69.2	Low	37 Å²	37	104.6 Å²	104.6	26%	0.259	53%	0.533	S	S	.	.	H	α-helix	trans	-62.7	-32.9	176.4	-62.5	0	0	0	0	112.6	S140 S141 L142 G148	S140-S144 VanDerWaalsContact O-CB 3.26Å; S140-S144 WeakPolarHBondContact O-CB 3.48Å; S140-S144 PolarHBondContact O-N 2.97Å; S140-S144 PolarHBondContact O-OG 3.41Å; S141-S144 PolarHBondContact O-N 2.89Å; L142-S144 VanDerWaalsContact C-N 3.33Å; L142-S144 PolarHBondContact O-N 3.02Å; S144-G148 VanDerWaalsContact O-CA 3.29Å; S144-G148 WeakPolarHBondContact O-CA 3.5Å; S144-G148 PolarHBondContact O-N 2.91Å
145	K	73.5	Confident	66.6	Low	172 Å²	172	102.6 Å²	102.6	75%	0.748	53%	0.532	S	S	*	.	H	α-helix	trans	-68.6	-33.3	173	-74	174.1	-178.2	176.8	0	113.3	S141 L142 T143	S141-K145 WeakPolarHBondContact O-CG 3.2Å; S141-K145 PolarHBondContact O-N 3.46Å; S141-K145 VanDerWaalsContact O-N 3.09Å; L142-K145 WeakPolarHBondContact O-CB 3.29Å; L142-K145 PolarHBondContact O-N 2.84Å; L142-K145 VanDerWaalsContact O-N 3.13Å; T143-K145 VanDerWaalsContact C-N 3.28Å; T143-K145 PolarHBondContact O-N 3.35Å
146	Y	70.7	Confident	64.4	Low	192 Å²	192	105.1 Å²	105.1	75%	0.753	56%	0.555	S	S	*	*	H	α-helix	trans	-92.9	-33.9	-179.1	-73.3	-73.7	0	0	0	114.4	L142 T143	L142-Y146 HydrophobicContact CD1-CD2 4.21Å; L142-Y146 HydrophobicContact CD1-CE2 3.62Å; L142-Y146 HydrophobicContact CG-CD2 4.06Å; L142-Y146 HydrophobicContact CG-CE2 3.85Å; L142-Y146 WeakPolarHBondContact O-CD2 3.28Å; L142-Y146 PolarHBondContact O-N 3.49Å; L142-Y146 VanDerWaalsContact O-N 3.15Å; T143-Y146 PolarHBondContact O-N 2.93Å; T143-Y146 VanDerWaalsContact O-N 3.1Å
147	L	64.3	Low	61.8	Low	133 Å²	133	103.6 Å²	103.6	70%	0.696	56%	0.56	S	S	*	*	H	α-helix	trans	-103.6	-7.7	-176.6	-81.1	126.1	0	0	0	113.8	T143 R149	T143-L147 HydrophobicContact CG2-CB 4.4Å; T143-L147 HydrophobicContact CG2-CD1 3.49Å; T143-L147 VanDerWaalsContact CG2-CD1 3.49Å; T143-L147 WeakPolarHBondContact O-CB 3.5Å; T143-L147 PolarHBondContact O-N 2.93Å; L147-R149 PolarHBondContact O-N 3.19Å; L147-R149 VanDerWaalsContact O-N 3.13Å
148	G	54	Low	59.4	Low	63 Å²	63	108 Å²	108	65%	0.649	58%	0.578	S	S	*	*	S	Bend	trans	70.6	2.5	174.6	0	0	0	0	0	115.8	S144	S144-G148 VanDerWaalsContact O-CA 3.29Å; S144-G148 WeakPolarHBondContact O-CA 3.5Å; S144-G148 PolarHBondContact O-N 2.91Å
149	R	55.3	Low	56.9	Low	197 Å²	197	105.6 Å²	105.6	74%	0.743	59%	0.586	S	S	*	*	S	Bend	trans	-149.1	144.6	174	-65	-169.9	-178.6	-167.1	0.2	112.1	L147	L147-R149 PolarHBondContact O-N 3.19Å; L147-R149 VanDerWaalsContact O-N 3.13Å
150	P	43.9	Very low	54.4	Low	52 Å²	52	107.5 Å²	107.5	34%	0.338	61%	0.608	S	S	.	*			trans	-71.3	139.9	178	26.9	-32	0	0	0	112.6	T152 Q153	P150-T152 PolarHBondContact O-N 3.07Å; P150-T152 VanDerWaalsContact O-N 3.12Å; P150-Q153 PolarHBondContact O-N 3.47Å
151	I	54	Low	52.1	Low	97 Å²	97	113.4 Å²	113.4	50%	0.497	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-57.7	-25.6	-177.8	-85.9	167.7	0	0	0	113.2	T143 Q153 L154	T143-I151 HydrophobicContact CG2-CD1 3.63Å; T143-I151 HydrophobicContact CG2-CG1 3.96Å; I151-Q153 PolarHBondContact O-N 3.01Å; I151-L154 PolarHBondContact O-N 3.18Å
152	T	56.7	Low	49.5	Very low	123 Å²	123	115.4 Å²	115.4	76%	0.755	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-65	-10.2	-177.2	46.2	0	0	0	0	114.4	P150	P150-T152 PolarHBondContact O-N 3.07Å; P150-T152 VanDerWaalsContact O-N 3.12Å
153	Q	41.3	Very low	47.2	Very low	153 Å²	153	119.8 Å²	119.8	72%	0.715	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-110.4	12.3	-179.7	-68.4	-169.7	-15.4	0	0	114.9	P150 I151 P155	P150-Q153 PolarHBondContact O-N 3.47Å; I151-Q153 PolarHBondContact O-N 3.01Å; Q153-P155 WeakPolarHBondContact O-CD 3.47Å
154	L	36.6	Very low	45.1	Very low	136 Å²	136	123 Å²	123	71%	0.712	70%	0.695	S	S	*	*			trans	-76.3	119.4	168.7	-87.3	150.8	0	0	0	109.5	I151	I151-L154 PolarHBondContact O-N 3.18Å
155	P	35	Very low	43	Very low	101 Å²	101	127.3 Å²	127.3	66%	0.656	73%	0.725	S	S	*	*			trans	-61	148.7	171.7	-14.7	28.7	0	0	0	109.2	Q153 A157	Q153-P155 WeakPolarHBondContact O-CD 3.47Å; P155-A157 VanDerWaalsContact C-N 3.27Å; P155-A157 PolarHBondContact O-N 3.29Å
156	P	40.2	Very low	40.8	Very low	131 Å²	131	126.7 Å²	126.7	85%	0.851	73%	0.729	S	S	*	*			trans	-67.1	86.7	-176.1	26.7	-32	0	0	0	110	Q158	P156-Q158 PolarHBondContact O-N 3.21Å
157	A	34.6	Very low	38.7	Very low	89 Å²	89	124.6 Å²	124.6	74%	0.736	73%	0.73	S	S	*	*			trans	-70.5	121.2	169.6	0	0	0	0	0	107.4	P155 A159	P155-A157 VanDerWaalsContact C-N 3.27Å; P155-A157 PolarHBondContact O-N 3.29Å; A157-A159 VanDerWaalsContact C-N 3.31Å; A157-A159 PolarHBondContact O-N 3.11Å
158	Q	36.7	Very low	37	Very low	205 Å²	205	125.8 Å²	125.8	96%	0.958	74%	0.737	S	S	*	*			trans	-54.3	89.5	174.6	-62.7	166.4	-24.7	0	0	109.9	P156	P156-Q158 PolarHBondContact O-N 3.21Å
159	A	31.7	Very low	35.6	Very low	82 Å²	82	128.3 Å²	128.3	68%	0.678	75%	0.745	S	S	*	*			trans	-112.1	94.3	167.7	0	0	0	0	0	107.2	A157 L161	A157-A159 VanDerWaalsContact C-N 3.31Å; A157-A159 PolarHBondContact O-N 3.11Å; A159-L161 VanDerWaalsContact C-N 3.29Å; A159-L161 PolarHBondContact O-N 3.08Å
160	A	29.6	Very low	34.4	Very low	102 Å²	102	125.9 Å²	125.9	84%	0.843	75%	0.751	S	S	*	*			trans	-49.8	96.8	155.9	0	0	0	0	0	109
161	L	32.8	Very low	33.6	Very low	154 Å²	154	127.2 Å²	127.2	81%	0.806	78%	0.775	S	S	*	*			trans	-109.6	92.1	154.1	-70	179.7	0	0	0	106.3	A159 M163	A159-L161 VanDerWaalsContact C-N 3.29Å; A159-L161 PolarHBondContact O-N 3.08Å; L161-M163 PolarHBondContact O-N 2.81Å
162	S	26.5	Very low	32.3	Very low	99 Å²	99	126.3 Å²	126.3	69%	0.692	79%	0.789	S	S	*	*			trans	-42.5	99.5	162	-179	0	0	0	0	109.6
163	M	30.4	Very low	30.8	Very low	170 Å²	170	129.6 Å²	129.6	84%	0.837	80%	0.801	S	S	*	*			trans	-97.9	111.5	155.9	-76.9	-72.2	94.5	0	0	106.4	L161 S165	L161-M163 PolarHBondContact O-N 2.81Å; M163-S165 PolarHBondContact O-N 2.91Å
164	S	27.6	Very low	30.1	Very low	96 Å²	96	125.6 Å²	125.6	67%	0.671	80%	0.801	S	S	*	*			trans	-56.6	117.2	-170.9	-43.1	0	0	0	0	110.6	L166	S164-L166 PolarHBondContact O-N 3.17Å; S164-L166 VanDerWaalsContact O-N 3.1Å
165	S	28.6	Very low	29.6	Very low	126 Å²	126	124.4 Å²	124.4	88%	0.881	80%	0.804	S	S	*	*			trans	-65.3	103.8	167.6	-175.3	0	0	0	0	108.9	M163	M163-S165 PolarHBondContact O-N 2.91Å
166	L	27	Very low	29.4	Very low	160 Å²	160	125.7 Å²	125.7	84%	0.838	81%	0.813	S	S	*	*			trans	-85.2	110.8	156.8	-78.9	151.3	0	0	0	106.5	S164	S164-L166 PolarHBondContact O-N 3.17Å; S164-L166 VanDerWaalsContact O-N 3.1Å
167	D	27	Very low	28.9	Very low	147 Å²	147	124.1 Å²	124.1	79%	0.786	81%	0.805	S	S	*	*				-165.5	156.9	124.1	-127.3	-32	0	0	0	113.4
168	L	28.5	Very low	28.9	Very low	159 Å²	159	127.9 Å²	127.9	83%	0.832	81%	0.811	S	S	*	*			trans	-75.9	143.1	-155.1	-70.2	146.4	0	0	0	114.9
169	S	24.4	Very low	28.8	Very low	116 Å²	116	123.8 Å²	123.8	81%	0.811	80%	0.796	S	S	*	*			trans	-52	144.1	161.4	-43.9	0	0	0	0	112.7
170	V	30.4	Very low	29.1	Very low	145 Å²	145	122.7 Å²	122.7	88%	0.879	78%	0.778	S	S	*	*				-173.3	131.4	116.1	152.3	0	0	0	0	107.7
171	G	25.5	Very low	29.5	Very low	81 Å²	81	122.6 Å²	122.6	84%	0.835	76%	0.764	S	S	*	*			trans	-74.6	166.5	-166.2	0	0	0	0	0	116.8
172	G	27.9	Very low	29.9	Very low	78 Å²	78	121.6 Å²	121.6	80%	0.804	76%	0.759	S	S	*	*			trans	-169.4	94.8	169.6	0	0	0	0	0	109.8
173	L	24.8	Very low	30.7	Very low	191 Å²	191	120.6 Å²	120.6	100%	1	75%	0.745	S	S	*	*			trans	-67.3	128	167.3	-75.3	146.5	0	0	0	109.2
174	G	25.7	Very low	31.1	Very low	69 Å²	69	115.8 Å²	115.8	71%	0.711	73%	0.728	S	S	*	*			trans	159.3	93	164.6	0	0	0	0	0	116.6
175	S	27.1	Very low	31.2	Very low	112 Å²	112	113.9 Å²	113.9	78%	0.783	72%	0.724	S	S	*	*			trans	61.8	148	151.4	-72.3	0	0	0	0	120.4	S177	S175-S177 PolarHBondContact O-N 2.98Å
176	P	31.1	Very low	31.4	Very low	128 Å²	128	111.6 Å²	111.6	83%	0.831	72%	0.72	S	S	*	*			trans	-80.4	89.7	-173.4	33.4	-31.3	0	0	0	109.6	L178	P176-L178 PolarHBondContact O-N 2.82Å
177	S	29.3	Very low	31.6	Very low	98 Å²	98	109.8 Å²	109.8	69%	0.685	72%	0.721	S	S	*	*			trans	-72.4	119.5	160	50.7	0	0	0	0	108	S175 D179	S175-S177 PolarHBondContact O-N 2.98Å; S177-D179 PolarHBondContact O-N 3.49Å
178	L	34.1	Very low	31.9	Very low	167 Å²	167	107.5 Å²	107.5	87%	0.874	72%	0.717	S	S	*	*			trans	-53.1	106.4	170.1	-73	155.5	0	0	0	108.9	P176 L180	P176-L178 PolarHBondContact O-N 2.82Å; L178-L180 VanDerWaalsContact C-N 3.27Å; L178-L180 PolarHBondContact O-N 3.4Å
179	D	35.4	Very low	31.8	Very low	119 Å²	119	103.4 Å²	103.4	64%	0.636	71%	0.713	S	S	*	*			trans	-66	86.2	175.9	-99	-28.3	0	0	0	109.9	S177 D181	S177-D179 PolarHBondContact O-N 3.49Å; D179-D181 PolarHBondContact O-N 2.97Å
180	L	37.4	Very low	31.9	Very low	59 Å²	59	108.4 Å²	108.4	31%	0.309	72%	0.715	S	S	.	*	G	3₁₀ helix	trans	-70.1	-15.5	178.8	-169.8	62.2	0	0	0	112.4	L178 L182 L183 L670 A672	L178-L180 VanDerWaalsContact C-N 3.27Å; L178-L180 PolarHBondContact O-N 3.4Å; L180-L182 PolarHBondContact O-N 2.99Å; L180-L183 HydrophobicContact CD1-CD1 3.69Å; L180-L183 PolarHBondContact O-N 3.45Å; L180-L670 VanDerWaalsContact CD2-O 3.31Å; L180-L670 WeakPolarHBondContact CD2-O 3.28Å; L180-A672 HydrophobicContact CD2-CB 4.33Å
181	D	38.2	Very low	32	Very low	101 Å²	101	105.6 Å²	105.6	54%	0.54	70%	0.7	S	S	.	*	G	3₁₀ helix	trans	-68.8	-15.5	-179.7	-85.4	-25.5	0	0	0	113.6	D179 L183 S184 G185 R669	D179-D181 PolarHBondContact O-N 2.97Å; D181-L183 PolarHBondContact O-N 3.37Å; D181-S184 PolarHBondContact O-N 2.85Å; D181-S184 VanDerWaalsContact O-N 3.09Å; D181-G185 PolarHBondContact O-N 3.24Å; D181-R669 IonicContact OD1-NH1 3.87Å; D181-R669 PolarHBondContact OD1-NH1 3.33Å
182	L	41.3	Very low	32.5	Very low	132 Å²	132	106.9 Å²	106.9	69%	0.691	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-67.5	-14.3	172	-73.7	170.8	0	0	0	113.7	L180	L180-L182 PolarHBondContact O-N 2.99Å
183	L	42.2	Very low	33.2	Very low	79 Å²	79	108.6 Å²	108.6	41%	0.414	68%	0.679	S	S	.	*	G	3₁₀ helix	trans	-81.9	-18.5	172.1	-65.3	-179.9	0	0	0	113.1	L180 D181	L180-L183 HydrophobicContact CD1-CD1 3.69Å; L180-L183 PolarHBondContact O-N 3.45Å; D181-L183 PolarHBondContact O-N 3.37Å
184	S	39.5	Very low	34.1	Very low	68 Å²	68	104.9 Å²	104.9	48%	0.476	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.2	-5.4	-176.2	-70.7	0	0	0	0	114.6	D181	D181-S184 PolarHBondContact O-N 2.85Å; D181-S184 VanDerWaalsContact O-N 3.09Å
185	G	30.7	Very low	35.3	Very low	57 Å²	57	107.1 Å²	107.1	59%	0.588	65%	0.652	S	S	*	*			trans	-120.8	42.4	-172.2	0	0	0	0	0	115.3	D181 S187	D181-G185 PolarHBondContact O-N 3.24Å; G185-S187 VanDerWaalsContact C-N 3.3Å; G185-S187 PolarHBondContact O-N 2.97Å
186	G	31.2	Very low	36.5	Very low	77 Å²	77	103.7 Å²	103.7	79%	0.794	63%	0.627	S	S	*	*			trans	-85.8	53	178.5	0	0	0	0	0	114.3
187	S	32.4	Very low	37.8	Very low	123 Å²	123	103.6 Å²	103.6	86%	0.86	62%	0.616	S	S	*	*			trans	-103.2	34.1	167.3	-157.5	0	0	0	0	111.5	G185 G189	G185-S187 VanDerWaalsContact C-N 3.3Å; G185-S187 PolarHBondContact O-N 2.97Å; S187-G189 VanDerWaalsContact C-N 3.31Å; S187-G189 PolarHBondContact O-N 2.82Å
188	S	32.7	Very low	39.5	Very low	99 Å²	99	104 Å²	104	69%	0.692	62%	0.617	S	S	*	*			trans	-84.7	76.9	166.3	72.8	0	0	0	0	110.1	Y190	S188-Y190 VanDerWaalsContact C-N 3.32Å; S188-Y190 PolarHBondContact O-N 3.2Å
189	G	27.8	Very low	41.6	Very low	73 Å²	73	96.6 Å²	96.6	75%	0.753	58%	0.579	S	S	*	*	S	Bend		55.4	12.7	129.1	0	0	0	0	0	122.4	S187 P191	S187-G189 VanDerWaalsContact C-N 3.31Å; S187-G189 PolarHBondContact O-N 2.82Å; G189-P191 WeakPolarHBondContact O-CD 3.41Å
190	Y	26.4	Very low	43.9	Very low	220 Å²	220	93.4 Å²	93.4	86%	0.863	57%	0.565	S	S	*	*			trans	-90.2	110.4	157.4	-73.7	-78.2	0	0	0	107.3	S188	S188-Y190 VanDerWaalsContact C-N 3.32Å; S188-Y190 PolarHBondContact O-N 3.2Å
191	P	31.3	Very low	46.1	Very low	86 Å²	86	97.5 Å²	97.5	56%	0.558	58%	0.583	S	S	*	*			trans	-57	136.8	171.2	24.2	-29.8	0	0	0	107.5	G189 F193	G189-P191 WeakPolarHBondContact O-CD 3.41Å; P191-F193 PolarHBondContact O-N 2.87Å; P191-F193 VanDerWaalsContact O-N 3.14Å
192	P	36.9	Very low	48.2	Very low	108 Å²	108	99.2 Å²	99.2	70%	0.701	59%	0.59	S	S	*	*			trans	-52.4	127.9	174.1	22.2	-31.1	0	0	0	107.2	H194	P192-H194 PolarHBondContact O-N 3.33Å; P192-H194 VanDerWaalsContact O-N 3.12Å
193	F	41.9	Very low	50.4	Low	114 Å²	114	95.8 Å²	95.8	50%	0.5	57%	0.57	S	S	.	*			trans	-32.6	120.6	-177	-87.6	-98.7	0	0	0	110.4	P191 L195 A367 P368	P191-F193 PolarHBondContact O-N 2.87Å; P191-F193 VanDerWaalsContact O-N 3.14Å; F193-L195 PolarHBondContact O-N 3.08Å; F193-A367 HydrophobicContact CD1-CB 3.79Å; F193-A367 HydrophobicContact CE1-CB 3.72Å; F193-P368 HydrophobicContact CE1-CG 4.07Å; F193-P368 HydrophobicContact CZ-CG 3.66Å
194	H	43.7	Very low	52.7	Low	114 Å²	114	94.4 Å²	94.4	53%	0.528	56%	0.559	S	S	.	*			trans	-49.3	115.1	175.9	-80	-76.3	0	0	0	107.7	P192	P192-H194 PolarHBondContact O-N 3.33Å; P192-H194 VanDerWaalsContact O-N 3.12Å
195	L	49.9	Very low	55.1	Low	116 Å²	116	95 Å²	95	61%	0.607	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-46.8	137.1	168.3	-76.1	157.2	0	0	0	107.7	F193 M197	F193-L195 PolarHBondContact O-N 3.08Å; L195-M197 PolarHBondContact O-N 3.13Å
196	P	52.6	Low	58	Low	40 Å²	40	97.4 Å²	97.4	26%	0.26	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-50.9	121.3	174.4	-22.8	30.9	0	0	0	108.2	V302 L358	P196-V302 HydrophobicContact CB-CG1 4.04Å; P196-V302 HydrophobicContact CG-CG1 4.24Å; P196-L358 HydrophobicContact CB-CD1 4.08Å; P196-L358 HydrophobicContact CG-CD1 4.2Å
197	M	58.9	Low	61	Low	125 Å²	125	94.2 Å²	94.2	62%	0.616	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-50.3	153	174.3	-84.1	-83.3	-56.6	0	0	109.8	L195 V199	L195-M197 PolarHBondContact O-N 3.13Å; M197-V199 PolarHBondContact O-N 3.28Å
198	P	65.2	Low	63.9	Low	107 Å²	107	89.7 Å²	89.7	70%	0.695	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-50.2	130.1	173.6	-23.9	31.8	0	0	0	110.9	S200	P198-S200 PolarHBondContact O-N 3.46Å
199	V	78.5	Confident	66.8	Low	12 Å²	12	90 Å²	90	7%	0.073	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-60.2	133.4	-178.8	179.8	0	0	0	0	109.5	M197 E203 R204 M207 D303 L305 L318	M197-V199 PolarHBondContact O-N 3.28Å; V199-E203 HydrophobicContact CG1-CB 3.79Å; V199-R204 HydrophobicContact CG1-CG 4.08Å; V199-R204 PolarHBondContact O-NH1 3.24Å; V199-R204 PolarHBondContact O-NH2 2.88Å; V199-M207 HydrophobicContact CG1-CE 3.8Å; V199-M207 HydrophobicContact CG1-SD 3.68Å; V199-M207 HydrophobicContact CG2-CE 4.1Å; V199-M207 HydrophobicContact CG2-SD 4.29Å; V199-D303 HydrophobicContact CG2-CB 4.34Å; V199-L305 HydrophobicContact CB-CD2 4.11Å; V199-L305 HydrophobicContact CG1-CD2 4.13Å; V199-L305 HydrophobicContact CG2-CD2 4.03Å; V199-L318 HydrophobicContact CG2-CD2 3.65Å
200	S	83.2	Confident	70	Confident	51 Å²	51	90.2 Å²	90.2	36%	0.357	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-72.8	151.7	178.1	72.8	0	0	0	0	111.5	P198 M202 E203 R204	P198-S200 PolarHBondContact O-N 3.46Å; S200-M202 PolarHBondContact O-N 3.39Å; S200-M202 VanDerWaalsContact O-N 3.12Å; S200-E203 VanDerWaalsContact CB-OE2 3.28Å; S200-E203 WeakPolarHBondContact CB-OE2 3.45Å; S200-E203 PolarHBondContact N-OE2 3.32Å; S200-E203 PolarHBondContact O-N 2.92Å; S200-E203 WeakPolarHBondContact OG-CG 3.36Å; S200-E203 PolarHBondContact OG-N 2.79Å; S200-E203 PolarHBondContact OG-OE2 3.47Å; S200-R204 PolarHBondContact O-N 2.64Å
201	E	82.9	Confident	73.3	Confident	145 Å²	145	79.8 Å²	79.8	68%	0.678	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.9	176.8	-70.2	-60.2	140.8	0	0	113.3	R204 P205	E201-R204 IonicContact OE1-CZ 3.41Å; E201-R204 IonicContact OE1-NH1 3.35Å; E201-R204 PolarHBondContact OE1-NH1 3.16Å; E201-R204 IonicContact OE2-NH1 3.57Å; E201-P205 VanDerWaalsContact O-CD 3.26Å; E201-P205 WeakPolarHBondContact O-CD 3.48Å
202	M	84	Confident	76.4	Confident	138 Å²	138	78.4 Å²	78.4	68%	0.68	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-28.4	177.8	-174.8	173	175.3	0	0	112.6	S200 P205 M206	S200-M202 PolarHBondContact O-N 3.39Å; S200-M202 VanDerWaalsContact O-N 3.12Å; M202-P205 WeakPolarHBondContact O-CD 3.42Å; M202-P205 WeakPolarHBondContact O-CG 3.41Å; M202-M206 HydrophobicContact CE-CE 3.94Å; M202-M206 HydrophobicContact CG-CE 4.34Å
203	E	86.4	Confident	79.2	Confident	59 Å²	59	79.7 Å²	79.7	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-82.4	-30.8	-179.3	-72	162.4	143.8	0	0	112.4	V199 S200 M206 M207	V199-E203 HydrophobicContact CG1-CB 3.79Å; S200-E203 VanDerWaalsContact CB-OE2 3.28Å; S200-E203 WeakPolarHBondContact CB-OE2 3.45Å; S200-E203 PolarHBondContact N-OE2 3.32Å; S200-E203 PolarHBondContact O-N 2.92Å; S200-E203 WeakPolarHBondContact OG-CG 3.36Å; S200-E203 PolarHBondContact OG-N 2.79Å; S200-E203 PolarHBondContact OG-OE2 3.47Å; E203-M206 WeakPolarHBondContact O-CB 3.45Å; E203-M206 PolarHBondContact O-N 2.8Å; E203-M207 HydrophobicContact CB-CE 4.3Å; E203-M207 WeakPolarHBondContact O-CG 3.22Å; E203-M207 PolarHBondContact O-N 2.98Å
204	R	90.3	Very high	81.8	Confident	50 Å²	50	74.4 Å²	74.4	19%	0.189	38%	0.384	C	S	.	.	H	α-helix	trans	-47.4	-51.7	177.7	-69.9	-168.5	168.9	73.9	20.9	113.8	V199 S200 E201 M206 M207 A208 D303 L305	V199-R204 HydrophobicContact CG1-CG 4.08Å; V199-R204 PolarHBondContact O-NH1 3.24Å; V199-R204 PolarHBondContact O-NH2 2.88Å; S200-R204 PolarHBondContact O-N 2.64Å; E201-R204 IonicContact OE1-CZ 3.41Å; E201-R204 IonicContact OE1-NH1 3.35Å; E201-R204 PolarHBondContact OE1-NH1 3.16Å; E201-R204 IonicContact OE2-NH1 3.57Å; R204-M206 PolarHBondContact O-N 3.42Å; R204-M207 PolarHBondContact O-N 2.96Å; R204-A208 WeakPolarHBondContact O-CB 3.3Å; R204-A208 PolarHBondContact O-N 3.49Å; R204-D303 IonicContact CZ-OD2 3.42Å; R204-D303 IonicContact NH2-OD2 2.88Å; R204-D303 PolarHBondContact NH2-OD2 2.96Å; R204-L305 HydrophobicContact CG-CD2 4.3Å
205	P	91	Very high	84.3	Confident	80 Å²	80	69 Å²	69	52%	0.519	36%	0.359	S	S	.	.	H	α-helix	trans	-66.9	-33.7	178.4	25.7	-35	0	0	0	113.2	E201 M202 A208 E209	E201-P205 VanDerWaalsContact O-CD 3.26Å; E201-P205 WeakPolarHBondContact O-CD 3.48Å; M202-P205 WeakPolarHBondContact O-CD 3.42Å; M202-P205 WeakPolarHBondContact O-CG 3.41Å; P205-A208 PolarHBondContact O-N 3.46Å; P205-E209 PolarHBondContact O-N 2.77Å
206	M	91.9	Very high	86.6	Confident	108 Å²	108	67.2 Å²	67.2	53%	0.532	35%	0.35	S	S	.	.	H	α-helix	trans	-67	-42.5	177.2	-60.3	-177.3	-178.4	0	0	111.2	M202 E203 R204 E209 M210	M202-M206 HydrophobicContact CE-CE 3.94Å; M202-M206 HydrophobicContact CG-CE 4.34Å; E203-M206 WeakPolarHBondContact O-CB 3.45Å; E203-M206 PolarHBondContact O-N 2.8Å; R204-M206 PolarHBondContact O-N 3.42Å; M206-E209 PolarHBondContact O-N 3.43Å; M206-M210 WeakPolarHBondContact O-CB 3.3Å; M206-M210 PolarHBondContact O-N 2.94Å
207	M	92.8	Very high	88.7	Confident	11 Å²	11	67 Å²	67	5%	0.054	35%	0.345	C	S	.	.	H	α-helix	trans	-63.4	-41.6	173.7	-72	177.4	178.3	0	0	111.4	V199 E203 R204 E209 M210 A211 L305 L338 V356	V199-M207 HydrophobicContact CG1-CE 3.8Å; V199-M207 HydrophobicContact CG1-SD 3.68Å; V199-M207 HydrophobicContact CG2-CE 4.1Å; V199-M207 HydrophobicContact CG2-SD 4.29Å; E203-M207 HydrophobicContact CB-CE 4.3Å; E203-M207 WeakPolarHBondContact O-CG 3.22Å; E203-M207 PolarHBondContact O-N 2.98Å; R204-M207 PolarHBondContact O-N 2.96Å; M207-E209 PolarHBondContact O-N 2.87Å; M207-M210 PolarHBondContact O-N 3.24Å; M207-A211 WeakPolarHBondContact O-CB 3.45Å; M207-A211 PolarHBondContact O-N 3.45Å; M207-L305 HydrophobicContact CB-CD1 3.88Å; M207-L305 HydrophobicContact CG-CD1 4.38Å; M207-L305 HydrophobicContact SD-CD1 3.58Å; M207-L305 VanDerWaalsContact SD-CD1 3.58Å; M207-L305 HydrophobicContact SD-CD2 4.41Å; M207-L338 HydrophobicContact CB-CD1 3.7Å; M207-L338 HydrophobicContact CB-CD2 4.16Å; M207-L338 HydrophobicContact CG-CD1 4.18Å; M207-L338 HydrophobicContact CG-CD2 4.33Å; M207-L338 VanDerWaalsContact O-CD1 3.24Å; M207-L338 WeakPolarHBondContact O-CD1 3.34Å; M207-L338 HydrophobicContact SD-CD2 4.16Å; M207-V356 HydrophobicContact CE-CG1 4.03Å
208	A	93.5	Very high	90.5	Very high	28 Å²	28	61 Å²	61	23%	0.231	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-40.7	176.2	0	0	0	0	0	112.6	R204 P205 A211 T212 L316	R204-A208 WeakPolarHBondContact O-CB 3.3Å; R204-A208 PolarHBondContact O-N 3.49Å; P205-A208 PolarHBondContact O-N 3.46Å; A208-A211 PolarHBondContact O-N 2.92Å; A208-T212 PolarHBondContact O-N 2.84Å; A208-T212 PolarHBondContact O-OG1 3.46Å; A208-L316 HydrophobicContact CB-CD2 4.03Å
209	E	94.3	Very high	92	Very high	105 Å²	105	57.1 Å²	57.1	49%	0.491	29%	0.289	S	S	.	.	H	α-helix	trans	-64.7	-42.8	174.6	-175.2	176.4	-169.5	0	0	111.8	P205 M206 M207 T212 R213	P205-E209 PolarHBondContact O-N 2.77Å; M206-E209 PolarHBondContact O-N 3.43Å; M207-E209 PolarHBondContact O-N 2.87Å; E209-T212 PolarHBondContact O-N 3.16Å; E209-R213 WeakPolarHBondContact O-CG 3.39Å; E209-R213 PolarHBondContact O-N 2.87Å; E209-R213 VanDerWaalsContact O-N 3.08Å; E209-R213 IonicContact OE1-CZ 2.9Å; E209-R213 IonicContact OE1-NE 2.98Å; E209-R213 IonicContact OE1-NH2 3.75Å; E209-R213 PolarHBondContact OE1-NH2 2.86Å
210	M	94	Very high	92.9	Very high	77 Å²	77	63.1 Å²	63.1	38%	0.379	31%	0.31	S	S	.	.	H	α-helix	trans	-59.4	-47	175.2	-178	-179.7	-69.2	0	0	111.7	M206 M207 T212 R213 A214 L338 I354	M206-M210 WeakPolarHBondContact O-CB 3.3Å; M206-M210 PolarHBondContact O-N 2.94Å; M207-M210 PolarHBondContact O-N 3.24Å; M210-T212 VanDerWaalsContact C-N 3.34Å; M210-T212 PolarHBondContact O-N 2.97Å; M210-R213 PolarHBondContact O-N 3.23Å; M210-A214 WeakPolarHBondContact O-CB 3.33Å; M210-A214 PolarHBondContact O-N 3.49Å; M210-L338 HydrophobicContact SD-CD1 4.48Å; M210-I354 HydrophobicContact CG-CG1 4.11Å; M210-I354 HydrophobicContact CG-CG2 4.26Å; M210-I354 HydrophobicContact SD-CG1 4.23Å
211	A	96.2	Very high	93.5	Very high	2 Å²	2	60.7 Å²	60.7	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-38.9	177.7	0	0	0	0	0	112.8	M207 A208 A214 M215 L316 L338 Y340	M207-A211 WeakPolarHBondContact O-CB 3.45Å; M207-A211 PolarHBondContact O-N 3.45Å; A208-A211 PolarHBondContact O-N 2.92Å; A211-A214 PolarHBondContact O-N 3.01Å; A211-M215 WeakPolarHBondContact O-CB 3.48Å; A211-M215 PolarHBondContact O-N 3Å; A211-L316 HydrophobicContact CB-CD1 3.51Å; A211-L316 HydrophobicContact CB-CD2 4.3Å; A211-L338 HydrophobicContact CB-CD1 4.23Å; A211-Y340 HydrophobicContact CB-CD1 4.21Å; A211-Y340 HydrophobicContact CB-CG 4.16Å
212	T	96	Very high	94.2	Very high	56 Å²	56	54.1 Å²	54.1	34%	0.344	26%	0.264	S	S	.	.	H	α-helix	trans	-64	-44.5	177.1	-55.9	0	0	0	0	111.2	A208 E209 M210 M215 D216	A208-T212 PolarHBondContact O-N 2.84Å; A208-T212 PolarHBondContact O-OG1 3.46Å; E209-T212 PolarHBondContact O-N 3.16Å; M210-T212 VanDerWaalsContact C-N 3.34Å; M210-T212 PolarHBondContact O-N 2.97Å; T212-M215 WeakPolarHBondContact O-CB 3.29Å; T212-M215 PolarHBondContact O-N 3.11Å; T212-D216 PolarHBondContact O-N 3.08Å; T212-D216 VanDerWaalsContact O-N 3.13Å
213	R	95.3	Very high	94.7	Very high	135 Å²	135	53.8 Å²	53.8	51%	0.509	26%	0.261	S	S	.	.	H	α-helix	trans	-63.7	-42.9	176.3	-67.2	173.3	-175.5	-167.4	2.1	111.8	E209 M210 M215 D216 E217	E209-R213 WeakPolarHBondContact O-CG 3.39Å; E209-R213 PolarHBondContact O-N 2.87Å; E209-R213 VanDerWaalsContact O-N 3.08Å; E209-R213 IonicContact OE1-CZ 2.9Å; E209-R213 IonicContact OE1-NE 2.98Å; E209-R213 IonicContact OE1-NH2 3.75Å; E209-R213 PolarHBondContact OE1-NH2 2.86Å; M210-R213 PolarHBondContact O-N 3.23Å; R213-M215 VanDerWaalsContact C-N 3.29Å; R213-M215 PolarHBondContact O-N 2.88Å; R213-D216 PolarHBondContact O-N 2.76Å; R213-E217 WeakPolarHBondContact O-CB 3.2Å; R213-E217 PolarHBondContact O-N 2.85Å
214	A	96.5	Very high	95.1	Very high	3 Å²	3	51.7 Å²	51.7	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-36.3	176.6	0	0	0	0	0	112.3	M210 A211 E217 L218 I354 P376	M210-A214 WeakPolarHBondContact O-CB 3.33Å; M210-A214 PolarHBondContact O-N 3.49Å; A211-A214 PolarHBondContact O-N 3.01Å; A214-E217 PolarHBondContact O-N 2.93Å; A214-L218 VanDerWaalsContact O-CB 3.31Å; A214-L218 WeakPolarHBondContact O-CB 3.36Å; A214-L218 PolarHBondContact O-N 3.44Å; A214-I354 HydrophobicContact CB-CB 3.72Å; A214-I354 HydrophobicContact CB-CG1 4.14Å; A214-I354 HydrophobicContact CB-CG2 3.79Å; A214-P376 HydrophobicContact CB-CB 4.15Å; A214-P376 HydrophobicContact CB-CG 4.02Å
215	M	97.8	Very high	95.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-49.2	174.5	179	64.3	70.9	0	0	112.3	A211 T212 R213 E217 L218 I219 Y340 R342 A350 A352	A211-M215 WeakPolarHBondContact O-CB 3.48Å; A211-M215 PolarHBondContact O-N 3Å; T212-M215 WeakPolarHBondContact O-CB 3.29Å; T212-M215 PolarHBondContact O-N 3.11Å; R213-M215 VanDerWaalsContact C-N 3.29Å; R213-M215 PolarHBondContact O-N 2.88Å; M215-E217 VanDerWaalsContact C-N 3.28Å; M215-E217 PolarHBondContact O-N 2.98Å; M215-L218 PolarHBondContact O-N 2.85Å; M215-I219 HydrophobicContact CG-CD1 4.02Å; M215-I219 VanDerWaalsContact O-CG1 3.29Å; M215-I219 WeakPolarHBondContact O-CG1 3.19Å; M215-I219 PolarHBondContact O-N 2.81Å; M215-I219 HydrophobicContact SD-CD1 4.09Å; M215-I219 HydrophobicContact SD-CG1 4.39Å; M215-Y340 HydrophobicContact CB-CD1 3.79Å; M215-Y340 HydrophobicContact CB-CE1 3.9Å; M215-Y340 HydrophobicContact CE-CD1 3.52Å; M215-Y340 HydrophobicContact CE-CE1 3.94Å; M215-Y340 HydrophobicContact CE-CG 4.04Å; M215-Y340 WeakPolarHBondContact CE-O 3.36Å; M215-Y340 HydrophobicContact CG-CD1 4.22Å; M215-Y340 HydrophobicContact CG-CE1 4.05Å; M215-R342 HydrophobicContact CE-CB 3.78Å; M215-R342 HydrophobicContact SD-CB 4.36Å; M215-A350 HydrophobicContact CE-CB 4.15Å; M215-A350 HydrophobicContact SD-CB 3.4Å; M215-A350 WeakPolarHBondContact SD-CB 3.33Å; M215-A352 HydrophobicContact CB-CB 4.15Å; M215-A352 HydrophobicContact CE-CB 3.72Å; M215-A352 HydrophobicContact SD-CB 4.02Å
216	D	96.6	Very high	95	Very high	79 Å²	79	53.7 Å²	53.7	42%	0.422	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-38.5	178.8	-68.7	-25.6	0	0	0	111.4	T212 R213 R220	T212-D216 PolarHBondContact O-N 3.08Å; T212-D216 VanDerWaalsContact O-N 3.13Å; R213-D216 PolarHBondContact O-N 2.76Å; D216-R220 WeakPolarHBondContact O-CG 3.34Å; D216-R220 PolarHBondContact O-N 3.35Å
217	E	96.3	Very high	95	Very high	35 Å²	35	54.3 Å²	54.3	16%	0.164	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-49.5	175.1	-175.2	168.5	139.6	0	0	112.3	R213 A214 M215 I219 R220 M221 Y243 F247 P376	R213-E217 WeakPolarHBondContact O-CB 3.2Å; R213-E217 PolarHBondContact O-N 2.85Å; A214-E217 PolarHBondContact O-N 2.93Å; M215-E217 VanDerWaalsContact C-N 3.28Å; M215-E217 PolarHBondContact O-N 2.98Å; E217-I219 VanDerWaalsContact C-N 3.33Å; E217-I219 PolarHBondContact O-N 3.07Å; E217-R220 WeakPolarHBondContact O-CB 3.27Å; E217-R220 PolarHBondContact O-N 3.04Å; E217-R220 VanDerWaalsContact O-N 3.15Å; E217-M221 HydrophobicContact CG-CG 4.41Å; E217-M221 HydrophobicContact CG-SD 4.12Å; E217-M221 WeakPolarHBondContact O-CG 3.18Å; E217-M221 PolarHBondContact O-N 2.86Å; E217-Y243 WeakPolarHBondContact OE1-CE2 3.4Å; E217-Y243 PolarHBondContact OE1-OH 2.94Å; E217-F247 HydrophobicContact CB-CE1 4.4Å; E217-F247 HydrophobicContact CG-CD1 3.64Å; E217-F247 HydrophobicContact CG-CE1 3.66Å; E217-F247 HydrophobicContact CG-CG 4.29Å; E217-F247 HydrophobicContact CG-CZ 4.31Å; E217-P376 HydrophobicContact CB-CB 4.2Å; E217-P376 HydrophobicContact CB-CG 4.46Å; E217-P376 HydrophobicContact CG-CB 4.06Å; E217-P376 HydrophobicContact CG-CG 4.26Å; E217-P376 VanDerWaalsContact OE1-CG 3.3Å; E217-P376 WeakPolarHBondContact OE1-CG 3.44Å
218	L	97.8	Very high	95.1	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.2	-46.4	176.9	174.4	67.7	0	0	0	111.7	A214 M215 R220 M221 A222 I351 A352 V394	A214-L218 VanDerWaalsContact O-CB 3.31Å; A214-L218 WeakPolarHBondContact O-CB 3.36Å; A214-L218 PolarHBondContact O-N 3.44Å; M215-L218 PolarHBondContact O-N 2.85Å; L218-R220 VanDerWaalsContact C-N 3.3Å; L218-R220 PolarHBondContact O-N 3.1Å; L218-M221 PolarHBondContact O-N 3.28Å; L218-A222 VanDerWaalsContact O-CB 3.3Å; L218-A222 WeakPolarHBondContact O-CB 3.31Å; L218-A222 PolarHBondContact O-N 3.41Å; L218-I351 WeakPolarHBondContact CD2-O 3.34Å; L218-A352 HydrophobicContact CB-CB 4.35Å; L218-A352 HydrophobicContact CD2-CB 3.65Å; L218-V394 HydrophobicContact CD1-CB 3.72Å; L218-V394 HydrophobicContact CD1-CG1 4.18Å; L218-V394 HydrophobicContact CD1-CG2 4.13Å
219	I	97.3	Very high	95.2	Very high	25 Å²	25	52.7 Å²	52.7	13%	0.128	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-44.7	179.4	-68.5	164.4	0	0	0	110	M215 E217 A222 Q223 I344 A350 L380	M215-I219 HydrophobicContact CG-CD1 4.02Å; M215-I219 VanDerWaalsContact O-CG1 3.29Å; M215-I219 WeakPolarHBondContact O-CG1 3.19Å; M215-I219 PolarHBondContact O-N 2.81Å; M215-I219 HydrophobicContact SD-CD1 4.09Å; M215-I219 HydrophobicContact SD-CG1 4.39Å; E217-I219 VanDerWaalsContact C-N 3.33Å; E217-I219 PolarHBondContact O-N 3.07Å; I219-A222 PolarHBondContact O-N 2.92Å; I219-Q223 WeakPolarHBondContact O-CB 3.42Å; I219-Q223 VanDerWaalsContact O-CG 3.31Å; I219-Q223 WeakPolarHBondContact O-CG 3.39Å; I219-Q223 PolarHBondContact O-N 2.92Å; I219-Q223 VanDerWaalsContact O-N 3.08Å; I219-I344 HydrophobicContact CD1-CD1 3.71Å; I219-I344 HydrophobicContact CD1-CG1 4.32Å; I219-I344 HydrophobicContact CG1-CD1 4.02Å; I219-A350 HydrophobicContact CG1-CB 4.45Å; I219-L380 HydrophobicContact CG1-CD2 4.02Å
220	R	96.5	Very high	95.2	Very high	138 Å²	138	51 Å²	51	52%	0.521	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-43	177.1	-71.6	176.4	65.5	-166.1	-4.1	112	D216 E217 L218 Q223 A224 F247	D216-R220 WeakPolarHBondContact O-CG 3.34Å; D216-R220 PolarHBondContact O-N 3.35Å; E217-R220 WeakPolarHBondContact O-CB 3.27Å; E217-R220 PolarHBondContact O-N 3.04Å; E217-R220 VanDerWaalsContact O-N 3.15Å; L218-R220 VanDerWaalsContact C-N 3.3Å; L218-R220 PolarHBondContact O-N 3.1Å; R220-Q223 PolarHBondContact O-N 3.25Å; R220-A224 WeakPolarHBondContact O-CB 3.14Å; R220-A224 PolarHBondContact O-N 2.92Å; R220-F247 HydrophobicContact CB-CE1 4.28Å; R220-F247 HydrophobicContact CB-CZ 4.13Å
221	M	96.8	Very high	95	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-46.3	177.1	-72.3	-178.5	72.3	0	0	111.6	E217 L218 Q223 A224 L228 W229 L238 Y243 F247 V394 H396	E217-M221 HydrophobicContact CG-CG 4.41Å; E217-M221 HydrophobicContact CG-SD 4.12Å; E217-M221 WeakPolarHBondContact O-CG 3.18Å; E217-M221 PolarHBondContact O-N 2.86Å; L218-M221 PolarHBondContact O-N 3.28Å; M221-Q223 VanDerWaalsContact C-N 3.28Å; M221-Q223 PolarHBondContact O-N 3.2Å; M221-A224 WeakPolarHBondContact O-CB 3.33Å; M221-A224 PolarHBondContact O-N 3.45Å; M221-L228 HydrophobicContact CB-CD2 4.35Å; M221-L228 HydrophobicContact CG-CD2 4.13Å; M221-W229 HydrophobicContact CB-CZ2 4.22Å; M221-W229 HydrophobicContact CE-CH2 4.01Å; M221-W229 HydrophobicContact CE-CZ2 4.06Å; M221-W229 PolarHBondContact O-NE1 2.69Å; M221-L238 HydrophobicContact CE-CD1 4.14Å; M221-L238 HydrophobicContact CE-CD2 4.38Å; M221-Y243 HydrophobicContact CE-CD2 4.2Å; M221-Y243 HydrophobicContact CE-CE2 4.24Å; M221-Y243 HydrophobicContact SD-CD2 4.35Å; M221-Y243 HydrophobicContact SD-CE2 3.97Å; M221-F247 HydrophobicContact CG-CE2 4.1Å; M221-F247 HydrophobicContact CG-CZ 3.99Å; M221-V394 HydrophobicContact CE-CG1 3.99Å; M221-H396 HydrophobicContact CE-CB 4.35Å
222	A	96.4	Very high	94.3	Very high	8 Å²	8	55.9 Å²	55.9	7%	0.066	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-34.6	179.7	0	0	0	0	0	112.3	L218 I219 R266 L380 T392 V394	L218-A222 VanDerWaalsContact O-CB 3.3Å; L218-A222 WeakPolarHBondContact O-CB 3.31Å; L218-A222 PolarHBondContact O-N 3.41Å; I219-A222 PolarHBondContact O-N 2.92Å; A222-R266 PolarHBondContact O-NH1 2.66Å; A222-L380 HydrophobicContact CB-CD1 3.46Å; A222-L380 VanDerWaalsContact CB-CD1 3.46Å; A222-L380 HydrophobicContact CB-CG 3.77Å; A222-T392 HydrophobicContact CB-CG2 4.01Å; A222-V394 HydrophobicContact CB-CG2 4.07Å
223	Q	95.2	Very high	93.2	Very high	131 Å²	131	57 Å²	57	61%	0.612	30%	0.303	S	S	*	.	H	α-helix	trans	-89.7	-7.9	178.8	-65.8	175.5	-8.1	0	0	114.4	I219 R220 M221 L380	I219-Q223 WeakPolarHBondContact O-CB 3.42Å; I219-Q223 VanDerWaalsContact O-CG 3.31Å; I219-Q223 WeakPolarHBondContact O-CG 3.39Å; I219-Q223 PolarHBondContact O-N 2.92Å; I219-Q223 VanDerWaalsContact O-N 3.08Å; R220-Q223 PolarHBondContact O-N 3.25Å; M221-Q223 VanDerWaalsContact C-N 3.28Å; M221-Q223 PolarHBondContact O-N 3.2Å; Q223-L380 HydrophobicContact CG-CD1 4.3Å
224	A	94.3	Very high	92.5	Very high	14 Å²	14	54.5 Å²	54.5	12%	0.116	32%	0.319	C	S	.	.			trans	-65.3	156.7	-177.9	0	0	0	0	0	112.8	R220 M221 L228 R266	R220-A224 WeakPolarHBondContact O-CB 3.14Å; R220-A224 PolarHBondContact O-N 2.92Å; M221-A224 WeakPolarHBondContact O-CB 3.33Å; M221-A224 PolarHBondContact O-N 3.45Å; A224-L228 HydrophobicContact CB-CB 3.81Å; A224-L228 HydrophobicContact CB-CD2 3.56Å; A224-L228 HydrophobicContact CB-CG 4.32Å; A224-R266 PolarHBondContact O-NH1 2.98Å; A224-R266 PolarHBondContact O-NH2 3.17Å
225	G	91.2	Very high	92	Very high	33 Å²	33	58.1 Å²	58.1	34%	0.34	33%	0.332	S	S	.	.			trans	-95.6	-159.8	179	0	0	0	0	0	113.4	H227 L228 W229	G225-H227 PolarHBondContact N-CE1 3.41Å; G225-H227 PolarHBondContact O-N 2.67Å; G225-H227 VanDerWaalsContact O-N 3.08Å; G225-L228 PolarHBondContact O-N 2.59Å; G225-L228 VanDerWaalsContact O-N 3.17Å; G225-W229 PolarHBondContact O-N 2.97Å
226	E	88.3	Confident	91.7	Very high	139 Å²	139	60 Å²	60	65%	0.65	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-11	-177.5	-57.7	-171.2	149.3	0	0	114.3	W229 K231	E226-W229 WeakPolarHBondContact CA-O 3.46Å; E226-K231 IonicContact OE1-NZ 2.69Å; E226-K231 PolarHBondContact OE1-NZ 2.92Å
227	H	91.2	Very high	91.6	Very high	122 Å²	122	59 Å²	59	57%	0.565	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-37.7	173.7	60.5	-90.6	0	0	0	111.9	G225 T242	G225-H227 PolarHBondContact N-CE1 3.41Å; G225-H227 PolarHBondContact O-N 2.67Å; G225-H227 VanDerWaalsContact O-N 3.08Å; H227-T242 WeakPolarHBondContact O-CG2 3.41Å
228	L	95.5	Very high	91.6	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.016	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-32.6	179.3	-172.4	63.2	0	0	0	111.5	M221 A224 G225 L238 N239 T242 F247	M221-L228 HydrophobicContact CB-CD2 4.35Å; M221-L228 HydrophobicContact CG-CD2 4.13Å; A224-L228 HydrophobicContact CB-CB 3.81Å; A224-L228 HydrophobicContact CB-CD2 3.56Å; A224-L228 HydrophobicContact CB-CG 4.32Å; G225-L228 PolarHBondContact O-N 2.59Å; G225-L228 VanDerWaalsContact O-N 3.17Å; L228-L238 HydrophobicContact CD1-CD1 3.69Å; L228-L238 HydrophobicContact CD2-CD1 4.34Å; L228-L238 HydrophobicContact CG-CD1 3.74Å; L228-N239 WeakPolarHBondContact O-CB 3.34Å; L228-N239 PolarHBondContact O-N 2.64Å; L228-T242 HydrophobicContact CD1-CG2 4.41Å; L228-F247 HydrophobicContact CD2-CE2 4.37Å
229	W	96.1	Very high	91.4	Very high	1 Å²	1	60.1 Å²	60.1	0%	0.004	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	113.9	-172.3	-61	108.2	0	0	0	111.6	M221 G225 E226 E236 L238 R266 V394	M221-W229 HydrophobicContact CB-CZ2 4.22Å; M221-W229 HydrophobicContact CE-CH2 4.01Å; M221-W229 HydrophobicContact CE-CZ2 4.06Å; M221-W229 PolarHBondContact O-NE1 2.69Å; G225-W229 PolarHBondContact O-N 2.97Å; E226-W229 WeakPolarHBondContact CA-O 3.46Å; W229-E236 HydrophobicContact CB-CB 4.23Å; W229-L238 HydrophobicContact CE3-CB 4.26Å; W229-L238 HydrophobicContact CE3-CD1 4.28Å; W229-L238 HydrophobicContact CH2-CB 4.4Å; W229-L238 HydrophobicContact CH2-CD1 3.92Å; W229-L238 HydrophobicContact CZ2-CD1 4.33Å; W229-L238 HydrophobicContact CZ3-CB 3.73Å; W229-L238 HydrophobicContact CZ3-CD1 3.9Å; W229-L238 HydrophobicContact CZ3-CG 4.42Å; W229-R266 HydrophobicContact CD2-CB 3.9Å; W229-R266 HydrophobicContact CE3-CB 3.84Å; W229-R266 HydrophobicContact CH2-CB 3.86Å; W229-R266 HydrophobicContact CZ2-CB 3.88Å; W229-R266 HydrophobicContact CZ2-CG 4.46Å; W229-R266 HydrophobicContact CZ3-CB 3.83Å; W229-V394 HydrophobicContact CH2-CG1 3.94Å; W229-V394 HydrophobicContact CZ2-CG1 4.16Å; W229-V394 HydrophobicContact CZ2-CG2 4.34Å
230	V	93.6	Very high	91.2	Very high	71 Å²	71	60.7 Å²	60.7	43%	0.43	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.3	178.4	-179.9	0	0	0	0	109.5	A232 V237 N239	V230-A232 PolarHBondContact O-N 3.31Å; V230-V237 PolarHBondContact N-O 3.18Å; V230-V237 PolarHBondContact O-N 2.91Å; V230-N239 HydrophobicContact CG2-CB 4.08Å
231	K	89.3	Confident	91	Very high	132 Å²	132	60.5 Å²	60.5	57%	0.574	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	110.7	176.4	-70.2	174.9	-177.6	153.8	0	110.5	E226 R235 E236	E226-K231 IonicContact OE1-NZ 2.69Å; E226-K231 PolarHBondContact OE1-NZ 2.92Å; K231-R235 CarbonylContact C-O 3.58Å; K231-R235 WeakPolarHBondContact CA-O 3.5Å; K231-E236 HydrophobicContact CG-CG 4.34Å
232	A	81.5	Confident	90.7	Very high	48 Å²	48	62.2 Å²	62.2	40%	0.397	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.8	175.5	0	0	0	0	0	110.2	V230 G234 R235 V237	V230-A232 PolarHBondContact O-N 3.31Å; A232-G234 VanDerWaalsContact C-N 3.27Å; A232-G234 PolarHBondContact O-N 3.17Å; A232-R235 PolarHBondContact N-O 2.59Å; A232-R235 PolarHBondContact O-N 3.14Å; A232-R235 VanDerWaalsContact O-N 3.07Å; A232-V237 HydrophobicContact CB-CG2 4.15Å
233	G	74.4	Confident	90.6	Very high	80 Å²	80	62.8 Å²	62.8	83%	0.825	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	36.6	179.9	0	0	0	0	0	113.9	R235	G233-R235 VanDerWaalsContact C-N 3.28Å; G233-R235 PolarHBondContact O-N 3.38Å
234	G	79.5	Confident	90.4	Very high	82 Å²	82	58.2 Å²	58.2	85%	0.845	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	-0.4	-177.8	0	0	0	0	0	115.4	A232	A232-G234 VanDerWaalsContact C-N 3.27Å; A232-G234 PolarHBondContact O-N 3.17Å
235	R	86	Confident	90.2	Very high	79 Å²	79	62.1 Å²	62.1	30%	0.298	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	148.6	-179.4	-64.2	175.2	-71.4	176.3	1.9	111.2	K231 A232 G233 A417	K231-R235 CarbonylContact C-O 3.58Å; K231-R235 WeakPolarHBondContact CA-O 3.5Å; A232-R235 PolarHBondContact N-O 2.59Å; A232-R235 PolarHBondContact O-N 3.14Å; A232-R235 VanDerWaalsContact O-N 3.07Å; G233-R235 VanDerWaalsContact C-N 3.28Å; G233-R235 PolarHBondContact O-N 3.38Å; R235-A417 VanDerWaalsContact NH1-CB 3.27Å
236	E	93	Very high	90.1	Very high	40 Å²	40	63.5 Å²	63.5	19%	0.187	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.8	174.4	-65.2	-171.7	139.7	0	0	110.5	W229 K231 S265 R266	W229-E236 HydrophobicContact CB-CB 4.23Å; K231-E236 HydrophobicContact CG-CG 4.34Å; E236-S265 VanDerWaalsContact O-CA 3.26Å; E236-S265 WeakPolarHBondContact O-CA 3.44Å; E236-S265 WeakPolarHBondContact O-CB 3.48Å; E236-R266 HydrophobicContact CB-CB 4.3Å; E236-R266 VanDerWaalsContact CD-NH2 3.25Å; E236-R266 PolarHBondContact O-N 2.85Å; E236-R266 IonicContact OE1-CZ 3.91Å; E236-R266 IonicContact OE1-NH2 3.2Å; E236-R266 PolarHBondContact OE1-NH2 2.86Å; E236-R266 IonicContact OE2-CZ 3.71Å; E236-R266 IonicContact OE2-NE 2.74Å; E236-R266 PolarHBondContact OE2-NE 2.93Å; E236-R266 IonicContact OE2-NH2 3.97Å; E236-R266 PolarHBondContact OE2-NH2 3.45Å
237	V	94.6	Very high	90.2	Very high	57 Å²	57	58.6 Å²	58.6	35%	0.345	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	141.2	-179.5	-177.9	0	0	0	0	109.2	V230 A232 N239 G264	V230-V237 PolarHBondContact N-O 3.18Å; V230-V237 PolarHBondContact O-N 2.91Å; A232-V237 HydrophobicContact CB-CG2 4.15Å; V237-N239 PolarHBondContact O-N 2.83Å; V237-G264 WeakPolarHBondContact CA-O 3.23Å
238	L	95.2	Very high	89.6	Confident	10 Å²	10	55.4 Å²	55.4	5%	0.052	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	129	-178	-174.5	64.7	0	0	0	111.4	M221 L228 W229 V240 Y243 V262 G264 H396	M221-L238 HydrophobicContact CE-CD1 4.14Å; M221-L238 HydrophobicContact CE-CD2 4.38Å; L228-L238 HydrophobicContact CD1-CD1 3.69Å; L228-L238 HydrophobicContact CD2-CD1 4.34Å; L228-L238 HydrophobicContact CG-CD1 3.74Å; W229-L238 HydrophobicContact CE3-CB 4.26Å; W229-L238 HydrophobicContact CE3-CD1 4.28Å; W229-L238 HydrophobicContact CH2-CB 4.4Å; W229-L238 HydrophobicContact CH2-CD1 3.92Å; W229-L238 HydrophobicContact CZ2-CD1 4.33Å; W229-L238 HydrophobicContact CZ3-CB 3.73Å; W229-L238 HydrophobicContact CZ3-CD1 3.9Å; W229-L238 HydrophobicContact CZ3-CG 4.42Å; L238-V240 PolarHBondContact O-N 2.96Å; L238-Y243 HydrophobicContact CD1-CD2 4.45Å; L238-Y243 HydrophobicContact CD1-CG 4.49Å; L238-Y243 HydrophobicContact CD2-CD2 4.34Å; L238-Y243 HydrophobicContact CD2-CG 4.12Å; L238-V262 HydrophobicContact CD2-CG1 4.41Å; L238-G264 PolarHBondContact N-O 3.28Å; L238-H396 WeakPolarHBondContact CD2-NE2 3.47Å
239	N	94.7	Very high	88.6	Confident	49 Å²	49	62.2 Å²	62.2	26%	0.262	38%	0.379	S	S	.	.			trans	-78.8	99.2	163.9	-174.3	-42.1	0	0	0	108.8	L228 V230 V237 D241 T242 Y243	L228-N239 WeakPolarHBondContact O-CB 3.34Å; L228-N239 PolarHBondContact O-N 2.64Å; V230-N239 HydrophobicContact CG2-CB 4.08Å; V237-N239 PolarHBondContact O-N 2.83Å; N239-D241 VanDerWaalsContact C-N 3.33Å; N239-D241 PolarHBondContact O-N 3.43Å; N239-D241 PolarHBondContact OD1-N 3.47Å; N239-T242 PolarHBondContact ND2-OG1 3.49Å; N239-T242 PolarHBondContact O-N 2.89Å; N239-T242 PolarHBondContact OD1-N 3.03Å; N239-T242 PolarHBondContact OD1-OG1 2.89Å; N239-T242 VanDerWaalsContact OD1-OG1 3.1Å; N239-Y243 WeakPolarHBondContact O-CB 3.44Å; N239-Y243 PolarHBondContact O-N 3.38Å
240	V	91.9	Very high	86.7	Confident	38 Å²	38	68.8 Å²	68.8	23%	0.23	42%	0.421	C	S	.	.	H	α-helix	trans	-59.9	-41.2	-175.7	179.7	0	0	0	0	112	L238 T242 Y243 D244 V262	L238-V240 PolarHBondContact O-N 2.96Å; V240-T242 VanDerWaalsContact C-N 3.34Å; V240-T242 PolarHBondContact O-N 2.94Å; V240-Y243 PolarHBondContact O-N 3.42Å; V240-D244 WeakPolarHBondContact O-CB 3.3Å; V240-D244 PolarHBondContact O-N 3.36Å; V240-V262 HydrophobicContact CG2-CB 4.36Å; V240-V262 HydrophobicContact CG2-CG1 4.19Å
241	D	91.6	Very high	84.9	Confident	134 Å²	134	69.7 Å²	69.7	72%	0.717	45%	0.445	S	S	*	.	H	α-helix	trans	-63.8	-42	179.5	-62.5	-38	0	0	0	111.4	N239 S245	N239-D241 VanDerWaalsContact C-N 3.33Å; N239-D241 PolarHBondContact O-N 3.43Å; N239-D241 PolarHBondContact OD1-N 3.47Å; D241-S245 WeakPolarHBondContact O-CB 3.5Å; D241-S245 PolarHBondContact O-N 3.48Å
242	T	92.4	Very high	83.4	Confident	35 Å²	35	66.1 Å²	66.1	22%	0.215	44%	0.44	C	S	.	.	H	α-helix	trans	-68.8	-42.1	177.2	-56.7	0	0	0	0	110.7	H227 L228 N239 V240 S245 V246	H227-T242 WeakPolarHBondContact O-CG2 3.41Å; L228-T242 HydrophobicContact CD1-CG2 4.41Å; N239-T242 PolarHBondContact ND2-OG1 3.49Å; N239-T242 PolarHBondContact O-N 2.89Å; N239-T242 PolarHBondContact OD1-N 3.03Å; N239-T242 PolarHBondContact OD1-OG1 2.89Å; N239-T242 VanDerWaalsContact OD1-OG1 3.1Å; V240-T242 VanDerWaalsContact C-N 3.34Å; V240-T242 PolarHBondContact O-N 2.94Å; T242-S245 PolarHBondContact O-N 3.23Å; T242-S245 PolarHBondContact O-OG 3.34Å; T242-V246 HydrophobicContact CG2-CG2 4.41Å; T242-V246 VanDerWaalsContact O-CG2 3.29Å; T242-V246 WeakPolarHBondContact O-CG2 3.48Å; T242-V246 PolarHBondContact O-N 3.36Å; T242-V246 VanDerWaalsContact O-N 3.1Å
243	Y	93.7	Very high	82	Confident	21 Å²	21	68.3 Å²	68.3	8%	0.082	46%	0.458	C	S	.	.	H	α-helix	trans	-57.6	-52.4	174.9	168.4	-92.9	0	0	0	111.3	E217 M221 L238 N239 V240 S245 V246 F247 H396	E217-Y243 WeakPolarHBondContact OE1-CE2 3.4Å; E217-Y243 PolarHBondContact OE1-OH 2.94Å; M221-Y243 HydrophobicContact CE-CD2 4.2Å; M221-Y243 HydrophobicContact CE-CE2 4.24Å; M221-Y243 HydrophobicContact SD-CD2 4.35Å; M221-Y243 HydrophobicContact SD-CE2 3.97Å; L238-Y243 HydrophobicContact CD1-CD2 4.45Å; L238-Y243 HydrophobicContact CD1-CG 4.49Å; L238-Y243 HydrophobicContact CD2-CD2 4.34Å; L238-Y243 HydrophobicContact CD2-CG 4.12Å; N239-Y243 WeakPolarHBondContact O-CB 3.44Å; N239-Y243 PolarHBondContact O-N 3.38Å; V240-Y243 PolarHBondContact O-N 3.42Å; Y243-S245 VanDerWaalsContact C-N 3.25Å; Y243-S245 PolarHBondContact O-N 2.99Å; Y243-V246 PolarHBondContact O-N 3.09Å; Y243-F247 HydrophobicContact CD2-CB 4.48Å; Y243-F247 AromaticContact CD2-CD2 3.39Å; Y243-F247 HydrophobicContact CD2-CD2 3.39Å; Y243-F247 AromaticContact CD2-CE2 3.92Å; Y243-F247 HydrophobicContact CD2-CE2 3.92Å; Y243-F247 HydrophobicContact CD2-CG 4.23Å; Y243-F247 HydrophobicContact CE2-CB 4Å; Y243-F247 AromaticContact CE2-CD2 3.52Å; Y243-F247 HydrophobicContact CE2-CD2 3.52Å; Y243-F247 HydrophobicContact CE2-CE2 4.21Å; Y243-F247 AromaticContact CE2-CG 3.92Å; Y243-F247 HydrophobicContact CE2-CG 3.92Å; Y243-F247 HydrophobicContact CG-CD2 4.2Å; Y243-F247 WeakPolarHBondContact O-CD2 3.36Å; Y243-F247 PolarHBondContact O-N 3.44Å; Y243-H396 AromaticContact CE1-CE1 3.74Å; Y243-H396 AromaticContact CE2-CE1 3.54Å; Y243-H396 AromaticContact CZ-CE1 3.33Å; Y243-H396 PolarHBondContact OH-CE1 3.37Å
244	D	90.8	Very high	81.4	Confident	34 Å²	34	67.6 Å²	67.6	18%	0.182	44%	0.441	C	S	.	.	H	α-helix	trans	-60.1	-38.7	179.4	-76.7	-5.1	0	0	0	110.1	V240 V246 A248 S254 R256	V240-D244 WeakPolarHBondContact O-CB 3.3Å; V240-D244 PolarHBondContact O-N 3.36Å; D244-V246 VanDerWaalsContact C-N 3.31Å; D244-V246 PolarHBondContact O-N 3.08Å; D244-A248 WeakPolarHBondContact O-CB 3.26Å; D244-A248 PolarHBondContact O-N 3.38Å; D244-S254 PolarHBondContact OD2-OG 3.27Å; D244-R256 IonicContact OD1-NH2 3.26Å; D244-R256 PolarHBondContact OD1-NH2 3.3Å; D244-R256 VanDerWaalsContact OD1-NH2 3.1Å; D244-R256 IonicContact OD2-NH2 2.68Å
245	S	90	Very high	80.7	Confident	97 Å²	97	72.3 Å²	72.3	68%	0.678	44%	0.438	S	S	*	.	H	α-helix	trans	-64.6	-30.2	176.4	79.9	0	0	0	0	114.5	D241 T242 Y243	D241-S245 WeakPolarHBondContact O-CB 3.5Å; D241-S245 PolarHBondContact O-N 3.48Å; T242-S245 PolarHBondContact O-N 3.23Å; T242-S245 PolarHBondContact O-OG 3.34Å; Y243-S245 VanDerWaalsContact C-N 3.25Å; Y243-S245 PolarHBondContact O-N 2.99Å
246	V	89.4	Confident	80.2	Confident	62 Å²	62	71.2 Å²	71.2	38%	0.376	43%	0.434	S	S	.	.	H	α-helix	trans	-92.3	-33.9	-174.6	173.6	0	0	0	0	112.1	T242 Y243 D244	T242-V246 HydrophobicContact CG2-CG2 4.41Å; T242-V246 VanDerWaalsContact O-CG2 3.29Å; T242-V246 WeakPolarHBondContact O-CG2 3.48Å; T242-V246 PolarHBondContact O-N 3.36Å; T242-V246 VanDerWaalsContact O-N 3.1Å; Y243-V246 PolarHBondContact O-N 3.09Å; D244-V246 VanDerWaalsContact C-N 3.31Å; D244-V246 PolarHBondContact O-N 3.08Å
247	F	89.2	Confident	79.4	Confident	35 Å²	35	70.7 Å²	70.7	15%	0.154	44%	0.439	C	S	.	.	H	α-helix	trans	-115.8	-9.9	-170.3	-62.5	-78.2	0	0	0	114.3	E217 R220 M221 L228 Y243 K249	E217-F247 HydrophobicContact CB-CE1 4.4Å; E217-F247 HydrophobicContact CG-CD1 3.64Å; E217-F247 HydrophobicContact CG-CE1 3.66Å; E217-F247 HydrophobicContact CG-CG 4.29Å; E217-F247 HydrophobicContact CG-CZ 4.31Å; R220-F247 HydrophobicContact CB-CE1 4.28Å; R220-F247 HydrophobicContact CB-CZ 4.13Å; M221-F247 HydrophobicContact CG-CE2 4.1Å; M221-F247 HydrophobicContact CG-CZ 3.99Å; L228-F247 HydrophobicContact CD2-CE2 4.37Å; Y243-F247 HydrophobicContact CD2-CB 4.48Å; Y243-F247 AromaticContact CD2-CD2 3.39Å; Y243-F247 HydrophobicContact CD2-CD2 3.39Å; Y243-F247 AromaticContact CD2-CE2 3.92Å; Y243-F247 HydrophobicContact CD2-CE2 3.92Å; Y243-F247 HydrophobicContact CD2-CG 4.23Å; Y243-F247 HydrophobicContact CE2-CB 4Å; Y243-F247 AromaticContact CE2-CD2 3.52Å; Y243-F247 HydrophobicContact CE2-CD2 3.52Å; Y243-F247 HydrophobicContact CE2-CE2 4.21Å; Y243-F247 AromaticContact CE2-CG 3.92Å; Y243-F247 HydrophobicContact CE2-CG 3.92Å; Y243-F247 HydrophobicContact CG-CD2 4.2Å; Y243-F247 WeakPolarHBondContact O-CD2 3.36Å; Y243-F247 PolarHBondContact O-N 3.44Å; F247-K249 PolarHBondContact O-N 2.71Å
248	A	80.1	Confident	78.7	Confident	56 Å²	56	74.1 Å²	74.1	46%	0.463	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-59.9	138.4	176.6	0	0	0	0	0	112	D244	D244-A248 WeakPolarHBondContact O-CB 3.26Å; D244-A248 PolarHBondContact O-N 3.38Å
249	K	72.9	Confident	78.1	Confident	146 Å²	146	78 Å²	78	64%	0.635	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-66.7	137.8	172.6	-70.5	177	-176.3	166.8	0	109.6	F247 G251 A252	F247-K249 PolarHBondContact O-N 2.71Å; K249-G251 PolarHBondContact O-N 3.3Å; K249-G251 VanDerWaalsContact O-N 3.1Å; K249-A252 HydrophobicContact CB-CB 4.08Å; K249-A252 PolarHBondContact O-N 2.9Å
250	P	57.2	Low	77.8	Confident	139 Å²	139	77 Å²	77	90%	0.903	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	119.5	173.7	-22.7	31.6	0	0	0	110.9
251	G	56.6	Low	77.6	Confident	89 Å²	89	77.7 Å²	77.7	92%	0.918	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-2.9	178.6	0	0	0	0	0	116.2	K249 A253	K249-G251 PolarHBondContact O-N 3.3Å; K249-G251 VanDerWaalsContact O-N 3.1Å; G251-A253 PolarHBondContact O-N 3.28Å
252	A	57.5	Low	77.6	Confident	58 Å²	58	72.3 Å²	72.3	48%	0.479	45%	0.451	S	S	.	.			trans	-86	108	167.9	0	0	0	0	0	108.9	K249 S254	K249-A252 HydrophobicContact CB-CB 4.08Å; K249-A252 PolarHBondContact O-N 2.9Å; A252-S254 PolarHBondContact O-N 2.87Å
253	A	52.2	Low	77.6	Confident	93 Å²	93	71.9 Å²	71.9	77%	0.769	45%	0.447	S	S	*	.			trans	-65	121.8	162.2	0	0	0	0	0	107.4	G251 F255	G251-A253 PolarHBondContact O-N 3.28Å; A253-F255 PolarHBondContact O-N 3.49Å
254	S	60.5	Low	77.7	Confident	66 Å²	66	71.3 Å²	71.3	46%	0.462	45%	0.448	S	S	.	.			trans	-70.1	70.8	168.5	-169.6	0	0	0	0	107.9	D244 A252 R256	D244-S254 PolarHBondContact OD2-OG 3.27Å; A252-S254 PolarHBondContact O-N 2.87Å; S254-R256 PolarHBondContact O-N 2.84Å
255	F	65.2	Low	78	Confident	181 Å²	181	70.6 Å²	70.6	79%	0.794	45%	0.445	S	S	*	.			trans	-85.5	98.2	172.4	-173.5	-95.9	0	0	0	107.6	A253	A253-F255 PolarHBondContact O-N 3.49Å
256	R	76.1	Confident	78.3	Confident	56 Å²	56	67.2 Å²	67.2	21%	0.211	42%	0.418	C	S	.	.			trans	-85.4	142.6	168.4	-65.4	-172.4	-176.2	134.2	19.2	109.3	D244 S254 V260 E398	D244-R256 IonicContact OD1-NH2 3.26Å; D244-R256 PolarHBondContact OD1-NH2 3.3Å; D244-R256 VanDerWaalsContact OD1-NH2 3.1Å; D244-R256 IonicContact OD2-NH2 2.68Å; S254-R256 PolarHBondContact O-N 2.84Å; R256-V260 HydrophobicContact CB-CB 4.25Å; R256-V260 HydrophobicContact CB-CG1 4.27Å; R256-V260 HydrophobicContact CG-CG1 4.44Å; R256-E398 IonicContact NE-OE2 2.67Å; R256-E398 PolarHBondContact NE-OE2 3.17Å
257	G	76.7	Confident	78.7	Confident	29 Å²	29	67 Å²	67	30%	0.299	42%	0.415	S	S	.	.			trans	-61	159.3	172.1	0	0	0	0	0	111.3	D259 V260	G257-D259 PolarHBondContact O-N 2.9Å; G257-V260 PolarHBondContact O-N 3Å
258	P	77.9	Confident	79.1	Confident	128 Å²	128	67.7 Å²	67.7	83%	0.831	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-26.3	-179	25.8	-34.9	0	0	0	113.5
259	D	84.2	Confident	79.8	Confident	92 Å²	92	65.7 Å²	65.7	49%	0.492	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	11.5	-179.7	-53.7	-45.7	0	0	0	112.5	G257 E400 D401	G257-D259 PolarHBondContact O-N 2.9Å; D259-E400 CarbonylContact O-C 3.55Å; D259-E400 WeakPolarHBondContact O-CA 3.36Å; D259-D401 PolarHBondContact O-N 3.39Å
260	V	86.9	Confident	81	Confident	29 Å²	29	63.3 Å²	63.3	18%	0.176	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.9	-175.9	179.3	0	0	0	0	110.3	R256 G257 E398 I399 E400	R256-V260 HydrophobicContact CB-CB 4.25Å; R256-V260 HydrophobicContact CB-CG1 4.27Å; R256-V260 HydrophobicContact CG-CG1 4.44Å; G257-V260 PolarHBondContact O-N 3Å; V260-E398 HydrophobicContact CG1-CG 3.22Å; V260-E398 WeakPolarHBondContact CG1-OE1 3.35Å; V260-I399 WeakPolarHBondContact CA-O 3.48Å; V260-E400 HydrophobicContact CG2-CB 4.22Å; V260-E400 HydrophobicContact CG2-CG 3.93Å
261	H	88	Confident	82.9	Confident	52 Å²	52	56.8 Å²	56.8	24%	0.241	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	158.4	174.3	68.4	-82.4	0	0	0	112	E263 E398 I399 D401	H261-E263 IonicContact CD2-OE1 3.91Å; H261-E263 IonicContact CE1-OE1 2.86Å; H261-E263 IonicContact NE2-OE1 3.24Å; H261-E263 PolarHBondContact NE2-OE1 2.5Å; H261-E398 WeakPolarHBondContact O-CA 3.49Å; H261-I399 PolarHBondContact N-O 3.14Å; H261-I399 PolarHBondContact O-N 3.38Å; H261-D401 VanDerWaalsContact CE1-CG 3.43Å; H261-D401 IonicContact CE1-OD1 3.35Å; H261-D401 PolarHBondContact CE1-OD1 2.93Å; H261-D401 IonicContact CE1-OD2 3.87Å; H261-D401 PolarHBondContact CE1-OD2 3.47Å; H261-D401 IonicContact ND1-OD2 3.97Å; H261-D401 PolarHBondContact ND1-OD2 3.45Å
262	V	91.7	Very high	84.6	Confident	20 Å²	20	58.6 Å²	58.6	12%	0.121	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.4	175.8	164.5	0	0	0	0	110.3	L238 V240 L375 H396 M397 E398	L238-V262 HydrophobicContact CD2-CG1 4.41Å; V240-V262 HydrophobicContact CG2-CB 4.36Å; V240-V262 HydrophobicContact CG2-CG1 4.19Å; V262-L375 HydrophobicContact CG1-CD1 4.3Å; V262-L375 HydrophobicContact CG2-CD1 3.94Å; V262-H396 WeakPolarHBondContact CG1-NE2 3.27Å; V262-M397 CarbonylContact C-O 3.58Å; V262-M397 WeakPolarHBondContact CA-O 3.41Å; V262-E398 HydrophobicContact CG2-CB 4.06Å; V262-E398 HydrophobicContact CG2-CG 4.14Å
263	E	93.6	Very high	86.4	Confident	26 Å²	26	57.6 Å²	57.6	12%	0.121	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.1	173.1	-59.9	178.6	-169.5	0	0	108.1	H261 R333 H396 M397 I399	H261-E263 IonicContact CD2-OE1 3.91Å; H261-E263 IonicContact CE1-OE1 2.86Å; H261-E263 IonicContact NE2-OE1 3.24Å; H261-E263 PolarHBondContact NE2-OE1 2.5Å; E263-R333 IonicContact OE1-CZ 2.78Å; E263-R333 IonicContact OE1-NH1 3.52Å; E263-R333 IonicContact OE1-NH2 3.57Å; E263-R333 PolarHBondContact OE1-NH2 3.12Å; E263-R333 IonicContact OE2-CZ 2.7Å; E263-R333 IonicContact OE2-NH1 2.77Å; E263-R333 PolarHBondContact OE2-NH1 3.03Å; E263-R333 IonicContact OE2-NH2 3.56Å; E263-R333 PolarHBondContact OE2-NH2 3.44Å; E263-H396 CarbonylContact O-C 3.52Å; E263-H396 WeakPolarHBondContact O-CA 3.27Å; E263-M397 HydrophobicContact CB-CG 3.9Å; E263-M397 PolarHBondContact N-O 3.38Å; E263-M397 PolarHBondContact O-N 3.47Å; E263-I399 HydrophobicContact CG-CG1 4.45Å
264	G	95.4	Very high	88.4	Confident	10 Å²	10	55.6 Å²	55.6	10%	0.103	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	129.1	179.2	0	0	0	0	0	110.9	V237 L238 E395	V237-G264 WeakPolarHBondContact CA-O 3.23Å; L238-G264 PolarHBondContact N-O 3.28Å; G264-E395 CarbonylContact C-O 3.54Å; G264-E395 VanDerWaalsContact CA-O 3.29Å; G264-E395 WeakPolarHBondContact CA-O 3.38Å
265	S	96.8	Very high	90.1	Very high	18 Å²	18	52.4 Å²	52.4	13%	0.126	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	152.2	177	59.8	0	0	0	0	112	E236 V394 E395 G420 A421	E236-S265 VanDerWaalsContact O-CA 3.26Å; E236-S265 WeakPolarHBondContact O-CA 3.44Å; E236-S265 WeakPolarHBondContact O-CB 3.48Å; S265-V394 WeakPolarHBondContact O-CA 3.38Å; S265-E395 PolarHBondContact N-O 2.88Å; S265-E395 PolarHBondContact O-N 3.49Å; S265-G420 WeakPolarHBondContact OG-CA 3.44Å; S265-A421 WeakPolarHBondContact O-CB 3.18Å; S265-A421 PolarHBondContact OG-N 2.92Å
266	R	97.2	Very high	91.5	Very high	27 Å²	27	45.9 Å²	45.9	10%	0.102	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.9	175.8	-172.4	178.4	69.5	177	-6.4	110.3	A222 A224 W229 E236 T392 W393 V394	A222-R266 PolarHBondContact O-NH1 2.66Å; A224-R266 PolarHBondContact O-NH1 2.98Å; A224-R266 PolarHBondContact O-NH2 3.17Å; W229-R266 HydrophobicContact CD2-CB 3.9Å; W229-R266 HydrophobicContact CE3-CB 3.84Å; W229-R266 HydrophobicContact CH2-CB 3.86Å; W229-R266 HydrophobicContact CZ2-CB 3.88Å; W229-R266 HydrophobicContact CZ2-CG 4.46Å; W229-R266 HydrophobicContact CZ3-CB 3.83Å; E236-R266 HydrophobicContact CB-CB 4.3Å; E236-R266 VanDerWaalsContact CD-NH2 3.25Å; E236-R266 PolarHBondContact O-N 2.85Å; E236-R266 IonicContact OE1-CZ 3.91Å; E236-R266 IonicContact OE1-NH2 3.2Å; E236-R266 PolarHBondContact OE1-NH2 2.86Å; E236-R266 IonicContact OE2-CZ 3.71Å; E236-R266 IonicContact OE2-NE 2.74Å; E236-R266 PolarHBondContact OE2-NE 2.93Å; E236-R266 IonicContact OE2-NH2 3.97Å; E236-R266 PolarHBondContact OE2-NH2 3.45Å; R266-T392 HydrophobicContact CG-CG2 4.17Å; R266-W393 VanDerWaalsContact CA-O 3.3Å; R266-W393 WeakPolarHBondContact CA-O 3.42Å; R266-W393 WeakPolarHBondContact CG-O 3.44Å; R266-V394 HydrophobicContact CB-CG2 4.43Å; R266-V394 HydrophobicContact CG-CG2 3.93Å
267	D	96.7	Very high	92.4	Very high	58 Å²	58	44.3 Å²	44.3	31%	0.31	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	162.9	167.8	-157.1	1.7	0	0	0	111	T392 W393 A421 H422 L425	D267-T392 CarbonylContact O-C 3.5Å; D267-T392 WeakPolarHBondContact O-CA 3.26Å; D267-W393 PolarHBondContact N-O 3.16Å; D267-W393 PolarHBondContact O-N 3.29Å; D267-A421 HydrophobicContact CB-CB 4.16Å; D267-H422 HydrophobicContact CB-CB 4.27Å; D267-H422 VanDerWaalsContact OD2-CA 3.23Å; D267-H422 WeakPolarHBondContact OD2-CA 3.29Å; D267-H422 VanDerWaalsContact OD2-CB 3.26Å; D267-H422 WeakPolarHBondContact OD2-CB 3.33Å; D267-L425 HydrophobicContact CB-CD2 3.95Å
268	S	96.9	Very high	93.3	Very high	49 Å²	49	42.9 Å²	42.9	34%	0.343	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	137.1	179.1	-66.7	0	0	0	0	112.7	V391 T392	S268-V391 CarbonylContact C-O 3.53Å; S268-V391 VanDerWaalsContact CA-O 3.24Å; S268-V391 WeakPolarHBondContact CA-O 3.06Å; S268-T392 WeakPolarHBondContact OG-CB 3.43Å; S268-T392 VanDerWaalsContact OG-CG2 3.32Å; S268-T392 WeakPolarHBondContact OG-CG2 3.45Å; S268-T392 PolarHBondContact OG-OG1 3.31Å
269	G	96.5	Very high	94.2	Very high	14 Å²	14	36.8 Å²	36.8	14%	0.144	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	168.3	-178.3	0	0	0	0	0	113.3	K390 V391	G269-K390 WeakPolarHBondContact O-CA 3.43Å; G269-V391 PolarHBondContact N-O 2.93Å; G269-V391 PolarHBondContact O-N 3.4Å
270	L	97.4	Very high	94.7	Very high	96 Å²	96	35 Å²	35	50%	0.503	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	142.7	174.1	-66.1	171.3	0	0	0	110.1	M384 S389 K390 Q429	L270-M384 HydrophobicContact CD2-CE 4.25Å; L270-M384 HydrophobicContact CD2-CG 3.98Å; L270-M384 HydrophobicContact CD2-SD 4.34Å; L270-S389 WeakPolarHBondContact CA-O 3.26Å; L270-K390 HydrophobicContact CD2-CB 3.91Å; L270-K390 HydrophobicContact CD2-CG 4.45Å; L270-Q429 PolarHBondContact O-NE2 3.17Å
271	V	96.4	Very high	95	Very high	2 Å²	2	34 Å²	34	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	140.2	177	-57.2	0	0	0	0	110.7	M273 L278 S388 S389 V391 L428 Q429 C432	V271-M273 PolarHBondContact O-N 2.99Å; V271-L278 HydrophobicContact CG2-CD1 3.62Å; V271-L278 HydrophobicContact CG2-CD2 4.38Å; V271-S388 WeakPolarHBondContact O-CA 3.47Å; V271-S388 VanDerWaalsContact O-CB 3.26Å; V271-S388 WeakPolarHBondContact O-CB 3.38Å; V271-S389 PolarHBondContact N-O 3.33Å; V271-S389 PolarHBondContact O-N 3.46Å; V271-V391 HydrophobicContact CG1-CG2 4.32Å; V271-V391 HydrophobicContact CG2-CG2 3.71Å; V271-L428 HydrophobicContact CG1-CD2 3.9Å; V271-L428 HydrophobicContact CG1-CG 3.97Å; V271-L428 HydrophobicContact CG2-CD2 4.5Å; V271-Q429 HydrophobicContact CG1-CG 3.79Å; V271-C432 HydrophobicContact CB-CB 4.31Å
272	F	93.1	Very high	95.5	Very high	127 Å²	127	31.6 Å²	31.6	56%	0.557	18%	0.181	S	C	*	.	S	Bend	trans	-80.4	56.9	-177.1	-62.1	-68.6	0	0	0	112.9	E433 A436	F272-E433 HydrophobicContact CD2-CG 4.08Å; F272-E433 HydrophobicContact CE2-CG 4.37Å; F272-A436 HydrophobicContact CB-CB 4.48Å
273	M	95.1	Very high	95.6	Very high	36 Å²	36	31.8 Å²	31.8	18%	0.177	18%	0.181	C	C	.	.	S	Bend	trans	-152.7	143.2	176.3	-170.1	167.3	-65.5	0	0	109.8	V271 L278 F291 G387 S388 S389 C435	V271-M273 PolarHBondContact O-N 2.99Å; M273-L278 HydrophobicContact CB-CD2 4.03Å; M273-L278 HydrophobicContact CB-CG 4.06Å; M273-L278 HydrophobicContact CG-CD2 4.13Å; M273-L278 HydrophobicContact CG-CG 4Å; M273-L278 HydrophobicContact SD-CD2 3.77Å; M273-L278 HydrophobicContact SD-CG 4.12Å; M273-F291 HydrophobicContact CE-CE1 4.23Å; M273-F291 HydrophobicContact CE-CZ 3.89Å; M273-F291 HydrophobicContact SD-CZ 4.48Å; M273-G387 CarbonylContact C-O 3.58Å; M273-S388 CarbonylContact O-C 3.51Å; M273-S389 VanDerWaalsContact O-CB 3.31Å; M273-S389 WeakPolarHBondContact O-CB 3.45Å; M273-S389 PolarHBondContact O-N 2.77Å; M273-S389 PolarHBondContact O-OG 3.39Å; M273-C435 HydrophobicContact CE-CB 4.11Å
274	S	95	Very high	95.7	Very high	51 Å²	51	33.2 Å²	33.2	36%	0.357	19%	0.19	S	C	.	.			trans	-64.7	153.2	174.2	63.8	0	0	0	0	111.8	V276 G277 L278 G387	S274-V276 VanDerWaalsContact C-N 3.27Å; S274-V276 PolarHBondContact O-N 2.93Å; S274-G277 PolarHBondContact O-N 2.78Å; S274-G277 PolarHBondContact OG-N 2.79Å; S274-L278 PolarHBondContact O-N 3Å; S274-L278 VanDerWaalsContact O-N 3.08Å; S274-G387 PolarHBondContact N-O 2.86Å
275	A	96.1	Very high	95.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-39.6	-177.5	0	0	0	0	0	112	G277 L278 V279 W349 I381 D383 S389	A275-G277 PolarHBondContact O-N 3.26Å; A275-L278 PolarHBondContact O-N 2.92Å; A275-V279 WeakPolarHBondContact O-CG2 3.26Å; A275-V279 PolarHBondContact O-N 3.29Å; A275-W349 HydrophobicContact CB-CG 4.46Å; A275-I381 HydrophobicContact CB-CB 4.36Å; A275-I381 HydrophobicContact CB-CG2 3.53Å; A275-D383 WeakPolarHBondContact CB-OD1 3.33Å; A275-D383 PolarHBondContact N-OD1 2.89Å; A275-S389 WeakPolarHBondContact CA-OG 3.26Å; A275-S389 PolarHBondContact N-OG 2.97Å
276	V	94.3	Very high	95.5	Very high	43 Å²	43	36.7 Å²	36.7	26%	0.261	21%	0.212	S	C	.	.	H	α-helix	trans	-63.6	-41	176.2	177.8	0	0	0	0	111.7	S274 L278 V279 D280 W349	S274-V276 VanDerWaalsContact C-N 3.27Å; S274-V276 PolarHBondContact O-N 2.93Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 2.79Å; V276-V279 PolarHBondContact O-N 3.38Å; V276-D280 WeakPolarHBondContact O-CB 3.47Å; V276-D280 PolarHBondContact O-N 3.08Å; V276-W349 HydrophobicContact CG2-CZ2 3.93Å
277	G	94.2	Very high	95.4	Very high	23 Å²	23	39.5 Å²	39.5	24%	0.237	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-40	176.1	0	0	0	0	0	112.3	S274 A275 M281	S274-G277 PolarHBondContact O-N 2.78Å; S274-G277 PolarHBondContact OG-N 2.79Å; A275-G277 PolarHBondContact O-N 3.26Å; G277-M281 WeakPolarHBondContact O-CB 3.42Å; G277-M281 PolarHBondContact O-N 2.83Å; G277-M281 VanDerWaalsContact O-N 3.11Å
278	L	96.7	Very high	95.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-40.8	174.7	-66.4	168	0	0	0	112.1	V271 M273 S274 A275 V276 M281 F282 I381 V391 L428	V271-L278 HydrophobicContact CG2-CD1 3.62Å; V271-L278 HydrophobicContact CG2-CD2 4.38Å; M273-L278 HydrophobicContact CB-CD2 4.03Å; M273-L278 HydrophobicContact CB-CG 4.06Å; M273-L278 HydrophobicContact CG-CD2 4.13Å; M273-L278 HydrophobicContact CG-CG 4Å; M273-L278 HydrophobicContact SD-CD2 3.77Å; M273-L278 HydrophobicContact SD-CG 4.12Å; S274-L278 PolarHBondContact O-N 3Å; S274-L278 VanDerWaalsContact O-N 3.08Å; A275-L278 PolarHBondContact O-N 2.92Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 2.79Å; L278-M281 VanDerWaalsContact O-CB 3.31Å; L278-M281 WeakPolarHBondContact O-CB 3.42Å; L278-M281 PolarHBondContact O-N 3.03Å; L278-F282 HydrophobicContact CB-CZ 4.46Å; L278-F282 HydrophobicContact CD2-CE1 4.31Å; L278-F282 HydrophobicContact CD2-CZ 4.24Å; L278-F282 WeakPolarHBondContact O-CB 3.41Å; L278-F282 WeakPolarHBondContact O-CD1 3.46Å; L278-F282 VanDerWaalsContact O-CG 3.24Å; L278-F282 WeakPolarHBondContact O-CG 3.33Å; L278-F282 PolarHBondContact O-N 2.68Å; L278-I381 HydrophobicContact CB-CD1 4.01Å; L278-I381 HydrophobicContact CB-CG2 4.5Å; L278-I381 HydrophobicContact CD1-CG2 3.61Å; L278-V391 HydrophobicContact CD1-CG2 3.97Å; L278-L428 HydrophobicContact CD2-CD1 3.75Å; L278-L428 HydrophobicContact CD2-CD2 4.34Å; L278-L428 HydrophobicContact CD2-CG 4.44Å
279	V	96.3	Very high	95.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-47.9	176.3	169.1	0	0	0	0	111.3	A275 V276 M281 F282 M283 R312 C341 W349 I351 I381	A275-V279 WeakPolarHBondContact O-CG2 3.26Å; A275-V279 PolarHBondContact O-N 3.29Å; V276-V279 PolarHBondContact O-N 3.38Å; V279-M281 PolarHBondContact O-N 2.78Å; V279-F282 PolarHBondContact O-N 2.89Å; V279-M283 HydrophobicContact CG1-CG 4.29Å; V279-M283 WeakPolarHBondContact O-CG 3.41Å; V279-M283 PolarHBondContact O-N 2.71Å; V279-M283 VanDerWaalsContact O-N 3.08Å; V279-R312 HydrophobicContact CG1-CB 4.29Å; V279-R312 HydrophobicContact CG1-CG 4.29Å; V279-C341 WeakPolarHBondContact CG1-SG 3.47Å; V279-W349 HydrophobicContact CG1-CE3 4.29Å; V279-W349 HydrophobicContact CG1-CZ3 4.35Å; V279-W349 HydrophobicContact CG2-CB 3.96Å; V279-W349 HydrophobicContact CG2-CD2 3.88Å; V279-W349 HydrophobicContact CG2-CE3 3.84Å; V279-W349 HydrophobicContact CG2-CG 3.94Å; V279-I351 HydrophobicContact CG2-CD1 4.1Å; V279-I381 HydrophobicContact CG2-CD1 4.27Å
280	D	93.9	Very high	95.1	Very high	54 Å²	54	39.6 Å²	39.6	29%	0.289	22%	0.217	S	C	.	.	H	α-helix	trans	-60.8	-28.3	177.7	-75.2	-15.9	0	0	0	112.5	V276 R312	V276-D280 WeakPolarHBondContact O-CB 3.47Å; V276-D280 PolarHBondContact O-N 3.08Å; D280-R312 IonicContact OD1-CZ 3.42Å; D280-R312 IonicContact OD1-NE 2.71Å; D280-R312 PolarHBondContact OD1-NE 2.88Å; D280-R312 IonicContact OD1-NH2 3.32Å; D280-R312 PolarHBondContact OD1-NH2 2.84Å; D280-R312 IonicContact OD2-CZ 3.54Å; D280-R312 IonicContact OD2-NE 3.63Å; D280-R312 IonicContact OD2-NH2 2.72Å; D280-R312 PolarHBondContact OD2-NH2 3.29Å
281	M	94.9	Very high	94.9	Very high	7 Å²	7	36.1 Å²	36.1	3%	0.034	20%	0.198	C	C	.	.	H	α-helix	trans	-71.8	-60.3	172.5	-166.7	-1.1	-83.5	0	0	108.8	G277 L278 V279 M283 D284 K287 W288 F291	G277-M281 WeakPolarHBondContact O-CB 3.42Å; G277-M281 PolarHBondContact O-N 2.83Å; G277-M281 VanDerWaalsContact O-N 3.11Å; L278-M281 VanDerWaalsContact O-CB 3.31Å; L278-M281 WeakPolarHBondContact O-CB 3.42Å; L278-M281 PolarHBondContact O-N 3.03Å; V279-M281 PolarHBondContact O-N 2.78Å; M281-M283 VanDerWaalsContact C-N 3.26Å; M281-M283 PolarHBondContact O-N 2.6Å; M281-D284 PolarHBondContact O-N 2.94Å; M281-K287 HydrophobicContact CE-CB 4.04Å; M281-K287 VanDerWaalsContact CE-O 3.3Å; M281-K287 WeakPolarHBondContact CE-O 3.45Å; M281-K287 HydrophobicContact SD-CB 3.06Å; M281-K287 WeakPolarHBondContact SD-CB 3.25Å; M281-K287 HydrophobicContact SD-CD 4.27Å; M281-K287 HydrophobicContact SD-CG 4.3Å; M281-W288 HydrophobicContact CE-CB 3.98Å; M281-W288 HydrophobicContact CE-CE3 3.86Å; M281-F291 HydrophobicContact CE-CB 4.03Å; M281-F291 HydrophobicContact CE-CD2 4.45Å; M281-F291 HydrophobicContact CE-CG 4.2Å; M281-F291 HydrophobicContact CG-CD1 3.82Å; M281-F291 HydrophobicContact CG-CD2 3.62Å; M281-F291 HydrophobicContact CG-CE1 3.85Å; M281-F291 HydrophobicContact CG-CE2 3.66Å; M281-F291 HydrophobicContact CG-CG 3.7Å; M281-F291 HydrophobicContact CG-CZ 3.78Å; M281-F291 HydrophobicContact SD-CB 4.09Å; M281-F291 HydrophobicContact SD-CD1 4.41Å; M281-F291 HydrophobicContact SD-CD2 3.42Å; M281-F291 WeakPolarHBondContact SD-CD2 3.06Å; M281-F291 HydrophobicContact SD-CE2 3.93Å; M281-F291 HydrophobicContact SD-CG 3.71Å
282	F	97	Very high	94.9	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-66.4	-25	-167.2	-67.1	4.9	0	0	0	113.9	L278 V279 W288 F292 R339 I351 I381 W393 L428	L278-F282 HydrophobicContact CB-CZ 4.46Å; L278-F282 HydrophobicContact CD2-CE1 4.31Å; L278-F282 HydrophobicContact CD2-CZ 4.24Å; L278-F282 WeakPolarHBondContact O-CB 3.41Å; L278-F282 WeakPolarHBondContact O-CD1 3.46Å; L278-F282 VanDerWaalsContact O-CG 3.24Å; L278-F282 WeakPolarHBondContact O-CG 3.33Å; L278-F282 PolarHBondContact O-N 2.68Å; V279-F282 PolarHBondContact O-N 2.89Å; F282-W288 HydrophobicContact CB-CE3 4.29Å; F282-W288 HydrophobicContact CB-CZ3 4.15Å; F282-W288 AromaticContact CD1-CE3 3.99Å; F282-W288 HydrophobicContact CD1-CE3 3.99Å; F282-W288 AromaticContact CD1-CZ3 3.68Å; F282-W288 HydrophobicContact CD1-CZ3 3.68Å; F282-W288 HydrophobicContact CD2-CZ3 4.23Å; F282-W288 HydrophobicContact CE1-CZ3 4.13Å; F282-W288 HydrophobicContact CG-CE3 4.22Å; F282-W288 AromaticContact CG-CZ3 3.75Å; F282-W288 HydrophobicContact CG-CZ3 3.75Å; F282-F292 HydrophobicContact CD1-CE2 4.43Å; F282-F292 HydrophobicContact CE1-CE2 4Å; F282-F292 HydrophobicContact CE1-CZ 4.1Å; F282-F292 HydrophobicContact CZ-CZ 4.39Å; F282-R339 PolarHBondContact O-NH1 3.42Å; F282-I351 HydrophobicContact CB-CD1 3.73Å; F282-I351 HydrophobicContact CD2-CD1 3.69Å; F282-I351 HydrophobicContact CG-CD1 4.16Å; F282-I381 HydrophobicContact CD2-CD1 4.34Å; F282-I381 HydrophobicContact CE2-CD1 4.09Å; F282-W393 AromaticContact CE2-CH2 3.91Å; F282-W393 HydrophobicContact CE2-CH2 3.91Å; F282-W393 AromaticContact CE2-CZ3 3.65Å; F282-W393 HydrophobicContact CE2-CZ3 3.65Å; F282-W393 HydrophobicContact CZ-CH2 4.01Å; F282-W393 AromaticContact CZ-CZ3 3.67Å; F282-W393 HydrophobicContact CZ-CZ3 3.67Å; F282-L428 HydrophobicContact CE1-CD1 3.85Å; F282-L428 HydrophobicContact CZ-CD1 3.82Å; F282-L428 HydrophobicContact CZ-CD2 3.91Å; F282-L428 HydrophobicContact CZ-CG 4.5Å
283	M	95.2	Very high	95	Very high	24 Å²	24	30.9 Å²	30.9	12%	0.118	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.7	176.8	-62.6	-56.1	-66.9	0	0	113.5	V279 M281 V317 R339 C341	V279-M283 HydrophobicContact CG1-CG 4.29Å; V279-M283 WeakPolarHBondContact O-CG 3.41Å; V279-M283 PolarHBondContact O-N 2.71Å; V279-M283 VanDerWaalsContact O-N 3.08Å; M281-M283 VanDerWaalsContact C-N 3.26Å; M281-M283 PolarHBondContact O-N 2.6Å; M283-V317 HydrophobicContact CE-CG1 4.15Å; M283-V317 HydrophobicContact CE-CG2 3.77Å; M283-R339 HydrophobicContact CE-CG 4.35Å; M283-R339 HydrophobicContact SD-CG 3.79Å; M283-C341 HydrophobicContact CE-CB 4.08Å; M283-C341 HydrophobicContact CG-CB 4.28Å; M283-C341 HydrophobicContact SD-CB 3.68Å
284	D	94	Very high	95	Very high	56 Å²	56	30.3 Å²	30.3	30%	0.299	18%	0.178	S	C	.	.			trans	-98.5	113.3	177.7	-174.2	-40.1	0	0	0	110.4	M281 S286 K287 W288	M281-D284 PolarHBondContact O-N 2.94Å; D284-S286 VanDerWaalsContact C-N 3.27Å; D284-S286 PolarHBondContact O-N 2.8Å; D284-S286 WeakPolarHBondContact OD1-CB 3.22Å; D284-S286 PolarHBondContact OD1-N 3.33Å; D284-K287 HydrophobicContact CB-CB 4.15Å; D284-K287 HydrophobicContact CB-CD 3.92Å; D284-K287 HydrophobicContact CB-CG 3.99Å; D284-K287 PolarHBondContact O-N 3.14Å; D284-K287 PolarHBondContact OD1-N 3.13Å; D284-K287 VanDerWaalsContact OD2-CE 3.29Å; D284-K287 WeakPolarHBondContact OD2-CE 3.38Å; D284-K287 IonicContact OD2-NZ 2.95Å; D284-W288 WeakPolarHBondContact O-CB 3.39Å; D284-W288 PolarHBondContact O-N 3.23Å
285	S	94.7	Very high	95.1	Very high	19 Å²	19	28 Å²	28	13%	0.133	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-31.1	-177.4	56.6	0	0	0	0	114.4	T289	S285-T289 PolarHBondContact O-N 3Å
286	S	94.3	Very high	95.1	Very high	82 Å²	82	28 Å²	28	57%	0.573	16%	0.162	S	C	*	.	H	α-helix	trans	-76.2	-40.9	179.8	-61.5	0	0	0	0	110.8	D284 W288 T289 E290	D284-S286 VanDerWaalsContact C-N 3.27Å; D284-S286 PolarHBondContact O-N 2.8Å; D284-S286 WeakPolarHBondContact OD1-CB 3.22Å; D284-S286 PolarHBondContact OD1-N 3.33Å; S286-W288 VanDerWaalsContact C-N 3.28Å; S286-W288 PolarHBondContact O-N 2.7Å; S286-T289 PolarHBondContact O-OG1 3.35Å; S286-E290 WeakPolarHBondContact O-CB 3.29Å; S286-E290 PolarHBondContact O-N 3Å
287	K	94.4	Very high	95.1	Very high	86 Å²	86	26.9 Å²	26.9	37%	0.374	16%	0.155	S	C	.	.	H	α-helix	trans	-71.7	-28.1	175.1	-52.1	177.3	-171.2	160	0	111.4	M281 D284 E290 F291	M281-K287 HydrophobicContact CE-CB 4.04Å; M281-K287 VanDerWaalsContact CE-O 3.3Å; M281-K287 WeakPolarHBondContact CE-O 3.45Å; M281-K287 HydrophobicContact SD-CB 3.06Å; M281-K287 WeakPolarHBondContact SD-CB 3.25Å; M281-K287 HydrophobicContact SD-CD 4.27Å; M281-K287 HydrophobicContact SD-CG 4.3Å; D284-K287 HydrophobicContact CB-CB 4.15Å; D284-K287 HydrophobicContact CB-CD 3.92Å; D284-K287 HydrophobicContact CB-CG 3.99Å; D284-K287 PolarHBondContact O-N 3.14Å; D284-K287 PolarHBondContact OD1-N 3.13Å; D284-K287 VanDerWaalsContact OD2-CE 3.29Å; D284-K287 WeakPolarHBondContact OD2-CE 3.38Å; D284-K287 IonicContact OD2-NZ 2.95Å; K287-E290 CarbonylContact O-C 3.45Å; K287-E290 WeakPolarHBondContact O-CB 3.47Å; K287-E290 PolarHBondContact O-N 2.8Å; K287-E290 VanDerWaalsContact O-N 3.17Å; K287-F291 PolarHBondContact O-N 3.46Å
288	W	96.1	Very high	94.9	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.011	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-49.2	176.3	-176.8	-114.6	0	0	0	112.4	M281 F282 D284 S286 E290 F291 F292 E321 W393 W424	M281-W288 HydrophobicContact CE-CB 3.98Å; M281-W288 HydrophobicContact CE-CE3 3.86Å; F282-W288 HydrophobicContact CB-CE3 4.29Å; F282-W288 HydrophobicContact CB-CZ3 4.15Å; F282-W288 AromaticContact CD1-CE3 3.99Å; F282-W288 HydrophobicContact CD1-CE3 3.99Å; F282-W288 AromaticContact CD1-CZ3 3.68Å; F282-W288 HydrophobicContact CD1-CZ3 3.68Å; F282-W288 HydrophobicContact CD2-CZ3 4.23Å; F282-W288 HydrophobicContact CE1-CZ3 4.13Å; F282-W288 HydrophobicContact CG-CE3 4.22Å; F282-W288 AromaticContact CG-CZ3 3.75Å; F282-W288 HydrophobicContact CG-CZ3 3.75Å; D284-W288 WeakPolarHBondContact O-CB 3.39Å; D284-W288 PolarHBondContact O-N 3.23Å; S286-W288 VanDerWaalsContact C-N 3.28Å; S286-W288 PolarHBondContact O-N 2.7Å; W288-E290 VanDerWaalsContact C-N 3.29Å; W288-E290 PolarHBondContact O-N 2.89Å; W288-F291 PolarHBondContact O-N 2.83Å; W288-F292 AromaticContact CD2-CD2 3.98Å; W288-F292 HydrophobicContact CD2-CD2 3.98Å; W288-F292 HydrophobicContact CD2-CE2 4.28Å; W288-F292 AromaticContact CE3-CD2 3.66Å; W288-F292 HydrophobicContact CE3-CD2 3.66Å; W288-F292 AromaticContact CE3-CE2 3.51Å; W288-F292 HydrophobicContact CE3-CE2 3.51Å; W288-F292 HydrophobicContact CH2-CD2 4.14Å; W288-F292 AromaticContact CH2-CE2 3.84Å; W288-F292 HydrophobicContact CH2-CE2 3.84Å; W288-F292 HydrophobicContact CH2-CZ 4.45Å; W288-F292 HydrophobicContact CZ2-CD2 4.43Å; W288-F292 AromaticContact CZ3-CD2 3.76Å; W288-F292 HydrophobicContact CZ3-CD2 3.76Å; W288-F292 AromaticContact CZ3-CE2 3.25Å; W288-F292 HydrophobicContact CZ3-CE2 3.25Å; W288-F292 HydrophobicContact CZ3-CZ 4.1Å; W288-F292 WeakPolarHBondContact O-CD2 3.49Å; W288-F292 PolarHBondContact O-N 3.43Å; W288-F292 VanDerWaalsContact O-N 3.17Å; W288-E321 PolarHBondContact NE1-OE2 3.19Å; W288-W393 AromaticContact CH2-CH2 3.74Å; W288-W393 HydrophobicContact CH2-CH2 3.74Å; W288-W393 AromaticContact CH2-CZ2 3.88Å; W288-W393 HydrophobicContact CH2-CZ2 3.88Å; W288-W393 HydrophobicContact CZ3-CH2 4.13Å; W288-W424 HydrophobicContact CH2-CE3 4.17Å; W288-W424 HydrophobicContact CH2-CH2 4.25Å; W288-W424 AromaticContact CH2-CZ3 3.62Å; W288-W424 HydrophobicContact CH2-CZ3 3.62Å; W288-W424 HydrophobicContact CZ2-CE3 4.24Å; W288-W424 AromaticContact CZ2-CH2 3.52Å; W288-W424 HydrophobicContact CZ2-CH2 3.52Å; W288-W424 AromaticContact CZ2-CZ3 3.29Å; W288-W424 HydrophobicContact CZ2-CZ3 3.29Å
289	T	94.8	Very high	94.8	Very high	38 Å²	38	29.9 Å²	29.9	23%	0.233	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-34	174.7	55	0	0	0	0	112	S285 S286 F292 P293 V296 A299	S285-T289 PolarHBondContact O-N 3Å; S286-T289 PolarHBondContact O-OG1 3.35Å; T289-F292 CarbonylContact O-C 3.57Å; T289-P293 WeakPolarHBondContact O-CA 3.38Å; T289-V296 HydrophobicContact CG2-CG1 3.9Å; T289-A299 HydrophobicContact CG2-CB 3.62Å; T289-A299 VanDerWaalsContact CG2-N 3.33Å
290	E	92.6	Very high	94.7	Very high	83 Å²	83	34.7 Å²	34.7	39%	0.388	18%	0.184	S	C	.	.	H	α-helix	trans	-68	-36.7	178.1	-175.5	-175.8	161.2	0	0	113.3	S286 K287 W288 P293 Q466	S286-E290 WeakPolarHBondContact O-CB 3.29Å; S286-E290 PolarHBondContact O-N 3Å; K287-E290 CarbonylContact O-C 3.45Å; K287-E290 WeakPolarHBondContact O-CB 3.47Å; K287-E290 PolarHBondContact O-N 2.8Å; K287-E290 VanDerWaalsContact O-N 3.17Å; W288-E290 VanDerWaalsContact C-N 3.29Å; W288-E290 PolarHBondContact O-N 2.89Å; E290-P293 WeakPolarHBondContact O-CD 3.49Å; E290-Q466 VanDerWaalsContact CD-NE2 3.32Å; E290-Q466 HydrophobicContact CG-CG 4.48Å; E290-Q466 VanDerWaalsContact OE1-CD 3.27Å; E290-Q466 PolarHBondContact OE1-NE2 2.93Å; E290-Q466 PolarHBondContact OE1-OE1 2.78Å
291	F	94.1	Very high	94.7	Very high	23 Å²	23	34.7 Å²	34.7	10%	0.101	19%	0.186	C	C	.	.	H	α-helix	trans	-77.8	-32.4	178.2	-102.8	-117.8	0	0	0	113	M273 M281 K287 W288 P293 L428 A431	M273-F291 HydrophobicContact CE-CE1 4.23Å; M273-F291 HydrophobicContact CE-CZ 3.89Å; M273-F291 HydrophobicContact SD-CZ 4.48Å; M281-F291 HydrophobicContact CE-CB 4.03Å; M281-F291 HydrophobicContact CE-CD2 4.45Å; M281-F291 HydrophobicContact CE-CG 4.2Å; M281-F291 HydrophobicContact CG-CD1 3.82Å; M281-F291 HydrophobicContact CG-CD2 3.62Å; M281-F291 HydrophobicContact CG-CE1 3.85Å; M281-F291 HydrophobicContact CG-CE2 3.66Å; M281-F291 HydrophobicContact CG-CG 3.7Å; M281-F291 HydrophobicContact CG-CZ 3.78Å; M281-F291 HydrophobicContact SD-CB 4.09Å; M281-F291 HydrophobicContact SD-CD1 4.41Å; M281-F291 HydrophobicContact SD-CD2 3.42Å; M281-F291 WeakPolarHBondContact SD-CD2 3.06Å; M281-F291 HydrophobicContact SD-CE2 3.93Å; M281-F291 HydrophobicContact SD-CG 3.71Å; K287-F291 PolarHBondContact O-N 3.46Å; W288-F291 PolarHBondContact O-N 2.83Å; F291-P293 WeakPolarHBondContact O-CD 3.42Å; F291-L428 HydrophobicContact CD1-CD1 4.14Å; F291-L428 HydrophobicContact CE1-CD1 4.35Å; F291-A431 HydrophobicContact CD1-CB 3.55Å; F291-A431 HydrophobicContact CE1-CB 3.8Å; F291-A431 HydrophobicContact CG-CB 4.14Å
292	F	96.8	Very high	94.5	Very high	1 Å²	1	36.5 Å²	36.5	0%	0.004	20%	0.197	C	C	.	.			trans	-120.7	45.9	-174.3	-59.3	-77.7	0	0	0	113.4	F282 W288 T289 A294 I295 V296 W393 W424 A427 L428	F282-F292 HydrophobicContact CD1-CE2 4.43Å; F282-F292 HydrophobicContact CE1-CE2 4Å; F282-F292 HydrophobicContact CE1-CZ 4.1Å; F282-F292 HydrophobicContact CZ-CZ 4.39Å; W288-F292 AromaticContact CD2-CD2 3.98Å; W288-F292 HydrophobicContact CD2-CD2 3.98Å; W288-F292 HydrophobicContact CD2-CE2 4.28Å; W288-F292 AromaticContact CE3-CD2 3.66Å; W288-F292 HydrophobicContact CE3-CD2 3.66Å; W288-F292 AromaticContact CE3-CE2 3.51Å; W288-F292 HydrophobicContact CE3-CE2 3.51Å; W288-F292 HydrophobicContact CH2-CD2 4.14Å; W288-F292 AromaticContact CH2-CE2 3.84Å; W288-F292 HydrophobicContact CH2-CE2 3.84Å; W288-F292 HydrophobicContact CH2-CZ 4.45Å; W288-F292 HydrophobicContact CZ2-CD2 4.43Å; W288-F292 AromaticContact CZ3-CD2 3.76Å; W288-F292 HydrophobicContact CZ3-CD2 3.76Å; W288-F292 AromaticContact CZ3-CE2 3.25Å; W288-F292 HydrophobicContact CZ3-CE2 3.25Å; W288-F292 HydrophobicContact CZ3-CZ 4.1Å; W288-F292 WeakPolarHBondContact O-CD2 3.49Å; W288-F292 PolarHBondContact O-N 3.43Å; W288-F292 VanDerWaalsContact O-N 3.17Å; T289-F292 CarbonylContact O-C 3.57Å; F292-A294 PolarHBondContact O-N 3.1Å; F292-A294 VanDerWaalsContact O-N 3.08Å; F292-I295 HydrophobicContact CB-CB 4.37Å; F292-I295 HydrophobicContact CD1-CD1 4.24Å; F292-I295 PolarHBondContact O-N 3.46Å; F292-V296 HydrophobicContact CB-CB 4.31Å; F292-V296 HydrophobicContact CB-CG2 3.8Å; F292-V296 PolarHBondContact O-N 3.05Å; F292-W393 AromaticContact CZ-CH2 3.98Å; F292-W393 HydrophobicContact CZ-CH2 3.98Å; F292-W393 HydrophobicContact CZ-CZ3 4.36Å; F292-W424 HydrophobicContact CB-CZ3 4.11Å; F292-W424 AromaticContact CD1-CE3 3.71Å; F292-W424 HydrophobicContact CD1-CE3 3.71Å; F292-W424 AromaticContact CD1-CZ3 3.92Å; F292-W424 HydrophobicContact CD1-CZ3 3.92Å; F292-W424 HydrophobicContact CD2-CE3 4.48Å; F292-W424 HydrophobicContact CD2-CZ3 4.06Å; F292-W424 AromaticContact CE1-CE3 3.82Å; F292-W424 HydrophobicContact CE1-CE3 3.82Å; F292-W424 HydrophobicContact CE1-CZ3 4.33Å; F292-W424 HydrophobicContact CE2-CZ3 4.48Å; F292-W424 HydrophobicContact CG-CE3 4.05Å; F292-W424 AromaticContact CG-CZ3 3.76Å; F292-W424 HydrophobicContact CG-CZ3 3.76Å; F292-W424 HydrophobicContact CZ-CE3 4.26Å; F292-A427 HydrophobicContact CD1-CB 3.88Å; F292-A427 HydrophobicContact CE1-CB 4.17Å; F292-L428 HydrophobicContact CE1-CB 4.02Å; F292-L428 HydrophobicContact CZ-CB 4.14Å; F292-L428 HydrophobicContact CZ-CD1 3.99Å
293	P	95.5	Very high	94.2	Very high	18 Å²	18	38.3 Å²	38.3	12%	0.117	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-28.1	-172.1	26.8	-35.6	0	0	0	112.4	T289 E290 F291 I295 H324 V469 C473	T289-P293 WeakPolarHBondContact O-CA 3.38Å; E290-P293 WeakPolarHBondContact O-CD 3.49Å; F291-P293 WeakPolarHBondContact O-CD 3.42Å; P293-I295 VanDerWaalsContact C-N 3.32Å; P293-H324 PolarHBondContact O-CE1 2.85Å; P293-H324 PolarHBondContact O-NE2 3.15Å; P293-V469 HydrophobicContact CG-CG1 4.32Å; P293-C473 HydrophobicContact CB-CB 4.18Å; P293-C473 WeakPolarHBondContact O-CB 3.49Å
294	A	95.1	Very high	94.1	Very high	23 Å²	23	40.6 Å²	40.6	19%	0.19	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-12.3	177.3	0	0	0	0	0	113.9	F292 H324 M326 R423	F292-A294 PolarHBondContact O-N 3.1Å; F292-A294 VanDerWaalsContact O-N 3.08Å; A294-H324 PolarHBondContact O-CD2 2.97Å; A294-H324 VanDerWaalsContact O-CD2 3.32Å; A294-H324 PolarHBondContact O-NE2 3.14Å; A294-M326 HydrophobicContact CB-CG 4.14Å; A294-M326 HydrophobicContact CB-SD 4.33Å; A294-R423 PolarHBondContact O-NH2 3.48Å
295	I	97	Very high	94	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-45.2	-177	-51.1	180	0	0	0	110.9	F292 P293 L323 H324 R423 W424 A427	F292-I295 HydrophobicContact CB-CB 4.37Å; F292-I295 HydrophobicContact CD1-CD1 4.24Å; F292-I295 PolarHBondContact O-N 3.46Å; P293-I295 VanDerWaalsContact C-N 3.32Å; I295-L323 HydrophobicContact CG2-CD2 4.44Å; I295-L323 CarbonylContact O-C 3.57Å; I295-L323 VanDerWaalsContact O-CA 3.25Å; I295-L323 WeakPolarHBondContact O-CA 3.32Å; I295-H324 PolarHBondContact O-CD2 2.82Å; I295-H324 VanDerWaalsContact O-CD2 3.32Å; I295-H324 PolarHBondContact O-N 3.38Å; I295-R423 HydrophobicContact CD1-CG 3.97Å; I295-R423 HydrophobicContact CG1-CG 4.41Å; I295-W424 HydrophobicContact CB-CH2 4.44Å; I295-W424 HydrophobicContact CB-CZ3 4.48Å; I295-W424 HydrophobicContact CD1-CD2 4Å; I295-W424 HydrophobicContact CD1-CE3 4.01Å; I295-W424 HydrophobicContact CD1-CG 4.29Å; I295-W424 HydrophobicContact CG2-CD2 4.21Å; I295-W424 HydrophobicContact CG2-CE3 4.37Å; I295-W424 HydrophobicContact CG2-CH2 3.72Å; I295-W424 HydrophobicContact CG2-CZ2 3.51Å; I295-W424 HydrophobicContact CG2-CZ3 4.13Å; I295-A427 HydrophobicContact CD1-CB 3.77Å
296	V	96.1	Very high	93.9	Very high	2 Å²	2	41 Å²	41	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	110.9	-177.8	-174.3	0	0	0	0	108.5	T289 F292 K298 A299 L323 W424	T289-V296 HydrophobicContact CG2-CG1 3.9Å; F292-V296 HydrophobicContact CB-CB 4.31Å; F292-V296 HydrophobicContact CB-CG2 3.8Å; F292-V296 PolarHBondContact O-N 3.05Å; V296-K298 WeakPolarHBondContact CG1-O 3.41Å; V296-A299 HydrophobicContact CG1-CB 4.04Å; V296-L323 HydrophobicContact CG2-CD2 3.94Å; V296-W424 HydrophobicContact CG2-CH2 3.49Å; V296-W424 VanDerWaalsContact CG2-CH2 3.49Å; V296-W424 HydrophobicContact CG2-CZ3 3.82Å
297	S	92.8	Very high	93.6	Very high	18 Å²	18	43.1 Å²	43.1	13%	0.126	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-35.4	177.2	66.9	0	0	0	0	111.9	E322 S477	S297-E322 PolarHBondContact N-O 3.07Å; S297-E322 WeakPolarHBondContact OG-CB 3.39Å; S297-E322 PolarHBondContact OG-O 3.29Å; S297-S477 VanDerWaalsContact CB-OG 3.29Å; S297-S477 WeakPolarHBondContact CB-OG 3.24Å; S297-S477 PolarHBondContact OG-OG 2.93Å
298	K	91.6	Very high	93.2	Very high	66 Å²	66	39.7 Å²	39.7	29%	0.287	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	145.7	175.9	-57.2	-170.8	-154.4	134.2	0	110.5	V296 E321 E322 S479	V296-K298 WeakPolarHBondContact CG1-O 3.41Å; K298-E321 CarbonylContact O-C 3.54Å; K298-E321 VanDerWaalsContact O-CA 3.24Å; K298-E321 WeakPolarHBondContact O-CA 3.5Å; K298-E322 HydrophobicContact CB-CB 4.26Å; K298-E322 HydrophobicContact CB-CG 4.36Å; K298-E322 WeakPolarHBondContact CD-OE1 3.13Å; K298-E322 VanDerWaalsContact NZ-CD 3.34Å; K298-E322 IonicContact NZ-OE1 2.89Å; K298-E322 PolarHBondContact NZ-OE1 2.72Å; K298-E322 IonicContact NZ-OE2 3.61Å; K298-E322 PolarHBondContact NZ-OE2 2.8Å; K298-E322 VanDerWaalsContact NZ-OE2 3.13Å; K298-E322 PolarHBondContact O-N 2.97Å; K298-S479 PolarHBondContact NZ-OG 3.45Å
299	A	94.4	Very high	92.4	Very high	20 Å²	20	46.6 Å²	46.6	17%	0.165	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	149.7	166.2	0	0	0	0	0	110.5	T289 V296 Y320 E321	T289-A299 HydrophobicContact CG2-CB 3.62Å; T289-A299 VanDerWaalsContact CG2-N 3.33Å; V296-A299 HydrophobicContact CG1-CB 4.04Å; A299-Y320 CarbonylContact C-O 3.46Å; A299-Y320 VanDerWaalsContact CA-O 3.25Å; A299-Y320 WeakPolarHBondContact CA-O 3.41Å; A299-E321 HydrophobicContact CB-CB 4.23Å
300	R	93.3	Very high	91.5	Very high	102 Å²	102	49.2 Å²	49.2	39%	0.385	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	148.5	171.9	62.9	-179.8	178.2	-125.8	-7.5	111	M319 Y320	R300-M319 WeakPolarHBondContact O-CA 3.21Å; R300-Y320 HydrophobicContact CG-CD1 4.29Å; R300-Y320 PolarHBondContact N-O 3.27Å; R300-Y320 PolarHBondContact O-N 3.45Å
301	T	93.4	Very high	90.6	Very high	54 Å²	54	46.5 Å²	46.5	33%	0.331	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	121.1	166.5	-52.8	0	0	0	0	108.7	V304 V317	T301-V304 HydrophobicContact CG2-CG2 4.04Å; T301-V317 HydrophobicContact CG2-CB 4.34Å
302	V	90.9	Very high	90	Very high	44 Å²	44	49.2 Å²	49.2	27%	0.267	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-47.7	177.7	179	0	0	0	0	110.1	P196 L318	P196-V302 HydrophobicContact CB-CG1 4.04Å; P196-V302 HydrophobicContact CG-CG1 4.24Å; V302-L318 HydrophobicContact CB-CB 4.39Å; V302-L318 HydrophobicContact CB-CD2 4.02Å; V302-L318 HydrophobicContact CB-CG 3.98Å; V302-L318 HydrophobicContact CG1-CD2 3.79Å; V302-L318 HydrophobicContact CG1-CG 4.3Å; V302-L318 PolarHBondContact N-O 3.25Å
303	D	91.1	Very high	89.4	Confident	40 Å²	40	49.8 Å²	49.8	21%	0.214	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154.6	176.4	-162.8	5.9	0	0	0	110.8	V199 R204 L305 L318	V199-D303 HydrophobicContact CG2-CB 4.34Å; R204-D303 IonicContact CZ-OD2 3.42Å; R204-D303 IonicContact NH2-OD2 2.88Å; R204-D303 PolarHBondContact NH2-OD2 2.96Å; D303-L305 HydrophobicContact CB-CD2 4.14Å; D303-L318 HydrophobicContact CB-CB 4.34Å; D303-L318 PolarHBondContact N-O 2.96Å; D303-L318 PolarHBondContact O-N 3.08Å
304	V	92.8	Very high	89.3	Confident	73 Å²	73	52.7 Å²	52.7	44%	0.442	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	103.8	172.2	-179.9	0	0	0	0	107.7	T301 N307 V317	T301-V304 HydrophobicContact CG2-CG2 4.04Å; V304-N307 HydrophobicContact CG1-CB 4.28Å; V304-V317 HydrophobicContact CG1-CG1 4.28Å; V304-V317 HydrophobicContact CG2-CG1 4.2Å
305	L	92	Very high	89.2	Confident	20 Å²	20	51.7 Å²	51.7	11%	0.105	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-41.3	-172.9	-54.3	-177.3	0	0	0	112.1	V199 R204 M207 D303 L316 L318 L338	V199-L305 HydrophobicContact CB-CD2 4.11Å; V199-L305 HydrophobicContact CG1-CD2 4.13Å; V199-L305 HydrophobicContact CG2-CD2 4.03Å; R204-L305 HydrophobicContact CG-CD2 4.3Å; M207-L305 HydrophobicContact CB-CD1 3.88Å; M207-L305 HydrophobicContact CG-CD1 4.38Å; M207-L305 HydrophobicContact SD-CD1 3.58Å; M207-L305 VanDerWaalsContact SD-CD1 3.58Å; M207-L305 HydrophobicContact SD-CD2 4.41Å; D303-L305 HydrophobicContact CB-CD2 4.14Å; L305-L316 HydrophobicContact CB-CB 4.39Å; L305-L316 HydrophobicContact CB-CD2 3.98Å; L305-L316 HydrophobicContact CB-CG 4.05Å; L305-L316 HydrophobicContact CD1-CD2 3.94Å; L305-L316 HydrophobicContact CD1-CG 4.09Å; L305-L316 PolarHBondContact N-O 2.88Å; L305-L318 HydrophobicContact CD1-CB 4.5Å; L305-L318 HydrophobicContact CG-CB 4.5Å; L305-L338 HydrophobicContact CD1-CD2 3.49Å; L305-L338 VanDerWaalsContact CD1-CD2 3.49Å
306	V	92.2	Very high	89.2	Confident	63 Å²	63	51.7 Å²	51.7	38%	0.382	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	123.4	175	-174.4	0	0	0	0	108.1	E314 S315 L316	V306-E314 VanDerWaalsContact CG1-O 3.23Å; V306-E314 WeakPolarHBondContact CG1-O 3.21Å; V306-S315 WeakPolarHBondContact O-CA 3.22Å; V306-L316 HydrophobicContact CB-CB 3.82Å; V306-L316 HydrophobicContact CG2-CB 3.99Å; V306-L316 HydrophobicContact CG2-CD2 4.24Å; V306-L316 PolarHBondContact N-O 3.45Å; V306-L316 PolarHBondContact O-N 2.66Å
307	N	88.9	Confident	89.1	Confident	127 Å²	127	52.1 Å²	52.1	68%	0.679	29%	0.292	S	S	*	.			trans	-97.2	100.2	174.1	-170.3	20.6	0	0	0	109.3	V304	V304-N307 HydrophobicContact CG1-CB 4.28Å
308	G	84.9	Confident	89.2	Confident	14 Å²	14	51.3 Å²	51.3	14%	0.144	29%	0.287	C	S	.	.			trans	-72.4	-174	179.6	0	0	0	0	0	113.3	A310 G311 S313 S315	G308-A310 PolarHBondContact O-N 3.43Å; G308-G311 PolarHBondContact O-N 3.26Å; G308-G311 VanDerWaalsContact O-N 3.13Å; G308-S313 WeakPolarHBondContact CA-O 3.44Å; G308-S315 VanDerWaalsContact CA-OG 3.29Å; G308-S315 WeakPolarHBondContact CA-OG 3.46Å; G308-S315 PolarHBondContact N-OG 3.24Å
309	M	79.8	Confident	89.3	Confident	147 Å²	147	48.1 Å²	48.1	72%	0.724	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-61.8	115.9	178.7	-70.1	-173.1	-67.5	0	0	110.3	G311 R312 S313	M309-G311 PolarHBondContact O-N 3.15Å; M309-R312 PolarHBondContact O-N 3Å; M309-S313 PolarHBondContact N-O 2.77Å; M309-S313 VanDerWaalsContact N-O 3.16Å
310	A	75.9	Confident	89.2	Confident	93 Å²	93	48.6 Å²	48.6	77%	0.769	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	56	26.3	-176.3	0	0	0	0	0	114.6	G308 R312	G308-A310 PolarHBondContact O-N 3.43Å; A310-R312 PolarHBondContact O-N 2.86Å
311	G	74.7	Confident	89.2	Confident	26 Å²	26	43.7 Å²	43.7	27%	0.268	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	71.3	15.7	-176.4	0	0	0	0	0	114.3	G308 M309 S315	G308-G311 PolarHBondContact O-N 3.26Å; G308-G311 VanDerWaalsContact O-N 3.13Å; M309-G311 PolarHBondContact O-N 3.15Å; G311-S315 WeakPolarHBondContact CA-OG 3.39Å; G311-S315 PolarHBondContact O-OG 2.87Å
312	R	80.1	Confident	89.2	Confident	81 Å²	81	41.4 Å²	41.4	31%	0.306	24%	0.237	S	C	.	.	S	Bend	trans	-108.3	-102.4	-178.7	-59.7	171.8	179.4	166.9	-3.3	111.1	V279 D280 M309 A310 E314 S315 W349	V279-R312 HydrophobicContact CG1-CB 4.29Å; V279-R312 HydrophobicContact CG1-CG 4.29Å; D280-R312 IonicContact OD1-CZ 3.42Å; D280-R312 IonicContact OD1-NE 2.71Å; D280-R312 PolarHBondContact OD1-NE 2.88Å; D280-R312 IonicContact OD1-NH2 3.32Å; D280-R312 PolarHBondContact OD1-NH2 2.84Å; D280-R312 IonicContact OD2-CZ 3.54Å; D280-R312 IonicContact OD2-NE 3.63Å; D280-R312 IonicContact OD2-NH2 2.72Å; D280-R312 PolarHBondContact OD2-NH2 3.29Å; M309-R312 PolarHBondContact O-N 3Å; A310-R312 PolarHBondContact O-N 2.86Å; R312-E314 PolarHBondContact O-N 2.83Å; R312-S315 PolarHBondContact N-OG 3.06Å; R312-S315 VanDerWaalsContact N-OG 3.12Å; R312-S315 WeakPolarHBondContact O-CB 3.47Å; R312-S315 PolarHBondContact O-N 2.85Å; R312-S315 VanDerWaalsContact O-N 3.08Å; R312-S315 PolarHBondContact O-OG 3.29Å; R312-W349 HydrophobicContact CB-CH2 4.04Å; R312-W349 HydrophobicContact CB-CZ3 3.92Å
313	S	85.8	Confident	89.3	Confident	12 Å²	12	39.3 Å²	39.3	8%	0.084	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	134.5	-175.3	-168.4	0	0	0	0	111.4	G308 M309 S315 Q343	G308-S313 WeakPolarHBondContact CA-O 3.44Å; M309-S313 PolarHBondContact N-O 2.77Å; M309-S313 VanDerWaalsContact N-O 3.16Å; S313-S315 VanDerWaalsContact C-N 3.25Å; S313-Q343 WeakPolarHBondContact OG-CB 3.48Å; S313-Q343 PolarHBondContact OG-N 2.97Å; S313-Q343 VanDerWaalsContact OG-N 3.17Å
314	E	91.5	Very high	89.5	Confident	79 Å²	79	37.4 Å²	37.4	37%	0.369	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	23.9	-175.9	-54	-62	149.5	0	0	113.4	V306 R312 Y340 C341 R342	V306-E314 VanDerWaalsContact CG1-O 3.23Å; V306-E314 WeakPolarHBondContact CG1-O 3.21Å; R312-E314 PolarHBondContact O-N 2.83Å; E314-Y340 PolarHBondContact OE2-OH 3.3Å; E314-C341 WeakPolarHBondContact CA-O 3.45Å; E314-C341 PolarHBondContact N-O 2.73Å; E314-R342 WeakPolarHBondContact OE1-CG 3.42Å; E314-R342 IonicContact OE1-NE 3.13Å; E314-R342 PolarHBondContact OE1-NE 3.48Å
315	S	94.8	Very high	89.5	Confident	3 Å²	3	34 Å²	34	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.9	176	-51.9	0	0	0	0	110.9	V306 G308 G311 R312 S313 Y340 C341	V306-S315 WeakPolarHBondContact O-CA 3.22Å; G308-S315 VanDerWaalsContact CA-OG 3.29Å; G308-S315 WeakPolarHBondContact CA-OG 3.46Å; G308-S315 PolarHBondContact N-OG 3.24Å; G311-S315 WeakPolarHBondContact CA-OG 3.39Å; G311-S315 PolarHBondContact O-OG 2.87Å; R312-S315 PolarHBondContact N-OG 3.06Å; R312-S315 VanDerWaalsContact N-OG 3.12Å; R312-S315 WeakPolarHBondContact O-CB 3.47Å; R312-S315 PolarHBondContact O-N 2.85Å; R312-S315 VanDerWaalsContact O-N 3.08Å; R312-S315 PolarHBondContact O-OG 3.29Å; S313-S315 VanDerWaalsContact C-N 3.25Å; S315-Y340 WeakPolarHBondContact O-CA 3.31Å; S315-Y340 WeakPolarHBondContact O-CD2 3.35Å; S315-C341 PolarHBondContact N-O 3.14Å; S315-C341 PolarHBondContact O-N 3Å
316	L	95.9	Very high	89.6	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.1	-179.5	-178.7	66.2	0	0	0	109.2	A208 A211 L305 V306 L338 Y340	A208-L316 HydrophobicContact CB-CD2 4.03Å; A211-L316 HydrophobicContact CB-CD1 3.51Å; A211-L316 HydrophobicContact CB-CD2 4.3Å; L305-L316 HydrophobicContact CB-CB 4.39Å; L305-L316 HydrophobicContact CB-CD2 3.98Å; L305-L316 HydrophobicContact CB-CG 4.05Å; L305-L316 HydrophobicContact CD1-CD2 3.94Å; L305-L316 HydrophobicContact CD1-CG 4.09Å; L305-L316 PolarHBondContact N-O 2.88Å; V306-L316 HydrophobicContact CB-CB 3.82Å; V306-L316 HydrophobicContact CG2-CB 3.99Å; V306-L316 HydrophobicContact CG2-CD2 4.24Å; V306-L316 PolarHBondContact N-O 3.45Å; V306-L316 PolarHBondContact O-N 2.66Å; L316-L338 HydrophobicContact CD1-CB 4.06Å; L316-Y340 HydrophobicContact CB-CD2 4.31Å; L316-Y340 HydrophobicContact CD1-CD2 4.29Å; L316-Y340 HydrophobicContact CD1-CG 4.25Å
317	V	94.9	Very high	89.6	Confident	10 Å²	10	30.2 Å²	30.2	6%	0.061	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.4	179.7	-62	0	0	0	0	110.3	M283 T301 V304 M319 L338 R339	M283-V317 HydrophobicContact CE-CG1 4.15Å; M283-V317 HydrophobicContact CE-CG2 3.77Å; T301-V317 HydrophobicContact CG2-CB 4.34Å; V304-V317 HydrophobicContact CG1-CG1 4.28Å; V304-V317 HydrophobicContact CG2-CG1 4.2Å; V317-M319 HydrophobicContact CB-CG 4.38Å; V317-M319 HydrophobicContact CG2-CG 3.75Å; V317-M319 HydrophobicContact CG2-SD 3.7Å; V317-L338 CarbonylContact O-C 3.6Å; V317-L338 WeakPolarHBondContact O-CA 3.23Å; V317-R339 HydrophobicContact CG2-CB 3.81Å; V317-R339 HydrophobicContact CG2-CG 4.37Å; V317-R339 PolarHBondContact N-O 3.35Å; V317-R339 PolarHBondContact O-N 2.68Å
318	L	94.7	Very high	89.6	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.1	167.5	179.9	67.5	0	0	0	107.8	V199 V302 D303 L305 L338 V356	V199-L318 HydrophobicContact CG2-CD2 3.65Å; V302-L318 HydrophobicContact CB-CB 4.39Å; V302-L318 HydrophobicContact CB-CD2 4.02Å; V302-L318 HydrophobicContact CB-CG 3.98Å; V302-L318 HydrophobicContact CG1-CD2 3.79Å; V302-L318 HydrophobicContact CG1-CG 4.3Å; V302-L318 PolarHBondContact N-O 3.25Å; D303-L318 HydrophobicContact CB-CB 4.34Å; D303-L318 PolarHBondContact N-O 2.96Å; D303-L318 PolarHBondContact O-N 3.08Å; L305-L318 HydrophobicContact CD1-CB 4.5Å; L305-L318 HydrophobicContact CG-CB 4.5Å; L318-L338 HydrophobicContact CB-CD2 4.31Å; L318-L338 HydrophobicContact CD1-CD2 3.85Å; L318-V356 HydrophobicContact CD1-CG2 4.08Å
319	M	93.1	Very high	89.8	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	152.1	-175.6	-66	-175.7	72.9	0	0	111.5	R300 V317 C336 F337 R339	R300-M319 WeakPolarHBondContact O-CA 3.21Å; V317-M319 HydrophobicContact CB-CG 4.38Å; V317-M319 HydrophobicContact CG2-CG 3.75Å; V317-M319 HydrophobicContact CG2-SD 3.7Å; M319-C336 WeakPolarHBondContact O-CA 3.4Å; M319-F337 HydrophobicContact CB-CE1 4Å; M319-F337 HydrophobicContact CB-CE2 4.23Å; M319-F337 HydrophobicContact CB-CZ 3.86Å; M319-F337 PolarHBondContact N-O 3.4Å; M319-F337 PolarHBondContact O-N 3.4Å; M319-R339 HydrophobicContact SD-CB 4Å
320	Y	92.2	Very high	90.3	Very high	29 Å²	29	17.7 Å²	17.7	11%	0.114	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.7	167.1	172.4	-92.8	0	0	0	108.7	A299 R300 E322 E334 F335	A299-Y320 CarbonylContact C-O 3.46Å; A299-Y320 VanDerWaalsContact CA-O 3.25Å; A299-Y320 WeakPolarHBondContact CA-O 3.41Å; R300-Y320 HydrophobicContact CG-CD1 4.29Å; R300-Y320 PolarHBondContact N-O 3.27Å; R300-Y320 PolarHBondContact O-N 3.45Å; Y320-E322 HydrophobicContact CE1-CG 3.84Å; Y320-E322 WeakPolarHBondContact OH-CG 3.44Å; Y320-E322 PolarHBondContact OH-OE1 3.39Å; Y320-E334 HydrophobicContact CE2-CB 4.26Å; Y320-E334 PolarHBondContact OH-OE2 3Å; Y320-F335 CarbonylContact C-O 3.53Å; Y320-F335 VanDerWaalsContact CA-O 3.31Å; Y320-F335 WeakPolarHBondContact CA-O 3.39Å
321	E	93.1	Very high	90.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.1	173	79.9	-173.1	173.5	0	0	112.9	W288 K298 A299 L323 E334 F335 F337 R374	W288-E321 PolarHBondContact NE1-OE2 3.19Å; K298-E321 CarbonylContact O-C 3.54Å; K298-E321 VanDerWaalsContact O-CA 3.24Å; K298-E321 WeakPolarHBondContact O-CA 3.5Å; A299-E321 HydrophobicContact CB-CB 4.23Å; E321-L323 HydrophobicContact CG-CD2 4.02Å; E321-L323 HydrophobicContact CG-CG 4.38Å; E321-E334 WeakPolarHBondContact O-CA 3.42Å; E321-F335 HydrophobicContact CG-CB 4.23Å; E321-F335 HydrophobicContact CG-CD2 4.33Å; E321-F335 PolarHBondContact N-O 3.4Å; E321-F335 PolarHBondContact O-N 2.83Å; E321-F337 HydrophobicContact CB-CE1 4Å; E321-F337 VanDerWaalsContact CD-CE1 3.44Å; E321-F337 HydrophobicContact CG-CD1 4.4Å; E321-F337 HydrophobicContact CG-CE1 3.55Å; E321-F337 HydrophobicContact CG-CZ 4.25Å; E321-R374 IonicContact OE1-CZ 2.92Å; E321-R374 IonicContact OE1-NE 3.61Å; E321-R374 IonicContact OE1-NH2 3.75Å; E321-R374 PolarHBondContact OE1-NH2 2.83Å
322	E	93.1	Very high	91.6	Very high	5 Å²	5	15.9 Å²	15.9	2%	0.023	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121	169.3	-66.8	-179.9	-142.1	0	0	108.5	S297 K298 Y320 R333 E334 S479	S297-E322 PolarHBondContact N-O 3.07Å; S297-E322 WeakPolarHBondContact OG-CB 3.39Å; S297-E322 PolarHBondContact OG-O 3.29Å; K298-E322 HydrophobicContact CB-CB 4.26Å; K298-E322 HydrophobicContact CB-CG 4.36Å; K298-E322 WeakPolarHBondContact CD-OE1 3.13Å; K298-E322 VanDerWaalsContact NZ-CD 3.34Å; K298-E322 IonicContact NZ-OE1 2.89Å; K298-E322 PolarHBondContact NZ-OE1 2.72Å; K298-E322 IonicContact NZ-OE2 3.61Å; K298-E322 PolarHBondContact NZ-OE2 2.8Å; K298-E322 VanDerWaalsContact NZ-OE2 3.13Å; K298-E322 PolarHBondContact O-N 2.97Å; Y320-E322 HydrophobicContact CE1-CG 3.84Å; Y320-E322 WeakPolarHBondContact OH-CG 3.44Å; Y320-E322 PolarHBondContact OH-OE1 3.39Å; E322-R333 CarbonylContact C-O 3.52Å; E322-R333 WeakPolarHBondContact CA-O 3.3Å; E322-E334 HydrophobicContact CG-CG 4.15Å; E322-S479 WeakPolarHBondContact OE2-CB 3.4Å; E322-S479 PolarHBondContact OE2-OG 2.82Å
323	L	94.6	Very high	92.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	137.5	174.6	-53.9	-172.7	0	0	0	110.5	I295 V296 E321 T332 R333 F335 F419 W424	I295-L323 HydrophobicContact CG2-CD2 4.44Å; I295-L323 CarbonylContact O-C 3.57Å; I295-L323 VanDerWaalsContact O-CA 3.25Å; I295-L323 WeakPolarHBondContact O-CA 3.32Å; V296-L323 HydrophobicContact CG2-CD2 3.94Å; E321-L323 HydrophobicContact CG-CD2 4.02Å; E321-L323 HydrophobicContact CG-CG 4.38Å; L323-T332 CarbonylContact O-C 3.6Å; L323-T332 VanDerWaalsContact O-CA 3.25Å; L323-T332 WeakPolarHBondContact O-CA 3.32Å; L323-T332 WeakPolarHBondContact O-CB 3.4Å; L323-R333 HydrophobicContact CB-CB 4.39Å; L323-R333 PolarHBondContact N-O 3.28Å; L323-R333 PolarHBondContact O-N 3.1Å; L323-F335 HydrophobicContact CB-CE2 4.44Å; L323-F335 HydrophobicContact CD1-CD2 4.1Å; L323-F335 HydrophobicContact CD1-CE2 3.58Å; L323-F335 HydrophobicContact CD1-CZ 4.44Å; L323-F335 HydrophobicContact CG-CD2 4.05Å; L323-F335 HydrophobicContact CG-CE2 3.85Å; L323-F419 HydrophobicContact CB-CD1 4.24Å; L323-F419 HydrophobicContact CB-CE1 4.04Å; L323-W424 HydrophobicContact CD1-CZ2 4.06Å; L323-W424 HydrophobicContact CD2-CH2 3.93Å; L323-W424 HydrophobicContact CD2-CZ2 3.88Å
324	H	93.8	Very high	92.2	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.075	C	C	.	.			trans	-129.6	155.5	179.9	72.9	174.8	0	0	0	113.8	P293 A294 I295 T332 R423 C473	P293-H324 PolarHBondContact O-CE1 2.85Å; P293-H324 PolarHBondContact O-NE2 3.15Å; A294-H324 PolarHBondContact O-CD2 2.97Å; A294-H324 VanDerWaalsContact O-CD2 3.32Å; A294-H324 PolarHBondContact O-NE2 3.14Å; I295-H324 PolarHBondContact O-CD2 2.82Å; I295-H324 VanDerWaalsContact O-CD2 3.32Å; I295-H324 PolarHBondContact O-N 3.38Å; H324-T332 HydrophobicContact CB-CG2 3.96Å; H324-R423 PolarHBondContact O-NH1 2.83Å; H324-R423 VanDerWaalsContact O-NH1 3.11Å; H324-C473 PolarHBondContact CE1-O 3.24Å; H324-C473 VanDerWaalsContact CE1-O 3.29Å
325	V	94.1	Very high	92.2	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.006	6%	0.058	C	C	.	.			trans	-94.6	144	154.6	178.1	0	0	0	0	106.3	S327 V330 Y409 A418 F419 L626	V325-S327 PolarHBondContact O-N 2.99Å; V325-V330 HydrophobicContact CB-CB 4.01Å; V325-V330 HydrophobicContact CB-CG1 3.93Å; V325-V330 HydrophobicContact CB-CG2 4.18Å; V325-V330 HydrophobicContact CG1-CG2 4.32Å; V325-V330 HydrophobicContact CG2-CG1 3.92Å; V325-Y409 HydrophobicContact CG1-CD1 4.15Å; V325-Y409 HydrophobicContact CG1-CE1 4.12Å; V325-A418 HydrophobicContact CG2-CB 3.76Å; V325-F419 HydrophobicContact CG2-CE1 4.22Å; V325-F419 HydrophobicContact CG2-CE2 3.86Å; V325-F419 HydrophobicContact CG2-CZ 3.6Å; V325-L626 HydrophobicContact CG1-CD1 3.75Å
326	M	93.1	Very high	92	Very high	5 Å²	5	11.2 Å²	11.2	3%	0.025	6%	0.062	C	C	.	.	S	Bend	trans	-72.6	60.6	-176.5	-71.6	-69.8	-67.9	0	0	112.4	A294 F472 C473 L476 L593 T624 T655	A294-M326 HydrophobicContact CB-CG 4.14Å; A294-M326 HydrophobicContact CB-SD 4.33Å; M326-F472 HydrophobicContact CE-CD1 3.96Å; M326-F472 HydrophobicContact CE-CE1 3.93Å; M326-C473 HydrophobicContact CE-CB 3.85Å; M326-C473 WeakPolarHBondContact CE-SG 3.46Å; M326-C473 HydrophobicContact SD-CB 3.75Å; M326-L476 HydrophobicContact CE-CD1 3.77Å; M326-L593 HydrophobicContact CE-CD1 4Å; M326-T624 HydrophobicContact CB-CG2 3.76Å; M326-T624 HydrophobicContact CE-CG2 3.64Å; M326-T624 PolarHBondContact O-OG1 3.3Å; M326-T655 PolarHBondContact O-OG1 3.34Å
327	S	92.7	Very high	91.9	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	S	Bend	trans	-160.3	137.3	-177	177	0	0	0	0	111.6	V325 V329 V330 Y409 S518	V325-S327 PolarHBondContact O-N 2.99Å; S327-V329 PolarHBondContact O-N 2.81Å; S327-V329 VanDerWaalsContact OG-CG2 3.24Å; S327-V329 WeakPolarHBondContact OG-CG2 3.24Å; S327-V329 PolarHBondContact OG-N 2.87Å; S327-V330 PolarHBondContact O-N 2.95Å; S327-Y409 VanDerWaalsContact CB-CZ 3.46Å; S327-Y409 VanDerWaalsContact CB-OH 3.32Å; S327-Y409 WeakPolarHBondContact CB-OH 3.28Å; S327-Y409 VanDerWaalsContact OG-CE2 3.24Å; S327-Y409 WeakPolarHBondContact OG-CE2 3.16Å; S327-Y409 PolarHBondContact OG-OH 2.78Å; S327-S518 PolarHBondContact OG-OG 3Å
328	P	89.4	Confident	92	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.006	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-3.5	-179.2	36	-40.8	0	0	0	114	W484 R496 A516	P328-W484 HydrophobicContact CB-CD2 3.75Å; P328-W484 HydrophobicContact CB-CE3 4.03Å; P328-W484 HydrophobicContact CB-CG 4.26Å; P328-W484 HydrophobicContact CB-CH2 4.05Å; P328-W484 HydrophobicContact CB-CZ2 3.77Å; P328-W484 HydrophobicContact CB-CZ3 4.18Å; P328-R496 HydrophobicContact CB-CB 4.32Å; P328-R496 HydrophobicContact CG-CB 4.35Å; P328-R496 PolarHBondContact O-NH1 3.25Å; P328-R496 VanDerWaalsContact O-NH1 3.1Å; P328-A516 HydrophobicContact CB-CB 4.5Å; P328-A516 HydrophobicContact CG-CB 3.84Å
329	V	88.8	Confident	92.1	Very high	19 Å²	19	10.7 Å²	10.7	12%	0.115	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-9.8	178.4	-58.2	0	0	0	0	113.3	S327 H406 Y409	S327-V329 PolarHBondContact O-N 2.81Å; S327-V329 VanDerWaalsContact OG-CG2 3.24Å; S327-V329 WeakPolarHBondContact OG-CG2 3.24Å; S327-V329 PolarHBondContact OG-N 2.87Å; V329-H406 HydrophobicContact CB-CB 4.19Å; V329-H406 HydrophobicContact CG2-CB 4.06Å; V329-Y409 HydrophobicContact CG2-CD2 3.43Å; V329-Y409 VanDerWaalsContact CG2-CD2 3.43Å; V329-Y409 HydrophobicContact CG2-CE2 3.34Å
330	V	89.9	Confident	92.4	Very high	4 Å²	4	11.5 Å²	11.5	2%	0.024	6%	0.061	C	C	.	.	S	Bend	trans	-103.9	116.3	178.6	-177.4	0	0	0	0	108.7	V325 S327 Y409 I413 A478	V325-V330 HydrophobicContact CB-CB 4.01Å; V325-V330 HydrophobicContact CB-CG1 3.93Å; V325-V330 HydrophobicContact CB-CG2 4.18Å; V325-V330 HydrophobicContact CG1-CG2 4.32Å; V325-V330 HydrophobicContact CG2-CG1 3.92Å; S327-V330 PolarHBondContact O-N 2.95Å; V330-Y409 HydrophobicContact CG2-CD1 4.06Å; V330-Y409 HydrophobicContact CG2-CD2 3.71Å; V330-Y409 HydrophobicContact CG2-CE2 4.35Å; V330-Y409 HydrophobicContact CG2-CG 3.55Å; V330-I413 HydrophobicContact CG1-CD1 3.7Å; V330-I413 HydrophobicContact CG2-CD1 4.17Å; V330-A478 WeakPolarHBondContact O-CB 3.15Å
331	P	88.2	Confident	92.6	Very high	68 Å²	68	10.1 Å²	10.1	44%	0.442	6%	0.056	S	C	.	.	B	Isolated β-bridge	trans	-64.9	149.7	178	27.9	-34	0	0	0	111.3
332	T	89.9	Confident	92.7	Very high	14 Å²	14	14.1 Å²	14.1	9%	0.086	7%	0.071	C	C	.	.	P	Polyproline II helix	trans	-69.2	146.9	175.5	52.2	0	0	0	0	111.8	L323 H324 S477	L323-T332 CarbonylContact O-C 3.6Å; L323-T332 VanDerWaalsContact O-CA 3.25Å; L323-T332 WeakPolarHBondContact O-CA 3.32Å; L323-T332 WeakPolarHBondContact O-CB 3.4Å; H324-T332 HydrophobicContact CB-CG2 3.96Å; T332-S477 WeakPolarHBondContact CG2-OG 3.39Å
333	R	90.7	Very high	92.8	Very high	17 Å²	17	17.1 Å²	17.1	6%	0.064	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	125.7	167.7	-63.6	179.2	176.4	-177.6	-3.1	108.4	E263 E322 L323 F335 M397 F419	E263-R333 IonicContact OE1-CZ 2.78Å; E263-R333 IonicContact OE1-NH1 3.52Å; E263-R333 IonicContact OE1-NH2 3.57Å; E263-R333 PolarHBondContact OE1-NH2 3.12Å; E263-R333 IonicContact OE2-CZ 2.7Å; E263-R333 IonicContact OE2-NH1 2.77Å; E263-R333 PolarHBondContact OE2-NH1 3.03Å; E263-R333 IonicContact OE2-NH2 3.56Å; E263-R333 PolarHBondContact OE2-NH2 3.44Å; E322-R333 CarbonylContact C-O 3.52Å; E322-R333 WeakPolarHBondContact CA-O 3.3Å; L323-R333 HydrophobicContact CB-CB 4.39Å; L323-R333 PolarHBondContact N-O 3.28Å; L323-R333 PolarHBondContact O-N 3.1Å; R333-F335 HydrophobicContact CB-CD2 4.44Å; R333-F335 HydrophobicContact CB-CE2 3.51Å; R333-F335 HydrophobicContact CB-CZ 3.93Å; R333-M397 PolarHBondContact NH1-SD 3.27Å; R333-F419 HydrophobicContact CG-CE1 4.45Å; R333-F419 HydrophobicContact CG-CZ 4.22Å; R333-F419 VanDerWaalsContact CZ-CE2 3.48Å
334	E	88.5	Confident	92.8	Very high	43 Å²	43	20.3 Å²	20.3	20%	0.201	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.9	-178.4	-50.5	-166.9	177.4	0	0	110.1	Y320 E321 E322	Y320-E334 HydrophobicContact CE2-CB 4.26Å; Y320-E334 PolarHBondContact OH-OE2 3Å; E321-E334 WeakPolarHBondContact O-CA 3.42Å; E322-E334 HydrophobicContact CG-CG 4.15Å
335	F	90.5	Very high	92.8	Very high	1 Å²	1	26.5 Å²	26.5	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.7	-179.9	-59	-88.5	0	0	0	110.7	Y320 E321 L323 R333 F337 S372 R374 M397	Y320-F335 CarbonylContact C-O 3.53Å; Y320-F335 VanDerWaalsContact CA-O 3.31Å; Y320-F335 WeakPolarHBondContact CA-O 3.39Å; E321-F335 HydrophobicContact CG-CB 4.23Å; E321-F335 HydrophobicContact CG-CD2 4.33Å; E321-F335 PolarHBondContact N-O 3.4Å; E321-F335 PolarHBondContact O-N 2.83Å; L323-F335 HydrophobicContact CB-CE2 4.44Å; L323-F335 HydrophobicContact CD1-CD2 4.1Å; L323-F335 HydrophobicContact CD1-CE2 3.58Å; L323-F335 HydrophobicContact CD1-CZ 4.44Å; L323-F335 HydrophobicContact CG-CD2 4.05Å; L323-F335 HydrophobicContact CG-CE2 3.85Å; R333-F335 HydrophobicContact CB-CD2 4.44Å; R333-F335 HydrophobicContact CB-CE2 3.51Å; R333-F335 HydrophobicContact CB-CZ 3.93Å; F335-F337 HydrophobicContact CB-CD1 3.91Å; F335-F337 HydrophobicContact CB-CE1 4.49Å; F335-S372 VanDerWaalsContact CE1-CB 3.47Å; F335-R374 HydrophobicContact CD1-CB 3.87Å; F335-R374 HydrophobicContact CE1-CB 4.24Å; F335-M397 HydrophobicContact CZ-SD 4.27Å
336	C	90.9	Very high	92.7	Very high	16 Å²	16	38.1 Å²	38.1	11%	0.108	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.5	160.4	-167.4	0	0	0	0	107.8	M319 S355 V356 L358	M319-C336 WeakPolarHBondContact O-CA 3.4Å; C336-S355 WeakPolarHBondContact O-CA 3.25Å; C336-S355 PolarHBondContact O-OG 2.9Å; C336-V356 PolarHBondContact O-N 2.83Å; C336-L358 HydrophobicContact CB-CD1 4.35Å
337	F	94.5	Very high	92.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	155	-169	66.6	-79.8	0	0	0	112.4	M319 E321 F335 R339 D353 I354	M319-F337 HydrophobicContact CB-CE1 4Å; M319-F337 HydrophobicContact CB-CE2 4.23Å; M319-F337 HydrophobicContact CB-CZ 3.86Å; M319-F337 PolarHBondContact N-O 3.4Å; M319-F337 PolarHBondContact O-N 3.4Å; E321-F337 HydrophobicContact CB-CE1 4Å; E321-F337 VanDerWaalsContact CD-CE1 3.44Å; E321-F337 HydrophobicContact CG-CD1 4.4Å; E321-F337 HydrophobicContact CG-CE1 3.55Å; E321-F337 HydrophobicContact CG-CZ 4.25Å; F335-F337 HydrophobicContact CB-CD1 3.91Å; F335-F337 HydrophobicContact CB-CE1 4.49Å; F337-R339 HydrophobicContact CD2-CB 4.42Å; F337-R339 HydrophobicContact CE2-CB 4.06Å; F337-D353 HydrophobicContact CD2-CB 3.74Å; F337-D353 HydrophobicContact CE2-CB 4.05Å; F337-D353 VanDerWaalsContact CE2-CG 3.45Å; F337-D353 WeakPolarHBondContact CE2-OD2 3.34Å; F337-I354 CarbonylContact C-O 3.58Å; F337-I354 VanDerWaalsContact CA-O 3.27Å; F337-I354 WeakPolarHBondContact CA-O 3.39Å; F337-I354 WeakPolarHBondContact CB-O 3.32Å
338	L	96.6	Very high	92.9	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.8	168.1	-59.2	175.5	0	0	0	108.7	M207 M210 A211 L305 L316 V317 L318 D353 I354 V356	M207-L338 HydrophobicContact CB-CD1 3.7Å; M207-L338 HydrophobicContact CB-CD2 4.16Å; M207-L338 HydrophobicContact CG-CD1 4.18Å; M207-L338 HydrophobicContact CG-CD2 4.33Å; M207-L338 VanDerWaalsContact O-CD1 3.24Å; M207-L338 WeakPolarHBondContact O-CD1 3.34Å; M207-L338 HydrophobicContact SD-CD2 4.16Å; M210-L338 HydrophobicContact SD-CD1 4.48Å; A211-L338 HydrophobicContact CB-CD1 4.23Å; L305-L338 HydrophobicContact CD1-CD2 3.49Å; L305-L338 VanDerWaalsContact CD1-CD2 3.49Å; L316-L338 HydrophobicContact CD1-CB 4.06Å; V317-L338 CarbonylContact O-C 3.6Å; V317-L338 WeakPolarHBondContact O-CA 3.23Å; L318-L338 HydrophobicContact CB-CD2 4.31Å; L318-L338 HydrophobicContact CD1-CD2 3.85Å; L338-D353 CarbonylContact O-C 3.6Å; L338-D353 WeakPolarHBondContact O-CA 3.45Å; L338-I354 HydrophobicContact CB-CG2 3.93Å; L338-I354 HydrophobicContact CD1-CG2 4.26Å; L338-I354 HydrophobicContact CG-CG2 4.49Å; L338-I354 PolarHBondContact N-O 2.65Å; L338-I354 PolarHBondContact O-N 2.91Å; L338-V356 HydrophobicContact CD1-CG2 3.94Å; L338-V356 HydrophobicContact CD2-CG2 3.85Å; L338-V356 HydrophobicContact CG-CG2 3.48Å; L338-V356 VanDerWaalsContact CG-CG2 3.48Å
339	R	97.3	Very high	93.3	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.6	167.4	175.7	165	-70.2	171.1	3.5	109.3	F282 M283 V317 M319 F337 I351 A352 D353	F282-R339 PolarHBondContact O-NH1 3.42Å; M283-R339 HydrophobicContact CE-CG 4.35Å; M283-R339 HydrophobicContact SD-CG 3.79Å; V317-R339 HydrophobicContact CG2-CB 3.81Å; V317-R339 HydrophobicContact CG2-CG 4.37Å; V317-R339 PolarHBondContact N-O 3.35Å; V317-R339 PolarHBondContact O-N 2.68Å; M319-R339 HydrophobicContact SD-CB 4Å; F337-R339 HydrophobicContact CD2-CB 4.42Å; F337-R339 HydrophobicContact CE2-CB 4.06Å; R339-I351 HydrophobicContact CG-CG2 3.68Å; R339-A352 WeakPolarHBondContact CA-O 3.5Å; R339-D353 WeakPolarHBondContact CA-OD1 3.47Å; R339-D353 WeakPolarHBondContact CB-OD1 3.19Å; R339-D353 WeakPolarHBondContact CG-OD1 3.18Å; R339-D353 IonicContact CZ-OD1 3.78Å; R339-D353 IonicContact CZ-OD2 3.84Å; R339-D353 IonicContact NE-OD1 3.51Å; R339-D353 PolarHBondContact NE-OD1 3.48Å; R339-D353 IonicContact NE-OD2 3.67Å; R339-D353 PolarHBondContact NE-OD2 3.21Å; R339-D353 IonicContact NH2-OD1 3.51Å; R339-D353 IonicContact NH2-OD2 3.74Å; R339-D353 PolarHBondContact NH2-OD2 3.07Å
340	Y	97.5	Very high	93.7	Very high	16 Å²	16	39.6 Å²	39.6	6%	0.063	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.8	-177.4	-179.3	-141.3	0	0	0	110.7	A211 M215 E314 S315 L316 I351 A352	A211-Y340 HydrophobicContact CB-CD1 4.21Å; A211-Y340 HydrophobicContact CB-CG 4.16Å; M215-Y340 HydrophobicContact CB-CD1 3.79Å; M215-Y340 HydrophobicContact CB-CE1 3.9Å; M215-Y340 HydrophobicContact CE-CD1 3.52Å; M215-Y340 HydrophobicContact CE-CE1 3.94Å; M215-Y340 HydrophobicContact CE-CG 4.04Å; M215-Y340 WeakPolarHBondContact CE-O 3.36Å; M215-Y340 HydrophobicContact CG-CD1 4.22Å; M215-Y340 HydrophobicContact CG-CE1 4.05Å; E314-Y340 PolarHBondContact OE2-OH 3.3Å; S315-Y340 WeakPolarHBondContact O-CA 3.31Å; S315-Y340 WeakPolarHBondContact O-CD2 3.35Å; L316-Y340 HydrophobicContact CB-CD2 4.31Å; L316-Y340 HydrophobicContact CD1-CD2 4.29Å; L316-Y340 HydrophobicContact CD1-CG 4.25Å; Y340-I351 CarbonylContact O-C 3.54Å; Y340-I351 WeakPolarHBondContact O-CA 3.44Å; Y340-A352 PolarHBondContact N-O 3.38Å; Y340-A352 PolarHBondContact O-N 2.76Å
341	C	97.3	Very high	94.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.4	178.2	-179.4	0	0	0	0	111	V279 M283 E314 S315 I351	V279-C341 WeakPolarHBondContact CG1-SG 3.47Å; M283-C341 HydrophobicContact CE-CB 4.08Å; M283-C341 HydrophobicContact CG-CB 4.28Å; M283-C341 HydrophobicContact SD-CB 3.68Å; E314-C341 WeakPolarHBondContact CA-O 3.45Å; E314-C341 PolarHBondContact N-O 2.73Å; S315-C341 PolarHBondContact N-O 3.14Å; S315-C341 PolarHBondContact O-N 3Å; C341-I351 HydrophobicContact CB-CG1 4.18Å
342	R	95.3	Very high	94.6	Very high	84 Å²	84	36.4 Å²	36.4	32%	0.317	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.9	178.8	-175.6	169.9	-174.7	-162.6	-2.5	111.3	M215 E314 A350	M215-R342 HydrophobicContact CE-CB 3.78Å; M215-R342 HydrophobicContact SD-CB 4.36Å; E314-R342 WeakPolarHBondContact OE1-CG 3.42Å; E314-R342 IonicContact OE1-NE 3.13Å; E314-R342 PolarHBondContact OE1-NE 3.48Å; R342-A350 PolarHBondContact N-O 3.33Å; R342-A350 PolarHBondContact O-N 2.7Å
343	Q	95.8	Very high	95	Very high	68 Å²	68	36 Å²	36	32%	0.318	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	112.8	164.9	-170.6	170.9	13.5	0	0	108.7	S313 E345 W349	S313-Q343 WeakPolarHBondContact OG-CB 3.48Å; S313-Q343 PolarHBondContact OG-N 2.97Å; S313-Q343 VanDerWaalsContact OG-N 3.17Å; Q343-E345 WeakPolarHBondContact CG-O 3.45Å; Q343-E345 PolarHBondContact NE2-O 3.29Å; Q343-E345 VanDerWaalsContact NE2-O 3.12Å; Q343-W349 HydrophobicContact CB-CD2 4.05Å; Q343-W349 HydrophobicContact CB-CE3 3.77Å; Q343-W349 HydrophobicContact CB-CH2 3.89Å; Q343-W349 HydrophobicContact CB-CZ2 4.15Å; Q343-W349 HydrophobicContact CB-CZ3 3.71Å; Q343-W349 VanDerWaalsContact CD-CZ2 3.46Å; Q343-W349 HydrophobicContact CG-CD2 4.06Å; Q343-W349 HydrophobicContact CG-CE3 4.3Å; Q343-W349 HydrophobicContact CG-CH2 4.2Å; Q343-W349 HydrophobicContact CG-CZ2 3.95Å; Q343-W349 HydrophobicContact CG-CZ3 4.38Å
344	I	94.5	Very high	95.3	Very high	68 Å²	68	36 Å²	36	35%	0.349	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-49.9	179.7	-61.9	175.3	0	0	0	109.4	I219 L348 A350 L380	I219-I344 HydrophobicContact CD1-CD1 3.71Å; I219-I344 HydrophobicContact CD1-CG1 4.32Å; I219-I344 HydrophobicContact CG1-CD1 4.02Å; I344-L348 HydrophobicContact CB-CD2 4.05Å; I344-L348 HydrophobicContact CB-CG 4.14Å; I344-L348 HydrophobicContact CD1-CD2 4.17Å; I344-L348 HydrophobicContact CD1-CG 4.25Å; I344-L348 HydrophobicContact CG2-CD2 4.02Å; I344-L348 PolarHBondContact N-O 3.43Å; I344-A350 HydrophobicContact CD1-CB 3.88Å; I344-A350 HydrophobicContact CG1-CB 4.26Å; I344-L380 HydrophobicContact CD1-CD2 4.19Å
345	E	93.7	Very high	95.4	Very high	130 Å²	130	34.7 Å²	34.7	61%	0.607	16%	0.157	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-150.9	-178.6	175.9	59.1	177.1	-177	0	0	110.3	Q343 G347 L348	Q343-E345 WeakPolarHBondContact CG-O 3.45Å; Q343-E345 PolarHBondContact NE2-O 3.29Å; Q343-E345 VanDerWaalsContact NE2-O 3.12Å; E345-G347 PolarHBondContact O-N 2.91Å; E345-L348 HydrophobicContact CG-CB 3.57Å; E345-L348 HydrophobicContact CG-CD2 3.96Å; E345-L348 HydrophobicContact CG-CG 4.38Å; E345-L348 PolarHBondContact N-O 2.78Å; E345-L348 PolarHBondContact O-N 3.31Å
346	R	92.6	Very high	95.2	Very high	244 Å²	244	35.6 Å²	35.6	92%	0.921	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	115.4	-179.3	-174.8	179	178.2	-177.6	-1.2	110	L348	R346-L348 VanDerWaalsContact C-N 3.34Å
347	G	92.6	Very high	94.1	Very high	14 Å²	14	39.8 Å²	39.8	14%	0.144	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	2.6	-178.9	0	0	0	0	0	115.1	E345 A382 D383	E345-G347 PolarHBondContact O-N 2.91Å; G347-A382 CarbonylContact O-C 3.56Å; G347-A382 WeakPolarHBondContact O-CA 3.37Å; G347-D383 VanDerWaalsContact CA-OD2 3.27Å; G347-D383 WeakPolarHBondContact CA-OD2 3.5Å; G347-D383 PolarHBondContact O-N 3.03Å
348	L	96.8	Very high	92.4	Very high	31 Å²	31	41.3 Å²	41.3	16%	0.162	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	120.2	175.3	-177.3	64.4	0	0	0	110.5	I344 E345 R346 I381 A382	I344-L348 HydrophobicContact CB-CD2 4.05Å; I344-L348 HydrophobicContact CB-CG 4.14Å; I344-L348 HydrophobicContact CD1-CD2 4.17Å; I344-L348 HydrophobicContact CD1-CG 4.25Å; I344-L348 HydrophobicContact CG2-CD2 4.02Å; I344-L348 PolarHBondContact N-O 3.43Å; E345-L348 HydrophobicContact CG-CB 3.57Å; E345-L348 HydrophobicContact CG-CD2 3.96Å; E345-L348 HydrophobicContact CG-CG 4.38Å; E345-L348 PolarHBondContact N-O 2.78Å; E345-L348 PolarHBondContact O-N 3.31Å; R346-L348 VanDerWaalsContact C-N 3.34Å; L348-I381 WeakPolarHBondContact CA-O 3.21Å; L348-A382 HydrophobicContact CD1-CB 3.84Å
349	W	97.6	Very high	90.2	Very high	11 Å²	11	46.4 Å²	46.4	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	151.8	-177.7	-62.3	79.7	0	0	0	110.6	A275 V276 V279 R312 Q343 L380 I381	A275-W349 HydrophobicContact CB-CG 4.46Å; V276-W349 HydrophobicContact CG2-CZ2 3.93Å; V279-W349 HydrophobicContact CG1-CE3 4.29Å; V279-W349 HydrophobicContact CG1-CZ3 4.35Å; V279-W349 HydrophobicContact CG2-CB 3.96Å; V279-W349 HydrophobicContact CG2-CD2 3.88Å; V279-W349 HydrophobicContact CG2-CE3 3.84Å; V279-W349 HydrophobicContact CG2-CG 3.94Å; R312-W349 HydrophobicContact CB-CH2 4.04Å; R312-W349 HydrophobicContact CB-CZ3 3.92Å; Q343-W349 HydrophobicContact CB-CD2 4.05Å; Q343-W349 HydrophobicContact CB-CE3 3.77Å; Q343-W349 HydrophobicContact CB-CH2 3.89Å; Q343-W349 HydrophobicContact CB-CZ2 4.15Å; Q343-W349 HydrophobicContact CB-CZ3 3.71Å; Q343-W349 VanDerWaalsContact CD-CZ2 3.46Å; Q343-W349 HydrophobicContact CG-CD2 4.06Å; Q343-W349 HydrophobicContact CG-CE3 4.3Å; Q343-W349 HydrophobicContact CG-CH2 4.2Å; Q343-W349 HydrophobicContact CG-CZ2 3.95Å; Q343-W349 HydrophobicContact CG-CZ3 4.38Å; W349-L380 CarbonylContact O-C 3.59Å; W349-L380 WeakPolarHBondContact O-CA 3.28Å; W349-I381 HydrophobicContact CB-CB 4.32Å; W349-I381 PolarHBondContact N-O 2.87Å; W349-I381 PolarHBondContact O-N 2.85Å
350	A	98.1	Very high	87.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139.1	170.7	0	0	0	0	0	109.7	M215 I219 R342 I344 C379 L380	M215-A350 HydrophobicContact CE-CB 4.15Å; M215-A350 HydrophobicContact SD-CB 3.4Å; M215-A350 WeakPolarHBondContact SD-CB 3.33Å; I219-A350 HydrophobicContact CG1-CB 4.45Å; R342-A350 PolarHBondContact N-O 3.33Å; R342-A350 PolarHBondContact O-N 2.7Å; I344-A350 HydrophobicContact CD1-CB 3.88Å; I344-A350 HydrophobicContact CG1-CB 4.26Å; A350-C379 WeakPolarHBondContact CA-O 3.33Å; A350-L380 HydrophobicContact CB-CD2 3.58Å
351	I	98.1	Very high	85.2	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.015	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.8	171.8	-64.8	171.7	0	0	0	106.5	L218 V279 F282 R339 Y340 C341 G378 C379 I381	L218-I351 WeakPolarHBondContact CD2-O 3.34Å; V279-I351 HydrophobicContact CG2-CD1 4.1Å; F282-I351 HydrophobicContact CB-CD1 3.73Å; F282-I351 HydrophobicContact CD2-CD1 3.69Å; F282-I351 HydrophobicContact CG-CD1 4.16Å; R339-I351 HydrophobicContact CG-CG2 3.68Å; Y340-I351 CarbonylContact O-C 3.54Å; Y340-I351 WeakPolarHBondContact O-CA 3.44Å; C341-I351 HydrophobicContact CB-CG1 4.18Å; I351-G378 CarbonylContact O-C 3.57Å; I351-G378 VanDerWaalsContact O-CA 3.27Å; I351-G378 WeakPolarHBondContact O-CA 3.42Å; I351-C379 PolarHBondContact N-O 2.93Å; I351-C379 PolarHBondContact O-N 3.43Å; I351-I381 HydrophobicContact CD1-CD1 4.28Å
352	A	98.2	Very high	82.6	Confident	2 Å²	2	57.6 Å²	57.6	2%	0.017	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.4	-178.8	0	0	0	0	0	111.5	M215 L218 R339 Y340 S377	M215-A352 HydrophobicContact CB-CB 4.15Å; M215-A352 HydrophobicContact CE-CB 3.72Å; M215-A352 HydrophobicContact SD-CB 4.02Å; L218-A352 HydrophobicContact CB-CB 4.35Å; L218-A352 HydrophobicContact CD2-CB 3.65Å; R339-A352 WeakPolarHBondContact CA-O 3.5Å; Y340-A352 PolarHBondContact N-O 3.38Å; Y340-A352 PolarHBondContact O-N 2.76Å; A352-S377 CarbonylContact C-O 3.58Å; A352-S377 WeakPolarHBondContact CA-O 3.44Å
353	D	97.8	Very high	80.2	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.027	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.7	179	-68.2	-16	0	0	0	110.1	F337 L338 R339 R374 S377	F337-D353 HydrophobicContact CD2-CB 3.74Å; F337-D353 HydrophobicContact CE2-CB 4.05Å; F337-D353 VanDerWaalsContact CE2-CG 3.45Å; F337-D353 WeakPolarHBondContact CE2-OD2 3.34Å; L338-D353 CarbonylContact O-C 3.6Å; L338-D353 WeakPolarHBondContact O-CA 3.45Å; R339-D353 WeakPolarHBondContact CA-OD1 3.47Å; R339-D353 WeakPolarHBondContact CB-OD1 3.19Å; R339-D353 WeakPolarHBondContact CG-OD1 3.18Å; R339-D353 IonicContact CZ-OD1 3.78Å; R339-D353 IonicContact CZ-OD2 3.84Å; R339-D353 IonicContact NE-OD1 3.51Å; R339-D353 PolarHBondContact NE-OD1 3.48Å; R339-D353 IonicContact NE-OD2 3.67Å; R339-D353 PolarHBondContact NE-OD2 3.21Å; R339-D353 IonicContact NH2-OD1 3.51Å; R339-D353 IonicContact NH2-OD2 3.74Å; R339-D353 PolarHBondContact NH2-OD2 3.07Å; D353-R374 VanDerWaalsContact CB-CD 3.41Å; D353-R374 HydrophobicContact CB-CG 4.43Å; D353-S377 PolarHBondContact N-O 2.68Å; D353-S377 PolarHBondContact O-N 2.89Å
354	I	96.2	Very high	77.6	Confident	19 Å²	19	62 Å²	62	10%	0.097	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	128.6	178.1	-178.5	57.5	0	0	0	110.7	M210 A214 F337 L338 R374 P376	M210-I354 HydrophobicContact CG-CG1 4.11Å; M210-I354 HydrophobicContact CG-CG2 4.26Å; M210-I354 HydrophobicContact SD-CG1 4.23Å; A214-I354 HydrophobicContact CB-CB 3.72Å; A214-I354 HydrophobicContact CB-CG1 4.14Å; A214-I354 HydrophobicContact CB-CG2 3.79Å; F337-I354 CarbonylContact C-O 3.58Å; F337-I354 VanDerWaalsContact CA-O 3.27Å; F337-I354 WeakPolarHBondContact CA-O 3.39Å; F337-I354 WeakPolarHBondContact CB-O 3.32Å; L338-I354 HydrophobicContact CB-CG2 3.93Å; L338-I354 HydrophobicContact CD1-CG2 4.26Å; L338-I354 HydrophobicContact CG-CG2 4.49Å; L338-I354 PolarHBondContact N-O 2.65Å; L338-I354 PolarHBondContact O-N 2.91Å; I354-R374 WeakPolarHBondContact CD1-O 3.11Å; I354-P376 HydrophobicContact CD1-CG 3.95Å
355	S	92.3	Very high	75.2	Confident	14 Å²	14	64.4 Å²	64.4	10%	0.098	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	140.7	177.3	-88.4	0	0	0	0	111.9	C336 C373 R374	C336-S355 WeakPolarHBondContact O-CA 3.25Å; C336-S355 PolarHBondContact O-OG 2.9Å; S355-C373 VanDerWaalsContact CB-SG 3.54Å; S355-R374 WeakPolarHBondContact CB-O 3.45Å; S355-R374 PolarHBondContact N-O 2.96Å; S355-R374 WeakPolarHBondContact OG-CB 3.26Å; S355-R374 PolarHBondContact OG-N 2.88Å
356	V	84.5	Confident	72.8	Confident	20 Å²	20	61.5 Å²	61.5	12%	0.121	32%	0.315	C	S	.	.			trans	-95.8	126.1	169.8	-174.3	0	0	0	0	107.8	M207 L318 C336 L338 L358	M207-V356 HydrophobicContact CE-CG1 4.03Å; L318-V356 HydrophobicContact CD1-CG2 4.08Å; C336-V356 PolarHBondContact O-N 2.83Å; L338-V356 HydrophobicContact CD1-CG2 3.94Å; L338-V356 HydrophobicContact CD2-CG2 3.85Å; L338-V356 HydrophobicContact CG-CG2 3.48Å; L338-V356 VanDerWaalsContact CG-CG2 3.48Å; V356-L358 VanDerWaalsContact C-N 3.32Å; V356-L358 HydrophobicContact CG1-CD2 4.26Å; V356-L358 HydrophobicContact CG1-CG 4.26Å; V356-L358 PolarHBondContact O-N 2.94Å
357	D	69.8	Low	70.7	Confident	104 Å²	104	50.9 Å²	50.9	56%	0.556	28%	0.279	S	S	*	.			trans	-71.7	90.5	169.2	-173.2	12.6	0	0	0	110.3	Q359	D357-Q359 PolarHBondContact O-N 2.93Å; D357-Q359 WeakPolarHBondContact OD1-CB 3.38Å; D357-Q359 WeakPolarHBondContact OD1-CG 3.26Å; D357-Q359 PolarHBondContact OD1-N 3.23Å
358	L	58.1	Low	68.9	Low	33 Å²	33	53.8 Å²	53.8	17%	0.173	30%	0.295	C	S	.	.			trans	-81.5	11.1	171.1	-69.1	170.8	0	0	0	112.1	P196 C336 V356 Q360 H361 D362	P196-L358 HydrophobicContact CB-CD1 4.08Å; P196-L358 HydrophobicContact CG-CD1 4.2Å; C336-L358 HydrophobicContact CB-CD1 4.35Å; V356-L358 VanDerWaalsContact C-N 3.32Å; V356-L358 HydrophobicContact CG1-CD2 4.26Å; V356-L358 HydrophobicContact CG1-CG 4.26Å; V356-L358 PolarHBondContact O-N 2.94Å; L358-Q360 PolarHBondContact O-N 3.24Å; L358-H361 WeakPolarHBondContact O-CA 3.47Å; L358-H361 WeakPolarHBondContact O-CB 3.36Å; L358-H361 PolarHBondContact O-N 3.02Å; L358-D362 PolarHBondContact O-N 3.42Å; L358-D362 VanDerWaalsContact O-N 3.08Å
359	Q	50.1	Low	67	Low	106 Å²	106	54.9 Å²	54.9	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-55.3	-28.4	-178.7	-75.5	170	17.9	0	0	113.2	D357 H361 A363 P369	D357-Q359 PolarHBondContact O-N 2.93Å; D357-Q359 WeakPolarHBondContact OD1-CB 3.38Å; D357-Q359 WeakPolarHBondContact OD1-CG 3.26Å; D357-Q359 PolarHBondContact OD1-N 3.23Å; Q359-H361 VanDerWaalsContact C-N 3.26Å; Q359-H361 PolarHBondContact O-N 3.34Å; Q359-A363 WeakPolarHBondContact O-CB 3.47Å; Q359-A363 PolarHBondContact O-N 3.4Å; Q359-A363 VanDerWaalsContact O-N 3.09Å; Q359-P369 HydrophobicContact CG-CB 4.47Å
360	Q	46.2	Very low	65.3	Low	164 Å²	164	57.7 Å²	57.7	77%	0.766	33%	0.326	S	S	*	.	H	α-helix	trans	-68.4	-23.2	172.9	-71.7	-173.3	1.7	0	0	113.6	L358 R364	L358-Q360 PolarHBondContact O-N 3.24Å; Q360-R364 PolarHBondContact O-NE 3.29Å; Q360-R364 PolarHBondContact O-NH2 2.84Å
361	H	44	Very low	64.3	Low	53 Å²	53	62.9 Å²	62.9	25%	0.245	35%	0.345	C	S	.	.	H	α-helix	trans	-87.9	-44.8	174.1	-111.6	-80.2	0	0	0	112.2	L358 Q359 R364 F365	L358-H361 WeakPolarHBondContact O-CA 3.47Å; L358-H361 WeakPolarHBondContact O-CB 3.36Å; L358-H361 PolarHBondContact O-N 3.02Å; Q359-H361 VanDerWaalsContact C-N 3.26Å; Q359-H361 PolarHBondContact O-N 3.34Å; H361-R364 PolarHBondContact CD2-NH2 2.86Å; H361-R364 PolarHBondContact NE2-NH2 3.49Å; H361-R364 VanDerWaalsContact NE2-NH2 3.19Å; H361-R364 PolarHBondContact O-N 3.18Å; H361-F365 WeakPolarHBondContact O-CD2 3.16Å
362	D	42.2	Very low	63.7	Low	37 Å²	37	63.3 Å²	63.3	20%	0.198	35%	0.349	C	S	.	.	H	α-helix	trans	-74.5	-32.5	-175.6	-77.9	-30.2	0	0	0	114	L358 R364 F365 G366 A367	L358-D362 PolarHBondContact O-N 3.42Å; L358-D362 VanDerWaalsContact O-N 3.08Å; D362-R364 PolarHBondContact O-N 2.85Å; D362-F365 CarbonylContact O-C 3.52Å; D362-F365 PolarHBondContact O-N 2.87Å; D362-G366 PolarHBondContact O-N 3.25Å; D362-A367 HydrophobicContact CB-CB 3.96Å; D362-A367 PolarHBondContact O-N 2.9Å
363	A	45.2	Very low	63.3	Low	84 Å²	84	65.6 Å²	65.6	69%	0.694	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.4	175.4	0	0	0	0	0	113	Q359 F365	Q359-A363 WeakPolarHBondContact O-CB 3.47Å; Q359-A363 PolarHBondContact O-N 3.4Å; Q359-A363 VanDerWaalsContact O-N 3.09Å; A363-F365 VanDerWaalsContact C-N 3.28Å; A363-F365 PolarHBondContact O-N 2.85Å
364	R	40.1	Very low	63.1	Low	159 Å²	159	65.4 Å²	65.4	60%	0.6	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-16	174.9	-73.4	-177.9	-80.2	-173.1	0.8	113.1	Q360 H361 D362	Q360-R364 PolarHBondContact O-NE 3.29Å; Q360-R364 PolarHBondContact O-NH2 2.84Å; H361-R364 PolarHBondContact CD2-NH2 2.86Å; H361-R364 PolarHBondContact NE2-NH2 3.49Å; H361-R364 VanDerWaalsContact NE2-NH2 3.19Å; H361-R364 PolarHBondContact O-N 3.18Å; D362-R364 PolarHBondContact O-N 2.85Å
365	F	45.4	Very low	63	Low	120 Å²	120	65.8 Å²	65.8	53%	0.526	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	7.7	-174.9	-63.5	-73.2	0	0	0	114.5	H361 D362 A363 A367	H361-F365 WeakPolarHBondContact O-CD2 3.16Å; D362-F365 CarbonylContact O-C 3.52Å; D362-F365 PolarHBondContact O-N 2.87Å; A363-F365 VanDerWaalsContact C-N 3.28Å; A363-F365 PolarHBondContact O-N 2.85Å; F365-A367 VanDerWaalsContact C-N 3.28Å; F365-A367 PolarHBondContact O-N 2.78Å
366	G	41.9	Very low	63.2	Low	69 Å²	69	65.5 Å²	65.5	71%	0.711	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	13.7	172.2	0	0	0	0	0	115.1	D362	D362-G366 PolarHBondContact O-N 3.25Å
367	A	50.2	Low	63.8	Low	20 Å²	20	64.6 Å²	64.6	17%	0.165	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-69.9	131.6	169.4	0	0	0	0	0	109.3	F193 D362 F365	F193-A367 HydrophobicContact CD1-CB 3.79Å; F193-A367 HydrophobicContact CE1-CB 3.72Å; D362-A367 HydrophobicContact CB-CB 3.96Å; D362-A367 PolarHBondContact O-N 2.9Å; F365-A367 VanDerWaalsContact C-N 3.28Å; F365-A367 PolarHBondContact O-N 2.78Å
368	P	54	Low	65.1	Low	75 Å²	75	59.7 Å²	59.7	49%	0.487	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-62.7	142.8	175.1	26	-33.4	0	0	0	109.8	F193	F193-P368 HydrophobicContact CE1-CG 4.07Å; F193-P368 HydrophobicContact CZ-CG 3.66Å
369	P	56.4	Low	67	Low	55 Å²	55	58.3 Å²	58.3	36%	0.357	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-58.7	147.7	179.5	23.7	-32.8	0	0	0	111.3	Q359 R371	Q359-P369 HydrophobicContact CG-CB 4.47Å; P369-R371 PolarHBondContact O-N 3.08Å
370	S	62.2	Low	69.3	Low	70 Å²	70	54 Å²	54	49%	0.49	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-58.3	126.9	172.2	-67.3	0	0	0	0	109.4	S372	S370-S372 PolarHBondContact O-N 2.78Å
371	R	76.5	Confident	71.8	Confident	109 Å²	109	46.2 Å²	46.2	41%	0.411	27%	0.268	S	S	.	.	S	Bend	trans	-82.8	1.7	-178.5	-57.6	-180	-173.7	179.4	0.3	113.2	P369 E400	P369-R371 PolarHBondContact O-N 3.08Å; R371-E400 PolarHBondContact O-N 2.77Å
372	S	86	Confident	74.4	Confident	12 Å²	12	45.1 Å²	45.1	8%	0.084	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	128.1	-174.7	-55	0	0	0	0	108.2	F335 S370	F335-S372 VanDerWaalsContact CE1-CB 3.47Å; S370-S372 PolarHBondContact O-N 2.78Å
373	C	90.2	Very high	77	Confident	49 Å²	49	46.6 Å²	46.6	33%	0.331	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.7	179.6	-180	0	0	0	0	108	S355 L375 M397 E398	S355-C373 VanDerWaalsContact CB-SG 3.54Å; C373-L375 PolarHBondContact O-N 2.76Å; C373-M397 CarbonylContact O-C 3.54Å; C373-M397 VanDerWaalsContact O-CA 3.27Å; C373-M397 WeakPolarHBondContact O-CA 3.48Å; C373-M397 WeakPolarHBondContact O-CB 3.29Å; C373-E398 HydrophobicContact CB-CB 4.34Å; C373-E398 PolarHBondContact N-O 2.77Å; C373-E398 PolarHBondContact O-N 3.47Å
374	R	92.9	Very high	79.5	Confident	1 Å²	1	46.4 Å²	46.4	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	115.6	173.2	-169.3	174.7	-82.2	-90.6	10.9	107.9	E321 F335 D353 I354 S355 E395	E321-R374 IonicContact OE1-CZ 2.92Å; E321-R374 IonicContact OE1-NE 3.61Å; E321-R374 IonicContact OE1-NH2 3.75Å; E321-R374 PolarHBondContact OE1-NH2 2.83Å; F335-R374 HydrophobicContact CD1-CB 3.87Å; F335-R374 HydrophobicContact CE1-CB 4.24Å; D353-R374 VanDerWaalsContact CB-CD 3.41Å; D353-R374 HydrophobicContact CB-CG 4.43Å; I354-R374 WeakPolarHBondContact CD1-O 3.11Å; S355-R374 WeakPolarHBondContact CB-O 3.45Å; S355-R374 PolarHBondContact N-O 2.96Å; S355-R374 WeakPolarHBondContact OG-CB 3.26Å; S355-R374 PolarHBondContact OG-N 2.88Å; R374-E395 IonicContact CZ-OE2 2.86Å; R374-E395 VanDerWaalsContact NH1-CD 3.34Å; R374-E395 IonicContact NH1-OE1 2.77Å; R374-E395 PolarHBondContact NH1-OE1 2.86Å; R374-E395 VanDerWaalsContact NH1-OE1 3.08Å; R374-E395 IonicContact NH1-OE2 3.75Å; R374-E395 PolarHBondContact NH1-OE2 2.81Å; R374-E395 IonicContact NH2-OE2 3.39Å
375	L	94.3	Very high	81.9	Confident	28 Å²	28	44.5 Å²	44.5	15%	0.147	28%	0.28	C	S	.	.			trans	-80.3	170.9	168	-61.5	176.5	0	0	0	108.6	V262 C373 S377 H396 E398	V262-L375 HydrophobicContact CG1-CD1 4.3Å; V262-L375 HydrophobicContact CG2-CD1 3.94Å; C373-L375 PolarHBondContact O-N 2.76Å; L375-S377 WeakPolarHBondContact O-CB 2.93Å; L375-S377 PolarHBondContact O-N 2.81Å; L375-S377 PolarHBondContact O-OG 2.87Å; L375-H396 CarbonylContact C-O 3.52Å; L375-H396 WeakPolarHBondContact CA-O 3.49Å; L375-H396 HydrophobicContact CB-CB 4.32Å; L375-H396 VanDerWaalsContact CB-ND1 3.34Å; L375-H396 WeakPolarHBondContact CB-ND1 3.37Å; L375-H396 WeakPolarHBondContact CB-O 3.34Å; L375-H396 VanDerWaalsContact CD1-CE1 3.44Å; L375-H396 WeakPolarHBondContact CD1-CE1 3.49Å; L375-H396 WeakPolarHBondContact CD1-NE2 3.41Å; L375-H396 PolarHBondContact N-O 3.15Å; L375-H396 VanDerWaalsContact O-O 3.07Å; L375-E398 HydrophobicContact CD1-CB 4.18Å; L375-E398 HydrophobicContact CG-CB 4.35Å
376	P	96.4	Very high	84.1	Confident	8 Å²	8	44.5 Å²	44.5	5%	0.052	29%	0.286	C	S	.	.	S	Bend	trans	-49.7	107.8	-177	-33.2	42.1	0	0	0	112.2	A214 E217 I354 H396	A214-P376 HydrophobicContact CB-CB 4.15Å; A214-P376 HydrophobicContact CB-CG 4.02Å; E217-P376 HydrophobicContact CB-CB 4.2Å; E217-P376 HydrophobicContact CB-CG 4.46Å; E217-P376 HydrophobicContact CG-CB 4.06Å; E217-P376 HydrophobicContact CG-CG 4.26Å; E217-P376 VanDerWaalsContact OE1-CG 3.3Å; E217-P376 WeakPolarHBondContact OE1-CG 3.44Å; I354-P376 HydrophobicContact CD1-CG 3.95Å; P376-H396 WeakPolarHBondContact O-CB 3.43Å
377	S	97.7	Very high	86.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	172.1	-172.4	-65.1	0	0	0	0	109.6	A352 D353 L375 V394 H396	A352-S377 CarbonylContact C-O 3.58Å; A352-S377 WeakPolarHBondContact CA-O 3.44Å; D353-S377 PolarHBondContact N-O 2.68Å; D353-S377 PolarHBondContact O-N 2.89Å; L375-S377 WeakPolarHBondContact O-CB 2.93Å; L375-S377 PolarHBondContact O-N 2.81Å; L375-S377 PolarHBondContact O-OG 2.87Å; S377-V394 CarbonylContact C-O 3.55Å; S377-V394 WeakPolarHBondContact CA-O 3.43Å; S377-H396 WeakPolarHBondContact OG-CA 3.42Å; S377-H396 PolarHBondContact OG-N 3.28Å; S377-H396 PolarHBondContact OG-O 2.85Å
378	G	97.8	Very high	88.5	Confident	2 Å²	2	42.6 Å²	42.6	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.8	-145.8	172.3	0	0	0	0	0	111.7	I351 V394	I351-G378 CarbonylContact O-C 3.57Å; I351-G378 VanDerWaalsContact O-CA 3.27Å; I351-G378 WeakPolarHBondContact O-CA 3.42Å; G378-V394 PolarHBondContact N-O 3.11Å; G378-V394 PolarHBondContact O-N 3.01Å
379	C	98.3	Very high	90.6	Very high	3 Å²	3	39 Å²	39	2%	0.02	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	152.3	-172.8	60.9	0	0	0	0	114.9	A350 I351 V391 T392 W393	A350-C379 WeakPolarHBondContact CA-O 3.33Å; I351-C379 PolarHBondContact N-O 2.93Å; I351-C379 PolarHBondContact O-N 3.43Å; C379-V391 HydrophobicContact CB-CG1 4.07Å; C379-T392 CarbonylContact C-O 3.59Å; C379-T392 WeakPolarHBondContact CA-O 3.21Å; C379-T392 WeakPolarHBondContact CB-O 3.39Å; C379-W393 HydrophobicContact CB-CD2 4.14Å; C379-W393 HydrophobicContact CB-CE3 4.01Å; C379-W393 HydrophobicContact CB-CG 4.43Å
380	L	98.3	Very high	92.6	Very high	17 Å²	17	41.3 Å²	41.3	9%	0.089	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.9	161.9	-60.9	-176.1	0	0	0	109.2	I219 A222 Q223 I344 W349 A350 V391 T392	I219-L380 HydrophobicContact CG1-CD2 4.02Å; A222-L380 HydrophobicContact CB-CD1 3.46Å; A222-L380 VanDerWaalsContact CB-CD1 3.46Å; A222-L380 HydrophobicContact CB-CG 3.77Å; Q223-L380 HydrophobicContact CG-CD1 4.3Å; I344-L380 HydrophobicContact CD1-CD2 4.19Å; W349-L380 CarbonylContact O-C 3.59Å; W349-L380 WeakPolarHBondContact O-CA 3.28Å; A350-L380 HydrophobicContact CB-CD2 3.58Å; L380-V391 CarbonylContact O-C 3.59Å; L380-V391 VanDerWaalsContact O-CA 3.32Å; L380-V391 WeakPolarHBondContact O-CA 3.43Å; L380-T392 PolarHBondContact N-O 3.14Å; L380-T392 PolarHBondContact O-N 3.1Å
381	I	98.2	Very high	94.3	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	112.3	-176.6	-48.9	172.2	0	0	0	108.1	A275 L278 V279 F282 L348 W349 I351 V391	A275-I381 HydrophobicContact CB-CB 4.36Å; A275-I381 HydrophobicContact CB-CG2 3.53Å; L278-I381 HydrophobicContact CB-CD1 4.01Å; L278-I381 HydrophobicContact CB-CG2 4.5Å; L278-I381 HydrophobicContact CD1-CG2 3.61Å; V279-I381 HydrophobicContact CG2-CD1 4.27Å; F282-I381 HydrophobicContact CD2-CD1 4.34Å; F282-I381 HydrophobicContact CE2-CD1 4.09Å; L348-I381 WeakPolarHBondContact CA-O 3.21Å; W349-I381 HydrophobicContact CB-CB 4.32Å; W349-I381 PolarHBondContact N-O 2.87Å; W349-I381 PolarHBondContact O-N 2.85Å; I351-I381 HydrophobicContact CD1-CD1 4.28Å; I381-V391 HydrophobicContact CG1-CG2 4.47Å; I381-V391 HydrophobicContact CG2-CG2 4.25Å
382	A	98	Very high	95.4	Very high	30 Å²	30	33.7 Å²	33.7	25%	0.248	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.4	179.9	0	0	0	0	0	110.5	G347 L348 S389 K390	G347-A382 CarbonylContact O-C 3.56Å; G347-A382 WeakPolarHBondContact O-CA 3.37Å; L348-A382 HydrophobicContact CD1-CB 3.84Å; A382-S389 CarbonylContact O-C 3.56Å; A382-S389 VanDerWaalsContact O-CA 3.22Å; A382-S389 WeakPolarHBondContact O-CA 3.25Å; A382-K390 PolarHBondContact N-O 3.5Å; A382-K390 PolarHBondContact O-N 3.4Å
383	D	97.4	Very high	96	Very high	68 Å²	68	33.4 Å²	33.4	36%	0.364	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	138.8	172.3	-80.9	-39.1	0	0	0	110.7	A275 G347	A275-D383 WeakPolarHBondContact CB-OD1 3.33Å; A275-D383 PolarHBondContact N-OD1 2.89Å; G347-D383 VanDerWaalsContact CA-OD2 3.27Å; G347-D383 WeakPolarHBondContact CA-OD2 3.5Å; G347-D383 PolarHBondContact O-N 3.03Å
384	M	96.8	Very high	96.4	Very high	79 Å²	79	31 Å²	31	39%	0.389	19%	0.192	S	C	.	.			trans	-107.1	159.5	174	-56.9	-62	-69.4	0	0	110.2	L270 D386 G387 S388 K390	L270-M384 HydrophobicContact CD2-CE 4.25Å; L270-M384 HydrophobicContact CD2-CG 3.98Å; L270-M384 HydrophobicContact CD2-SD 4.34Å; M384-D386 VanDerWaalsContact CB-OD1 3.27Å; M384-D386 WeakPolarHBondContact CB-OD1 3.49Å; M384-D386 PolarHBondContact O-N 3.15Å; M384-D386 VanDerWaalsContact O-N 3.16Å; M384-G387 PolarHBondContact O-N 2.81Å; M384-G387 VanDerWaalsContact O-N 3.11Å; M384-S388 WeakPolarHBondContact CB-O 3.17Å; M384-S388 WeakPolarHBondContact CB-OG 3.47Å; M384-S388 PolarHBondContact N-O 3.19Å; M384-K390 HydrophobicContact CG-CB 4.46Å; M384-K390 HydrophobicContact SD-CB 3.94Å
385	A	91.6	Very high	96.6	Very high	120 Å²	120	31.1 Å²	31.1	99%	0.992	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.1	-175.1	0	0	0	0	0	114.4
386	D	90.9	Very high	96.7	Very high	119 Å²	119	29.8 Å²	29.8	64%	0.636	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	2.2	178.9	64.4	-10.9	0	0	0	113.6	M384 S388	M384-D386 VanDerWaalsContact CB-OD1 3.27Å; M384-D386 WeakPolarHBondContact CB-OD1 3.49Å; M384-D386 PolarHBondContact O-N 3.15Å; M384-D386 VanDerWaalsContact O-N 3.16Å; D386-S388 VanDerWaalsContact C-N 3.3Å; D386-S388 VanDerWaalsContact CG-OG 3.28Å; D386-S388 VanDerWaalsContact OD1-CB 3.24Å; D386-S388 WeakPolarHBondContact OD1-CB 3.49Å; D386-S388 PolarHBondContact OD1-N 3.4Å; D386-S388 PolarHBondContact OD1-OG 3.41Å; D386-S388 PolarHBondContact OD2-OG 2.84Å
387	G	89.4	Confident	96.6	Very high	44 Å²	44	29.5 Å²	29.5	45%	0.454	18%	0.184	S	C	.	.	S	Bend	trans	83.9	1.1	-176	0	0	0	0	0	114.4	M273 S274 M384	M273-G387 CarbonylContact C-O 3.58Å; S274-G387 PolarHBondContact N-O 2.86Å; M384-G387 PolarHBondContact O-N 2.81Å; M384-G387 VanDerWaalsContact O-N 3.11Å
388	S	95.4	Very high	96.3	Very high	5 Å²	5	32.3 Å²	32.3	4%	0.035	20%	0.197	C	C	.	.			trans	-78.7	173.7	166.7	76	0	0	0	0	110.9	V271 M273 M384 D386	V271-S388 WeakPolarHBondContact O-CA 3.47Å; V271-S388 VanDerWaalsContact O-CB 3.26Å; V271-S388 WeakPolarHBondContact O-CB 3.38Å; M273-S388 CarbonylContact O-C 3.51Å; M384-S388 WeakPolarHBondContact CB-O 3.17Å; M384-S388 WeakPolarHBondContact CB-OG 3.47Å; M384-S388 PolarHBondContact N-O 3.19Å; D386-S388 VanDerWaalsContact C-N 3.3Å; D386-S388 VanDerWaalsContact CG-OG 3.28Å; D386-S388 VanDerWaalsContact OD1-CB 3.24Å; D386-S388 WeakPolarHBondContact OD1-CB 3.49Å; D386-S388 PolarHBondContact OD1-N 3.4Å; D386-S388 PolarHBondContact OD1-OG 3.41Å; D386-S388 PolarHBondContact OD2-OG 2.84Å
389	S	98.2	Very high	95.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	142.9	171.6	-57.9	0	0	0	0	111.3	L270 V271 M273 A275 A382	L270-S389 WeakPolarHBondContact CA-O 3.26Å; V271-S389 PolarHBondContact N-O 3.33Å; V271-S389 PolarHBondContact O-N 3.46Å; M273-S389 VanDerWaalsContact O-CB 3.31Å; M273-S389 WeakPolarHBondContact O-CB 3.45Å; M273-S389 PolarHBondContact O-N 2.77Å; M273-S389 PolarHBondContact O-OG 3.39Å; A275-S389 WeakPolarHBondContact CA-OG 3.26Å; A275-S389 PolarHBondContact N-OG 2.97Å; A382-S389 CarbonylContact O-C 3.56Å; A382-S389 VanDerWaalsContact O-CA 3.22Å; A382-S389 WeakPolarHBondContact O-CA 3.25Å
390	K	98.3	Very high	95.3	Very high	103 Å²	103	34.7 Å²	34.7	45%	0.448	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122	161.7	-176.9	179.8	176.5	-176.9	0	108.8	G269 L270 A382 M384	G269-K390 WeakPolarHBondContact O-CA 3.43Å; L270-K390 HydrophobicContact CD2-CB 3.91Å; L270-K390 HydrophobicContact CD2-CG 4.45Å; A382-K390 PolarHBondContact N-O 3.5Å; A382-K390 PolarHBondContact O-N 3.4Å; M384-K390 HydrophobicContact CG-CB 4.46Å; M384-K390 HydrophobicContact SD-CB 3.94Å
391	V	98.4	Very high	94.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.5	177.3	-178.2	0	0	0	0	108.7	S268 G269 V271 L278 C379 L380 I381 W393 L425 L428	S268-V391 CarbonylContact C-O 3.53Å; S268-V391 VanDerWaalsContact CA-O 3.24Å; S268-V391 WeakPolarHBondContact CA-O 3.06Å; G269-V391 PolarHBondContact N-O 2.93Å; G269-V391 PolarHBondContact O-N 3.4Å; V271-V391 HydrophobicContact CG1-CG2 4.32Å; V271-V391 HydrophobicContact CG2-CG2 3.71Å; L278-V391 HydrophobicContact CD1-CG2 3.97Å; C379-V391 HydrophobicContact CB-CG1 4.07Å; L380-V391 CarbonylContact O-C 3.59Å; L380-V391 VanDerWaalsContact O-CA 3.32Å; L380-V391 WeakPolarHBondContact O-CA 3.43Å; I381-V391 HydrophobicContact CG1-CG2 4.47Å; I381-V391 HydrophobicContact CG2-CG2 4.25Å; V391-W393 HydrophobicContact CG1-CE3 3.92Å; V391-L425 HydrophobicContact CB-CD1 4.15Å; V391-L425 HydrophobicContact CG1-CD1 4.37Å; V391-L428 HydrophobicContact CB-CD2 4.43Å; V391-L428 HydrophobicContact CG1-CD2 4.22Å; V391-L428 HydrophobicContact CG2-CD2 4.02Å
392	T	98.3	Very high	93.3	Very high	19 Å²	19	43.5 Å²	43.5	12%	0.117	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	114.7	166.8	-66.2	0	0	0	0	107.6	A222 R266 D267 S268 C379 L380	A222-T392 HydrophobicContact CB-CG2 4.01Å; R266-T392 HydrophobicContact CG-CG2 4.17Å; D267-T392 CarbonylContact O-C 3.5Å; D267-T392 WeakPolarHBondContact O-CA 3.26Å; S268-T392 WeakPolarHBondContact OG-CB 3.43Å; S268-T392 VanDerWaalsContact OG-CG2 3.32Å; S268-T392 WeakPolarHBondContact OG-CG2 3.45Å; S268-T392 PolarHBondContact OG-OG1 3.31Å; C379-T392 CarbonylContact C-O 3.59Å; C379-T392 WeakPolarHBondContact CA-O 3.21Å; C379-T392 WeakPolarHBondContact CB-O 3.39Å; L380-T392 PolarHBondContact N-O 3.14Å; L380-T392 PolarHBondContact O-N 3.1Å
393	W	98.3	Very high	92.2	Very high	6 Å²	6	45.6 Å²	45.6	2%	0.023	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	135.1	-175.6	-156.3	-65.1	0	0	0	110.2	R266 D267 F282 W288 F292 C379 V391 E395 A421 W424 L428	R266-W393 VanDerWaalsContact CA-O 3.3Å; R266-W393 WeakPolarHBondContact CA-O 3.42Å; R266-W393 WeakPolarHBondContact CG-O 3.44Å; D267-W393 PolarHBondContact N-O 3.16Å; D267-W393 PolarHBondContact O-N 3.29Å; F282-W393 AromaticContact CE2-CH2 3.91Å; F282-W393 HydrophobicContact CE2-CH2 3.91Å; F282-W393 AromaticContact CE2-CZ3 3.65Å; F282-W393 HydrophobicContact CE2-CZ3 3.65Å; F282-W393 HydrophobicContact CZ-CH2 4.01Å; F282-W393 AromaticContact CZ-CZ3 3.67Å; F282-W393 HydrophobicContact CZ-CZ3 3.67Å; W288-W393 AromaticContact CH2-CH2 3.74Å; W288-W393 HydrophobicContact CH2-CH2 3.74Å; W288-W393 AromaticContact CH2-CZ2 3.88Å; W288-W393 HydrophobicContact CH2-CZ2 3.88Å; W288-W393 HydrophobicContact CZ3-CH2 4.13Å; F292-W393 AromaticContact CZ-CH2 3.98Å; F292-W393 HydrophobicContact CZ-CH2 3.98Å; F292-W393 HydrophobicContact CZ-CZ3 4.36Å; C379-W393 HydrophobicContact CB-CD2 4.14Å; C379-W393 HydrophobicContact CB-CE3 4.01Å; C379-W393 HydrophobicContact CB-CG 4.43Å; V391-W393 HydrophobicContact CG1-CE3 3.92Å; W393-E395 PolarHBondContact NE1-OE1 2.85Å; W393-A421 HydrophobicContact CB-CB 4.18Å; W393-A421 HydrophobicContact CG-CB 4.43Å; W393-A421 WeakPolarHBondContact O-CB 3.35Å; W393-W424 HydrophobicContact CD2-CB 3.83Å; W393-W424 AromaticContact CE2-CG 3.81Å; W393-W424 HydrophobicContact CE3-CB 4.35Å; W393-W424 HydrophobicContact CG-CB 4.2Å; W393-W424 HydrophobicContact CH2-CB 4.39Å; W393-W424 HydrophobicContact CH2-CE3 4.09Å; W393-W424 HydrophobicContact CZ2-CB 3.87Å; W393-W424 AromaticContact CZ2-CD2 3.81Å; W393-W424 HydrophobicContact CZ2-CD2 3.81Å; W393-W424 AromaticContact CZ2-CE3 3.67Å; W393-W424 HydrophobicContact CZ2-CE3 3.67Å; W393-W424 AromaticContact CZ2-CG 3.94Å; W393-W424 HydrophobicContact CZ2-CG 3.94Å; W393-W424 HydrophobicContact CZ2-CZ3 4.41Å; W393-W424 AromaticContact NE1-CG 3.77Å; W393-L428 HydrophobicContact CE3-CD2 4.47Å; W393-L428 HydrophobicContact CZ3-CD2 4.07Å
394	V	98.4	Very high	91.4	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	115.9	176.3	175.8	0	0	0	0	107.8	L218 M221 A222 W229 S265 R266 S377 G378	L218-V394 HydrophobicContact CD1-CB 3.72Å; L218-V394 HydrophobicContact CD1-CG1 4.18Å; L218-V394 HydrophobicContact CD1-CG2 4.13Å; M221-V394 HydrophobicContact CE-CG1 3.99Å; A222-V394 HydrophobicContact CB-CG2 4.07Å; W229-V394 HydrophobicContact CH2-CG1 3.94Å; W229-V394 HydrophobicContact CZ2-CG1 4.16Å; W229-V394 HydrophobicContact CZ2-CG2 4.34Å; S265-V394 WeakPolarHBondContact O-CA 3.38Å; R266-V394 HydrophobicContact CB-CG2 4.43Å; R266-V394 HydrophobicContact CG-CG2 3.93Å; S377-V394 CarbonylContact C-O 3.55Å; S377-V394 WeakPolarHBondContact CA-O 3.43Å; G378-V394 PolarHBondContact N-O 3.11Å; G378-V394 PolarHBondContact O-N 3.01Å
395	E	97.4	Very high	90.9	Very high	2 Å²	2	46 Å²	46	1%	0.009	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.4	169.2	-76	-61.8	108.3	0	0	109	G264 S265 R374 W393 M397 A421 W424	G264-E395 CarbonylContact C-O 3.54Å; G264-E395 VanDerWaalsContact CA-O 3.29Å; G264-E395 WeakPolarHBondContact CA-O 3.38Å; S265-E395 PolarHBondContact N-O 2.88Å; S265-E395 PolarHBondContact O-N 3.49Å; R374-E395 IonicContact CZ-OE2 2.86Å; R374-E395 VanDerWaalsContact NH1-CD 3.34Å; R374-E395 IonicContact NH1-OE1 2.77Å; R374-E395 PolarHBondContact NH1-OE1 2.86Å; R374-E395 VanDerWaalsContact NH1-OE1 3.08Å; R374-E395 IonicContact NH1-OE2 3.75Å; R374-E395 PolarHBondContact NH1-OE2 2.81Å; R374-E395 IonicContact NH2-OE2 3.39Å; W393-E395 PolarHBondContact NE1-OE1 2.85Å; E395-M397 HydrophobicContact CB-CE 4.21Å; E395-A421 HydrophobicContact CB-CB 4.43Å; E395-A421 HydrophobicContact CG-CB 4.33Å; E395-W424 VanDerWaalsContact CD-NE1 3.27Å; E395-W424 HydrophobicContact CG-CG 4.37Å; E395-W424 PolarHBondContact OE2-NE1 2.88Å
396	H	96.6	Very high	90.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	116.7	-175.8	-173.5	-152.1	0	0	0	110.8	M221 L238 Y243 V262 E263 L375 P376 S377	M221-H396 HydrophobicContact CE-CB 4.35Å; L238-H396 WeakPolarHBondContact CD2-NE2 3.47Å; Y243-H396 AromaticContact CE1-CE1 3.74Å; Y243-H396 AromaticContact CE2-CE1 3.54Å; Y243-H396 AromaticContact CZ-CE1 3.33Å; Y243-H396 PolarHBondContact OH-CE1 3.37Å; V262-H396 WeakPolarHBondContact CG1-NE2 3.27Å; E263-H396 CarbonylContact O-C 3.52Å; E263-H396 WeakPolarHBondContact O-CA 3.27Å; L375-H396 CarbonylContact C-O 3.52Å; L375-H396 WeakPolarHBondContact CA-O 3.49Å; L375-H396 HydrophobicContact CB-CB 4.32Å; L375-H396 VanDerWaalsContact CB-ND1 3.34Å; L375-H396 WeakPolarHBondContact CB-ND1 3.37Å; L375-H396 WeakPolarHBondContact CB-O 3.34Å; L375-H396 VanDerWaalsContact CD1-CE1 3.44Å; L375-H396 WeakPolarHBondContact CD1-CE1 3.49Å; L375-H396 WeakPolarHBondContact CD1-NE2 3.41Å; L375-H396 PolarHBondContact N-O 3.15Å; L375-H396 VanDerWaalsContact O-O 3.07Å; P376-H396 WeakPolarHBondContact O-CB 3.43Å; S377-H396 WeakPolarHBondContact OG-CA 3.42Å; S377-H396 PolarHBondContact OG-N 3.28Å; S377-H396 PolarHBondContact OG-O 2.85Å
397	M	94	Very high	90.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	153.5	-173.2	61.1	-166.2	83.1	0	0	112	V262 E263 R333 F335 C373 E395 I399 F419	V262-M397 CarbonylContact C-O 3.58Å; V262-M397 WeakPolarHBondContact CA-O 3.41Å; E263-M397 HydrophobicContact CB-CG 3.9Å; E263-M397 PolarHBondContact N-O 3.38Å; E263-M397 PolarHBondContact O-N 3.47Å; R333-M397 PolarHBondContact NH1-SD 3.27Å; F335-M397 HydrophobicContact CZ-SD 4.27Å; C373-M397 CarbonylContact O-C 3.54Å; C373-M397 VanDerWaalsContact O-CA 3.27Å; C373-M397 WeakPolarHBondContact O-CA 3.48Å; C373-M397 WeakPolarHBondContact O-CB 3.29Å; E395-M397 HydrophobicContact CB-CE 4.21Å; M397-I399 HydrophobicContact CB-CD1 4.39Å; M397-I399 HydrophobicContact CG-CD1 3.99Å; M397-I399 HydrophobicContact CG-CG1 4.1Å; M397-I399 HydrophobicContact SD-CD1 4.01Å; M397-I399 HydrophobicContact SD-CG1 4.47Å; M397-F419 HydrophobicContact CE-CB 4.38Å
398	E	91.4	Very high	90.8	Very high	60 Å²	60	45.4 Å²	45.4	28%	0.28	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.7	170.6	-174.5	172.4	110.7	0	0	108.6	R256 V260 H261 V262 C373 L375	R256-E398 IonicContact NE-OE2 2.67Å; R256-E398 PolarHBondContact NE-OE2 3.17Å; V260-E398 HydrophobicContact CG1-CG 3.22Å; V260-E398 WeakPolarHBondContact CG1-OE1 3.35Å; H261-E398 WeakPolarHBondContact O-CA 3.49Å; V262-E398 HydrophobicContact CG2-CB 4.06Å; V262-E398 HydrophobicContact CG2-CG 4.14Å; C373-E398 HydrophobicContact CB-CB 4.34Å; C373-E398 PolarHBondContact N-O 2.77Å; C373-E398 PolarHBondContact O-N 3.47Å; L375-E398 HydrophobicContact CD1-CB 4.18Å; L375-E398 HydrophobicContact CG-CB 4.35Å
399	I	90.4	Very high	90.7	Very high	7 Å²	7	45.2 Å²	45.2	4%	0.036	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.3	-173.9	-56.1	-61.6	0	0	0	109.1	V260 H261 E263 M397	V260-I399 WeakPolarHBondContact CA-O 3.48Å; H261-I399 PolarHBondContact N-O 3.14Å; H261-I399 PolarHBondContact O-N 3.38Å; E263-I399 HydrophobicContact CG-CG1 4.45Å; M397-I399 HydrophobicContact CB-CD1 4.39Å; M397-I399 HydrophobicContact CG-CD1 3.99Å; M397-I399 HydrophobicContact CG-CG1 4.1Å; M397-I399 HydrophobicContact SD-CD1 4.01Å; M397-I399 HydrophobicContact SD-CG1 4.47Å
400	E	86.5	Confident	90.4	Very high	47 Å²	47	51.4 Å²	51.4	22%	0.22	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	108	174.5	-167.4	-172	-162.9	0	0	110.7	D259 V260 R371 R402	D259-E400 CarbonylContact O-C 3.55Å; D259-E400 WeakPolarHBondContact O-CA 3.36Å; V260-E400 HydrophobicContact CG2-CB 4.22Å; V260-E400 HydrophobicContact CG2-CG 3.93Å; R371-E400 PolarHBondContact O-N 2.77Å; E400-R402 VanDerWaalsContact C-N 3.31Å; E400-R402 HydrophobicContact CG-CG 3.98Å; E400-R402 PolarHBondContact O-N 3Å; E400-R402 IonicContact OE1-CZ 3.51Å; E400-R402 VanDerWaalsContact OE1-CZ 3.24Å; E400-R402 IonicContact OE1-NE 3.15Å; E400-R402 PolarHBondContact OE1-NE 3.5Å; E400-R402 IonicContact OE1-NH2 3.51Å; E400-R402 PolarHBondContact OE1-NH2 3.26Å; E400-R402 IonicContact OE2-CZ 3.1Å; E400-R402 IonicContact OE2-NE 3.39Å; E400-R402 PolarHBondContact OE2-NE 2.97Å; E400-R402 IonicContact OE2-NH2 3.5Å; E400-R402 PolarHBondContact OE2-NH2 2.89Å
401	D	79.4	Confident	90.1	Very high	60 Å²	60	49.7 Å²	49.7	32%	0.321	25%	0.247	S	C	.	.			trans	-80.6	64.7	-174.9	-83.9	-13	0	0	0	112.7	D259 H261	D259-D401 PolarHBondContact O-N 3.39Å; H261-D401 VanDerWaalsContact CE1-CG 3.43Å; H261-D401 IonicContact CE1-OD1 3.35Å; H261-D401 PolarHBondContact CE1-OD1 2.93Å; H261-D401 IonicContact CE1-OD2 3.87Å; H261-D401 PolarHBondContact CE1-OD2 3.47Å; H261-D401 IonicContact ND1-OD2 3.97Å; H261-D401 PolarHBondContact ND1-OD2 3.45Å
402	R	74.2	Confident	89.8	Confident	142 Å²	142	49.9 Å²	49.9	54%	0.536	25%	0.248	S	C	.	.			trans	-76.8	-21.3	175.3	-63.1	-167.1	-176.3	-147.1	-4.7	114.5	E400	E400-R402 VanDerWaalsContact C-N 3.31Å; E400-R402 HydrophobicContact CG-CG 3.98Å; E400-R402 PolarHBondContact O-N 3Å; E400-R402 IonicContact OE1-CZ 3.51Å; E400-R402 VanDerWaalsContact OE1-CZ 3.24Å; E400-R402 IonicContact OE1-NE 3.15Å; E400-R402 PolarHBondContact OE1-NE 3.5Å; E400-R402 IonicContact OE1-NH2 3.51Å; E400-R402 PolarHBondContact OE1-NH2 3.26Å; E400-R402 IonicContact OE2-CZ 3.1Å; E400-R402 IonicContact OE2-NE 3.39Å; E400-R402 PolarHBondContact OE2-NE 2.97Å; E400-R402 IonicContact OE2-NH2 3.5Å; E400-R402 PolarHBondContact OE2-NH2 2.89Å
403	V	75.7	Confident	89.6	Confident	74 Å²	74	49.4 Å²	49.4	45%	0.448	25%	0.245	S	C	.	.	S	Bend	trans	-118.7	128.1	-177.8	177.3	0	0	0	0	108.3	I405	V403-I405 PolarHBondContact O-N 3.35Å
404	P	80.7	Confident	89.1	Confident	119 Å²	119	53.5 Å²	53.5	77%	0.773	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-56.2	129.5	176.9	-24.8	33.6	0	0	0	111.6	H406	P404-H406 PolarHBondContact O-N 2.98Å
405	I	85	Confident	88.7	Confident	38 Å²	38	55.4 Å²	55.4	20%	0.195	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-62.1	133.4	172.4	-60.2	166.2	0	0	0	108.9	V403 L407 R410 I413 L414	V403-I405 PolarHBondContact O-N 3.35Å; I405-L407 PolarHBondContact O-N 3.16Å; I405-R410 HydrophobicContact CG2-CB 4.27Å; I405-I413 HydrophobicContact CD1-CB 4.36Å; I405-I413 HydrophobicContact CD1-CG2 3.81Å; I405-I413 HydrophobicContact CG2-CB 4.37Å; I405-I413 HydrophobicContact CG2-CD1 3.67Å; I405-L414 HydrophobicContact CD1-CD2 3.79Å; I405-L414 HydrophobicContact CD1-CG 4.16Å
406	H	89.3	Confident	88.3	Confident	70 Å²	70	56.2 Å²	56.2	32%	0.324	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-57.4	131.5	176.7	-168.5	-82	0	0	0	111	V329 P404 L408 Y409 R410	V329-H406 HydrophobicContact CB-CB 4.19Å; V329-H406 HydrophobicContact CG2-CB 4.06Å; P404-H406 PolarHBondContact O-N 2.98Å; H406-L408 VanDerWaalsContact C-N 3.27Å; H406-L408 PolarHBondContact ND1-N 3.19Å; H406-L408 PolarHBondContact O-N 3.04Å; H406-L408 VanDerWaalsContact O-N 3.11Å; H406-Y409 PolarHBondContact O-N 3.47Å; H406-R410 PolarHBondContact O-N 3.43Å; H406-R410 VanDerWaalsContact O-N 3.14Å
407	L	90.3	Very high	88	Confident	141 Å²	141	56.6 Å²	56.6	74%	0.738	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-53	-40.3	-170.6	-68.6	175.7	0	0	0	113.7	I405 Y409 R410	I405-L407 PolarHBondContact O-N 3.16Å; L407-Y409 VanDerWaalsContact C-N 3.26Å; L407-Y409 PolarHBondContact O-N 2.93Å; L407-R410 PolarHBondContact O-N 2.77Å
408	L	91.3	Very high	88	Confident	58 Å²	58	56.7 Å²	56.7	30%	0.304	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-57.4	-35.1	177.1	-72.9	172.3	0	0	0	113.9	H406 S518 W520 L653	H406-L408 VanDerWaalsContact C-N 3.27Å; H406-L408 PolarHBondContact ND1-N 3.19Å; H406-L408 PolarHBondContact O-N 3.04Å; H406-L408 VanDerWaalsContact O-N 3.11Å; L408-S518 WeakPolarHBondContact CD1-O 3.36Å; L408-W520 HydrophobicContact CD2-CB 3.88Å; L408-L653 HydrophobicContact CB-CD2 4.32Å; L408-L653 HydrophobicContact CD2-CD2 4.48Å; L408-L653 WeakPolarHBondContact O-CD1 3.34Å; L408-L653 VanDerWaalsContact O-CD2 3.27Å; L408-L653 WeakPolarHBondContact O-CD2 3.49Å
409	Y	92.7	Very high	88.1	Confident	1 Å²	1	54 Å²	54	0%	0.004	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-105.8	1.2	-173.9	-70.1	-85.1	0	0	0	113.1	V325 S327 V329 V330 H406 L407 D411 L412 I413 S518 L626 L653 T655	V325-Y409 HydrophobicContact CG1-CD1 4.15Å; V325-Y409 HydrophobicContact CG1-CE1 4.12Å; S327-Y409 VanDerWaalsContact CB-CZ 3.46Å; S327-Y409 VanDerWaalsContact CB-OH 3.32Å; S327-Y409 WeakPolarHBondContact CB-OH 3.28Å; S327-Y409 VanDerWaalsContact OG-CE2 3.24Å; S327-Y409 WeakPolarHBondContact OG-CE2 3.16Å; S327-Y409 PolarHBondContact OG-OH 2.78Å; V329-Y409 HydrophobicContact CG2-CD2 3.43Å; V329-Y409 VanDerWaalsContact CG2-CD2 3.43Å; V329-Y409 HydrophobicContact CG2-CE2 3.34Å; V330-Y409 HydrophobicContact CG2-CD1 4.06Å; V330-Y409 HydrophobicContact CG2-CD2 3.71Å; V330-Y409 HydrophobicContact CG2-CE2 4.35Å; V330-Y409 HydrophobicContact CG2-CG 3.55Å; H406-Y409 PolarHBondContact O-N 3.47Å; L407-Y409 VanDerWaalsContact C-N 3.26Å; L407-Y409 PolarHBondContact O-N 2.93Å; Y409-D411 PolarHBondContact O-N 2.84Å; Y409-L412 HydrophobicContact CD1-CD2 4Å; Y409-L412 PolarHBondContact O-N 2.89Å; Y409-I413 WeakPolarHBondContact O-CG1 3.49Å; Y409-I413 PolarHBondContact O-N 2.9Å; Y409-S518 VanDerWaalsContact OH-CB 3.26Å; Y409-S518 WeakPolarHBondContact OH-CB 3.46Å; Y409-S518 PolarHBondContact OH-OG 3.42Å; Y409-L626 HydrophobicContact CE1-CD1 4.23Å; Y409-L653 HydrophobicContact CD1-CD1 3.67Å; Y409-L653 HydrophobicContact CE1-CB 4.15Å; Y409-L653 HydrophobicContact CE1-CD1 3.75Å; Y409-L653 HydrophobicContact CG-CD1 4.35Å; Y409-T655 PolarHBondContact OH-OG1 2.86Å
410	R	91.9	Very high	88.4	Confident	130 Å²	130	53.9 Å²	53.9	49%	0.491	28%	0.281	S	S	.	.	H	α-helix	trans	-55.8	-51.9	-175	-177	178.5	179.4	-179.9	1.2	112	I405 H406 L407 L412 I413 L414	I405-R410 HydrophobicContact CG2-CB 4.27Å; H406-R410 PolarHBondContact O-N 3.43Å; H406-R410 VanDerWaalsContact O-N 3.14Å; L407-R410 PolarHBondContact O-N 2.77Å; R410-L412 PolarHBondContact O-N 2.97Å; R410-I413 PolarHBondContact O-N 2.93Å; R410-L414 HydrophobicContact CG-CD1 3.64Å; R410-L414 HydrophobicContact CG-CG 4.28Å; R410-L414 WeakPolarHBondContact O-CB 3.24Å; R410-L414 VanDerWaalsContact O-CG 3.28Å; R410-L414 WeakPolarHBondContact O-CG 2.96Å; R410-L414 PolarHBondContact O-N 3.24Å
411	D	92.2	Very high	88.8	Confident	67 Å²	67	51.6 Å²	51.6	36%	0.358	27%	0.27	S	S	.	.	H	α-helix	trans	-67.3	-38.1	-177.5	-63.3	-22.3	0	0	0	111.7	Y409 S415 R630	Y409-D411 PolarHBondContact O-N 2.84Å; D411-S415 WeakPolarHBondContact O-CB 3.35Å; D411-S415 PolarHBondContact O-N 3.42Å; D411-S415 PolarHBondContact O-OG 3.44Å; D411-R630 IonicContact OD2-NE 3.63Å
412	L	92.6	Very high	89.6	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-43	176.2	-175.6	75	0	0	0	112.1	Y409 R410 S415 A417 A418 L626 P627 L653	Y409-L412 HydrophobicContact CD1-CD2 4Å; Y409-L412 PolarHBondContact O-N 2.89Å; R410-L412 PolarHBondContact O-N 2.97Å; L412-S415 PolarHBondContact O-OG 3.49Å; L412-S415 VanDerWaalsContact O-OG 3.12Å; L412-A417 HydrophobicContact CD1-CB 3.44Å; L412-A417 VanDerWaalsContact CD1-CB 3.44Å; L412-A417 HydrophobicContact CG-CB 4.15Å; L412-A417 WeakPolarHBondContact O-CB 3.5Å; L412-A417 PolarHBondContact O-N 2.91Å; L412-A417 VanDerWaalsContact O-N 3.17Å; L412-A418 HydrophobicContact CD2-CB 4.32Å; L412-A418 HydrophobicContact CG-CB 4.18Å; L412-A418 PolarHBondContact O-N 2.87Å; L412-L626 HydrophobicContact CD2-CB 4.32Å; L412-L626 HydrophobicContact CD2-CD1 4.07Å; L412-P627 HydrophobicContact CD1-CG 3.92Å; L412-P627 WeakPolarHBondContact CD1-O 3.38Å; L412-L653 HydrophobicContact CB-CD1 4.35Å; L412-L653 HydrophobicContact CD2-CD1 4.33Å
413	I	92.5	Very high	90.6	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.046	24%	0.239	C	C	.	.	H	α-helix	trans	-74.4	-50.2	-178.6	-68.1	170.4	0	0	0	110.5	V330 I405 Y409 R410 S415 G416 A418 F419	V330-I413 HydrophobicContact CG1-CD1 3.7Å; V330-I413 HydrophobicContact CG2-CD1 4.17Å; I405-I413 HydrophobicContact CD1-CB 4.36Å; I405-I413 HydrophobicContact CD1-CG2 3.81Å; I405-I413 HydrophobicContact CG2-CB 4.37Å; I405-I413 HydrophobicContact CG2-CD1 3.67Å; Y409-I413 WeakPolarHBondContact O-CG1 3.49Å; Y409-I413 PolarHBondContact O-N 2.9Å; R410-I413 PolarHBondContact O-N 2.93Å; I413-S415 PolarHBondContact O-N 3.5Å; I413-G416 PolarHBondContact O-N 3.49Å; I413-A418 HydrophobicContact CG1-CB 3.87Å; I413-F419 HydrophobicContact CG1-CE2 4.49Å
414	L	89.5	Confident	91.6	Very high	92 Å²	92	40.6 Å²	40.6	48%	0.482	22%	0.217	S	C	.	.	H	α-helix	trans	-65.6	-25.7	-177.9	-67	-179.7	0	0	0	113.2	I405 R410 G416	I405-L414 HydrophobicContact CD1-CD2 3.79Å; I405-L414 HydrophobicContact CD1-CG 4.16Å; R410-L414 HydrophobicContact CG-CD1 3.64Å; R410-L414 HydrophobicContact CG-CG 4.28Å; R410-L414 WeakPolarHBondContact O-CB 3.24Å; R410-L414 VanDerWaalsContact O-CG 3.28Å; R410-L414 WeakPolarHBondContact O-CG 2.96Å; R410-L414 PolarHBondContact O-N 3.24Å; L414-G416 PolarHBondContact O-N 3.19Å
415	S	88.6	Confident	92.4	Very high	39 Å²	39	35 Å²	35	27%	0.273	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-2	173	67.2	0	0	0	0	114.1	D411 L412 I413 A417	D411-S415 WeakPolarHBondContact O-CB 3.35Å; D411-S415 PolarHBondContact O-N 3.42Å; D411-S415 PolarHBondContact O-OG 3.44Å; L412-S415 PolarHBondContact O-OG 3.49Å; L412-S415 VanDerWaalsContact O-OG 3.12Å; I413-S415 PolarHBondContact O-N 3.5Å; S415-A417 PolarHBondContact O-N 3.23Å; S415-A417 WeakPolarHBondContact OG-CB 3.25Å
416	G	89.7	Confident	92.9	Very high	19 Å²	19	33.7 Å²	33.7	20%	0.196	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	4.3	-174.2	0	0	0	0	0	114.1	I413 L414 A418 G420	I413-G416 PolarHBondContact O-N 3.49Å; L414-G416 PolarHBondContact O-N 3.19Å; G416-A418 VanDerWaalsContact C-N 3.3Å; G416-A418 PolarHBondContact O-N 2.88Å; G416-G420 WeakPolarHBondContact O-CA 3.16Å; G416-G420 PolarHBondContact O-N 3.26Å
417	A	90.6	Very high	93.3	Very high	9 Å²	9	30.5 Å²	30.5	7%	0.074	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-35.3	-178	0	0	0	0	0	112.8	R235 L412 S415 H422	R235-A417 VanDerWaalsContact NH1-CB 3.27Å; L412-A417 HydrophobicContact CD1-CB 3.44Å; L412-A417 VanDerWaalsContact CD1-CB 3.44Å; L412-A417 HydrophobicContact CG-CB 4.15Å; L412-A417 WeakPolarHBondContact O-CB 3.5Å; L412-A417 PolarHBondContact O-N 2.91Å; L412-A417 VanDerWaalsContact O-N 3.17Å; S415-A417 PolarHBondContact O-N 3.23Å; S415-A417 WeakPolarHBondContact OG-CB 3.25Å; A417-H422 VanDerWaalsContact CA-CE1 3.47Å; A417-H422 WeakPolarHBondContact CA-CE1 3.34Å; A417-H422 PolarHBondContact O-CE1 3.16Å; A417-H422 PolarHBondContact O-NE2 2.84Å
418	A	93.2	Very high	93.6	Very high	3 Å²	3	23.8 Å²	23.8	3%	0.025	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-31.3	-174.5	0	0	0	0	0	114.5	V325 L412 I413 G416 R423	V325-A418 HydrophobicContact CG2-CB 3.76Å; L412-A418 HydrophobicContact CD2-CB 4.32Å; L412-A418 HydrophobicContact CG-CB 4.18Å; L412-A418 PolarHBondContact O-N 2.87Å; I413-A418 HydrophobicContact CG1-CB 3.87Å; G416-A418 VanDerWaalsContact C-N 3.3Å; G416-A418 PolarHBondContact O-N 2.88Å; A418-R423 WeakPolarHBondContact O-CD 3.41Å; A418-R423 PolarHBondContact O-NE 2.88Å; A418-R423 PolarHBondContact O-NH1 3.29Å
419	F	94.6	Very high	93.8	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.018	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.6	0.1	-171.1	-61.2	-78.1	0	0	0	114.1	L323 V325 R333 M397 I413	L323-F419 HydrophobicContact CB-CD1 4.24Å; L323-F419 HydrophobicContact CB-CE1 4.04Å; V325-F419 HydrophobicContact CG2-CE1 4.22Å; V325-F419 HydrophobicContact CG2-CE2 3.86Å; V325-F419 HydrophobicContact CG2-CZ 3.6Å; R333-F419 HydrophobicContact CG-CE1 4.45Å; R333-F419 HydrophobicContact CG-CZ 4.22Å; R333-F419 VanDerWaalsContact CZ-CE2 3.48Å; M397-F419 HydrophobicContact CE-CB 4.38Å; I413-F419 HydrophobicContact CG1-CE2 4.49Å
420	G	95	Very high	93.9	Very high	4 Å²	4	26.3 Å²	26.3	4%	0.041	13%	0.134	C	C	.	.	S	Bend	trans	-76.1	168.7	-175.7	0	0	0	0	0	115.1	S265 G416 H422 R423	S265-G420 WeakPolarHBondContact OG-CA 3.44Å; G416-G420 WeakPolarHBondContact O-CA 3.16Å; G416-G420 PolarHBondContact O-N 3.26Å; G420-H422 VanDerWaalsContact C-N 3.34Å; G420-H422 PolarHBondContact O-N 2.94Å; G420-R423 WeakPolarHBondContact O-CB 3.21Å; G420-R423 PolarHBondContact O-N 2.79Å
421	A	96.8	Very high	94.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-55.9	-40.3	-174	0	0	0	0	0	114.2	S265 D267 W393 E395 R423 W424 L425	S265-A421 WeakPolarHBondContact O-CB 3.18Å; S265-A421 PolarHBondContact OG-N 2.92Å; D267-A421 HydrophobicContact CB-CB 4.16Å; W393-A421 HydrophobicContact CB-CB 4.18Å; W393-A421 HydrophobicContact CG-CB 4.43Å; W393-A421 WeakPolarHBondContact O-CB 3.35Å; E395-A421 HydrophobicContact CB-CB 4.43Å; E395-A421 HydrophobicContact CG-CB 4.33Å; A421-R423 PolarHBondContact O-N 2.95Å; A421-W424 WeakPolarHBondContact O-CB 3.24Å; A421-W424 PolarHBondContact O-N 3.09Å; A421-W424 VanDerWaalsContact O-N 3.14Å; A421-L425 WeakPolarHBondContact O-CB 3.29Å; A421-L425 PolarHBondContact O-N 3.38Å
422	H	95	Very high	94.2	Very high	32 Å²	32	17.4 Å²	17.4	15%	0.148	10%	0.098	C	C	.	.	H	α-helix	trans	-55.8	-34.5	175.5	67.1	-60.9	0	0	0	113.7	D267 A417 G420 A426	D267-H422 HydrophobicContact CB-CB 4.27Å; D267-H422 VanDerWaalsContact OD2-CA 3.23Å; D267-H422 WeakPolarHBondContact OD2-CA 3.29Å; D267-H422 VanDerWaalsContact OD2-CB 3.26Å; D267-H422 WeakPolarHBondContact OD2-CB 3.33Å; A417-H422 VanDerWaalsContact CA-CE1 3.47Å; A417-H422 WeakPolarHBondContact CA-CE1 3.34Å; A417-H422 PolarHBondContact O-CE1 3.16Å; A417-H422 PolarHBondContact O-NE2 2.84Å; G420-H422 VanDerWaalsContact C-N 3.34Å; G420-H422 PolarHBondContact O-N 2.94Å; H422-A426 VanDerWaalsContact O-CB 3.26Å; H422-A426 WeakPolarHBondContact O-CB 3.24Å; H422-A426 PolarHBondContact O-N 3.32Å
423	R	95.4	Very high	94.3	Very high	12 Å²	12	19 Å²	19	5%	0.045	11%	0.105	C	C	.	.	H	α-helix	trans	-70.6	-43.1	176.9	-169.1	-178.4	-176.4	-129.9	-9.1	111.6	A294 I295 H324 A418 G420 A421 A427 T590	A294-R423 PolarHBondContact O-NH2 3.48Å; I295-R423 HydrophobicContact CD1-CG 3.97Å; I295-R423 HydrophobicContact CG1-CG 4.41Å; H324-R423 PolarHBondContact O-NH1 2.83Å; H324-R423 VanDerWaalsContact O-NH1 3.11Å; A418-R423 WeakPolarHBondContact O-CD 3.41Å; A418-R423 PolarHBondContact O-NE 2.88Å; A418-R423 PolarHBondContact O-NH1 3.29Å; G420-R423 WeakPolarHBondContact O-CB 3.21Å; G420-R423 PolarHBondContact O-N 2.79Å; A421-R423 PolarHBondContact O-N 2.95Å; R423-A427 VanDerWaalsContact O-CB 3.31Å; R423-A427 WeakPolarHBondContact O-CB 3.37Å; R423-A427 PolarHBondContact O-N 3.32Å; R423-T590 HydrophobicContact CB-CG2 4.26Å; R423-T590 HydrophobicContact CG-CG2 4.5Å
424	W	97.3	Very high	94.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.9	-46.2	173.5	-72.2	99	0	0	0	111.7	W288 F292 I295 V296 L323 W393 E395 A421 A427 L428	W288-W424 HydrophobicContact CH2-CE3 4.17Å; W288-W424 HydrophobicContact CH2-CH2 4.25Å; W288-W424 AromaticContact CH2-CZ3 3.62Å; W288-W424 HydrophobicContact CH2-CZ3 3.62Å; W288-W424 HydrophobicContact CZ2-CE3 4.24Å; W288-W424 AromaticContact CZ2-CH2 3.52Å; W288-W424 HydrophobicContact CZ2-CH2 3.52Å; W288-W424 AromaticContact CZ2-CZ3 3.29Å; W288-W424 HydrophobicContact CZ2-CZ3 3.29Å; F292-W424 HydrophobicContact CB-CZ3 4.11Å; F292-W424 AromaticContact CD1-CE3 3.71Å; F292-W424 HydrophobicContact CD1-CE3 3.71Å; F292-W424 AromaticContact CD1-CZ3 3.92Å; F292-W424 HydrophobicContact CD1-CZ3 3.92Å; F292-W424 HydrophobicContact CD2-CE3 4.48Å; F292-W424 HydrophobicContact CD2-CZ3 4.06Å; F292-W424 AromaticContact CE1-CE3 3.82Å; F292-W424 HydrophobicContact CE1-CE3 3.82Å; F292-W424 HydrophobicContact CE1-CZ3 4.33Å; F292-W424 HydrophobicContact CE2-CZ3 4.48Å; F292-W424 HydrophobicContact CG-CE3 4.05Å; F292-W424 AromaticContact CG-CZ3 3.76Å; F292-W424 HydrophobicContact CG-CZ3 3.76Å; F292-W424 HydrophobicContact CZ-CE3 4.26Å; I295-W424 HydrophobicContact CB-CH2 4.44Å; I295-W424 HydrophobicContact CB-CZ3 4.48Å; I295-W424 HydrophobicContact CD1-CD2 4Å; I295-W424 HydrophobicContact CD1-CE3 4.01Å; I295-W424 HydrophobicContact CD1-CG 4.29Å; I295-W424 HydrophobicContact CG2-CD2 4.21Å; I295-W424 HydrophobicContact CG2-CE3 4.37Å; I295-W424 HydrophobicContact CG2-CH2 3.72Å; I295-W424 HydrophobicContact CG2-CZ2 3.51Å; I295-W424 HydrophobicContact CG2-CZ3 4.13Å; V296-W424 HydrophobicContact CG2-CH2 3.49Å; V296-W424 VanDerWaalsContact CG2-CH2 3.49Å; V296-W424 HydrophobicContact CG2-CZ3 3.82Å; L323-W424 HydrophobicContact CD1-CZ2 4.06Å; L323-W424 HydrophobicContact CD2-CH2 3.93Å; L323-W424 HydrophobicContact CD2-CZ2 3.88Å; W393-W424 HydrophobicContact CD2-CB 3.83Å; W393-W424 AromaticContact CE2-CG 3.81Å; W393-W424 HydrophobicContact CE3-CB 4.35Å; W393-W424 HydrophobicContact CG-CB 4.2Å; W393-W424 HydrophobicContact CH2-CB 4.39Å; W393-W424 HydrophobicContact CH2-CE3 4.09Å; W393-W424 HydrophobicContact CZ2-CB 3.87Å; W393-W424 AromaticContact CZ2-CD2 3.81Å; W393-W424 HydrophobicContact CZ2-CD2 3.81Å; W393-W424 AromaticContact CZ2-CE3 3.67Å; W393-W424 HydrophobicContact CZ2-CE3 3.67Å; W393-W424 AromaticContact CZ2-CG 3.94Å; W393-W424 HydrophobicContact CZ2-CG 3.94Å; W393-W424 HydrophobicContact CZ2-CZ3 4.41Å; W393-W424 AromaticContact NE1-CG 3.77Å; E395-W424 VanDerWaalsContact CD-NE1 3.27Å; E395-W424 HydrophobicContact CG-CG 4.37Å; E395-W424 PolarHBondContact OE2-NE1 2.88Å; A421-W424 WeakPolarHBondContact O-CB 3.24Å; A421-W424 PolarHBondContact O-N 3.09Å; A421-W424 VanDerWaalsContact O-N 3.14Å; W424-A427 PolarHBondContact O-N 2.87Å; W424-L428 WeakPolarHBondContact O-CB 3.45Å; W424-L428 PolarHBondContact O-N 2.79Å
425	L	97.1	Very high	94.5	Very high	3 Å²	3	17.6 Å²	17.6	2%	0.016	10%	0.099	C	C	.	.	H	α-helix	trans	-65.5	-45.4	-179.5	-175.1	64.8	0	0	0	112.2	D267 V391 A421 A427 L428 Q429	D267-L425 HydrophobicContact CB-CD2 3.95Å; V391-L425 HydrophobicContact CB-CD1 4.15Å; V391-L425 HydrophobicContact CG1-CD1 4.37Å; A421-L425 WeakPolarHBondContact O-CB 3.29Å; A421-L425 PolarHBondContact O-N 3.38Å; L425-A427 VanDerWaalsContact C-N 3.32Å; L425-A427 PolarHBondContact O-N 3.49Å; L425-L428 PolarHBondContact O-N 2.88Å; L425-Q429 WeakPolarHBondContact O-CB 3.04Å; L425-Q429 WeakPolarHBondContact O-CG 3.22Å; L425-Q429 PolarHBondContact O-N 3.06Å
426	A	96.1	Very high	94.5	Very high	10 Å²	10	17.8 Å²	17.8	8%	0.083	10%	0.103	C	C	.	.	H	α-helix	trans	-61.3	-41.3	175.8	0	0	0	0	0	111.8	H422 Q429 R430 D588 T590	H422-A426 VanDerWaalsContact O-CB 3.26Å; H422-A426 WeakPolarHBondContact O-CB 3.24Å; H422-A426 PolarHBondContact O-N 3.32Å; A426-Q429 PolarHBondContact O-N 3.15Å; A426-R430 WeakPolarHBondContact O-CB 3.27Å; A426-R430 PolarHBondContact O-N 2.76Å; A426-R430 VanDerWaalsContact O-N 3.08Å; A426-D588 HydrophobicContact CB-CB 4.22Å; A426-T590 HydrophobicContact CB-CG2 3.85Å
427	A	96.3	Very high	94.4	Very high	2 Å²	2	18.3 Å²	18.3	2%	0.017	10%	0.103	C	C	.	.	H	α-helix	trans	-65	-40	175.3	0	0	0	0	0	113	F292 I295 R423 W424 L425 R430 A431	F292-A427 HydrophobicContact CD1-CB 3.88Å; F292-A427 HydrophobicContact CE1-CB 4.17Å; I295-A427 HydrophobicContact CD1-CB 3.77Å; R423-A427 VanDerWaalsContact O-CB 3.31Å; R423-A427 WeakPolarHBondContact O-CB 3.37Å; R423-A427 PolarHBondContact O-N 3.32Å; W424-A427 PolarHBondContact O-N 2.87Å; L425-A427 VanDerWaalsContact C-N 3.32Å; L425-A427 PolarHBondContact O-N 3.49Å; A427-R430 VanDerWaalsContact CA-NH2 3.25Å; A427-A431 WeakPolarHBondContact O-CB 3.48Å; A427-A431 PolarHBondContact O-N 2.96Å
428	L	97.1	Very high	94.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.9	-45.7	176	-179.8	63.1	0	0	0	111.9	V271 L278 F282 F291 F292 V391 W393 W424 L425 R430 A431 C432	V271-L428 HydrophobicContact CG1-CD2 3.9Å; V271-L428 HydrophobicContact CG1-CG 3.97Å; V271-L428 HydrophobicContact CG2-CD2 4.5Å; L278-L428 HydrophobicContact CD2-CD1 3.75Å; L278-L428 HydrophobicContact CD2-CD2 4.34Å; L278-L428 HydrophobicContact CD2-CG 4.44Å; F282-L428 HydrophobicContact CE1-CD1 3.85Å; F282-L428 HydrophobicContact CZ-CD1 3.82Å; F282-L428 HydrophobicContact CZ-CD2 3.91Å; F282-L428 HydrophobicContact CZ-CG 4.5Å; F291-L428 HydrophobicContact CD1-CD1 4.14Å; F291-L428 HydrophobicContact CE1-CD1 4.35Å; F292-L428 HydrophobicContact CE1-CB 4.02Å; F292-L428 HydrophobicContact CZ-CB 4.14Å; F292-L428 HydrophobicContact CZ-CD1 3.99Å; V391-L428 HydrophobicContact CB-CD2 4.43Å; V391-L428 HydrophobicContact CG1-CD2 4.22Å; V391-L428 HydrophobicContact CG2-CD2 4.02Å; W393-L428 HydrophobicContact CE3-CD2 4.47Å; W393-L428 HydrophobicContact CZ3-CD2 4.07Å; W424-L428 WeakPolarHBondContact O-CB 3.45Å; W424-L428 PolarHBondContact O-N 2.79Å; L425-L428 PolarHBondContact O-N 2.88Å; L428-R430 VanDerWaalsContact C-N 3.33Å; L428-R430 PolarHBondContact O-N 2.85Å; L428-A431 PolarHBondContact O-N 2.84Å; L428-C432 WeakPolarHBondContact O-CB 3.37Å; L428-C432 PolarHBondContact O-N 2.93Å; L428-C432 PolarHBondContact O-SG 2.79Å
429	Q	96.3	Very high	93.4	Very high	68 Å²	68	26 Å²	26	32%	0.318	15%	0.146	S	C	.	.	H	α-helix	trans	-55.7	-50.6	177	-77.9	175.7	-35.6	0	0	110.7	L270 V271 L425 A426 A431 C432 E433	L270-Q429 PolarHBondContact O-NE2 3.17Å; V271-Q429 HydrophobicContact CG1-CG 3.79Å; L425-Q429 WeakPolarHBondContact O-CB 3.04Å; L425-Q429 WeakPolarHBondContact O-CG 3.22Å; L425-Q429 PolarHBondContact O-N 3.06Å; A426-Q429 PolarHBondContact O-N 3.15Å; Q429-A431 PolarHBondContact O-N 3.21Å; Q429-C432 PolarHBondContact O-N 2.9Å; Q429-E433 WeakPolarHBondContact O-CG 3.25Å; Q429-E433 PolarHBondContact O-N 3.23Å
430	R	95	Very high	92	Very high	44 Å²	44	30.9 Å²	30.9	17%	0.166	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-43.9	177.1	171.9	171.8	35.2	63.7	-4.8	112.6	A426 A427 L428 C432 E433 R434 D588	A426-R430 WeakPolarHBondContact O-CB 3.27Å; A426-R430 PolarHBondContact O-N 2.76Å; A426-R430 VanDerWaalsContact O-N 3.08Å; A427-R430 VanDerWaalsContact CA-NH2 3.25Å; L428-R430 VanDerWaalsContact C-N 3.33Å; L428-R430 PolarHBondContact O-N 2.85Å; R430-C432 VanDerWaalsContact C-N 3.33Å; R430-C432 PolarHBondContact O-N 2.71Å; R430-E433 PolarHBondContact O-N 3.1Å; R430-R434 WeakPolarHBondContact O-CB 3.08Å; R430-R434 PolarHBondContact O-N 2.87Å; R430-D588 IonicContact CZ-OD2 3.24Å; R430-D588 IonicContact NE-OD2 2.72Å; R430-D588 PolarHBondContact NE-OD2 2.91Å; R430-D588 IonicContact NH2-OD2 3.3Å; R430-D588 PolarHBondContact NH2-OD2 3.31Å
431	A	95.2	Very high	90.1	Very high	11 Å²	11	33.9 Å²	33.9	9%	0.091	20%	0.203	C	C	.	.	H	α-helix	trans	-62.9	-40.7	177.2	0	0	0	0	0	111.9	F291 A427 L428 Q429 R434 C435	F291-A431 HydrophobicContact CD1-CB 3.55Å; F291-A431 HydrophobicContact CE1-CB 3.8Å; F291-A431 HydrophobicContact CG-CB 4.14Å; A427-A431 WeakPolarHBondContact O-CB 3.48Å; A427-A431 PolarHBondContact O-N 2.96Å; L428-A431 PolarHBondContact O-N 2.84Å; Q429-A431 PolarHBondContact O-N 3.21Å; A431-R434 PolarHBondContact O-N 3.26Å; A431-C435 PolarHBondContact O-N 2.94Å; A431-C435 PolarHBondContact O-SG 2.77Å
432	C	95.4	Very high	87.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-68	-43.2	177	-65.7	0	0	0	0	112.2	V271 L428 Q429 R430 R434 C435 A436	V271-C432 HydrophobicContact CB-CB 4.31Å; L428-C432 WeakPolarHBondContact O-CB 3.37Å; L428-C432 PolarHBondContact O-N 2.93Å; L428-C432 PolarHBondContact O-SG 2.79Å; Q429-C432 PolarHBondContact O-N 2.9Å; R430-C432 VanDerWaalsContact C-N 3.33Å; R430-C432 PolarHBondContact O-N 2.71Å; C432-R434 VanDerWaalsContact C-N 3.3Å; C432-R434 PolarHBondContact O-N 2.87Å; C432-C435 PolarHBondContact O-N 3.26Å; C432-A436 WeakPolarHBondContact O-CB 3.41Å; C432-A436 PolarHBondContact O-N 2.85Å
433	E	93.8	Very high	84.8	Confident	37 Å²	37	43 Å²	43	17%	0.173	27%	0.27	C	S	.	.	H	α-helix	trans	-58.9	-43.1	173.8	-74.9	-172.4	172.8	0	0	111.6	F272 Q429 R430 C435 A436 C437 S560	F272-E433 HydrophobicContact CD2-CG 4.08Å; F272-E433 HydrophobicContact CE2-CG 4.37Å; Q429-E433 WeakPolarHBondContact O-CG 3.25Å; Q429-E433 PolarHBondContact O-N 3.23Å; R430-E433 PolarHBondContact O-N 3.1Å; E433-C435 PolarHBondContact O-N 3.47Å; E433-A436 PolarHBondContact O-N 3.48Å; E433-C437 PolarHBondContact O-N 3.35Å; E433-C437 PolarHBondContact O-SG 2.7Å; E433-S560 VanDerWaalsContact CD-OG 3.3Å; E433-S560 PolarHBondContact OE1-OG 2.92Å; E433-S560 PolarHBondContact OE2-N 2.88Å; E433-S560 PolarHBondContact OE2-OG 2.88Å; E433-S560 VanDerWaalsContact OE2-OG 3.11Å
434	R	93.6	Very high	82.3	Confident	29 Å²	29	48.9 Å²	48.9	11%	0.109	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-44	175.5	-178.7	-179.9	175.4	80.7	8.6	111.7	R430 A431 C432 C437 M462 S465 N558 E584	R430-R434 WeakPolarHBondContact O-CB 3.08Å; R430-R434 PolarHBondContact O-N 2.87Å; A431-R434 PolarHBondContact O-N 3.26Å; C432-R434 VanDerWaalsContact C-N 3.3Å; C432-R434 PolarHBondContact O-N 2.87Å; R434-C437 WeakPolarHBondContact O-CB 3.31Å; R434-C437 PolarHBondContact O-N 2.64Å; R434-M462 HydrophobicContact CG-CE 4.24Å; R434-M462 PolarHBondContact NH2-O 3.46Å; R434-S465 PolarHBondContact NH2-OG 3.13Å; R434-N558 WeakPolarHBondContact CA-O 3.36Å; R434-N558 HydrophobicContact CG-CB 4.42Å; R434-N558 PolarHBondContact NH1-ND2 2.93Å; R434-E584 IonicContact CZ-OE1 2.67Å; R434-E584 IonicContact CZ-OE2 2.64Å; R434-E584 VanDerWaalsContact NH1-CD 3.29Å; R434-E584 IonicContact NH1-OE1 3.49Å; R434-E584 PolarHBondContact NH1-OE1 3.38Å; R434-E584 IonicContact NH1-OE2 3.8Å; R434-E584 PolarHBondContact NH1-OE2 3.37Å; R434-E584 IonicContact NH2-OE2 3.53Å
435	C	91.6	Very high	79.3	Confident	44 Å²	44	56.1 Å²	56.1	30%	0.297	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-42	175.5	-68.5	0	0	0	0	111.8	M273 A431 C432 E433 C437 L438	M273-C435 HydrophobicContact CE-CB 4.11Å; A431-C435 PolarHBondContact O-N 2.94Å; A431-C435 PolarHBondContact O-SG 2.77Å; C432-C435 PolarHBondContact O-N 3.26Å; E433-C435 PolarHBondContact O-N 3.47Å; C435-C437 PolarHBondContact O-N 3.2Å; C435-L438 WeakPolarHBondContact O-CB 2.97Å; C435-L438 PolarHBondContact O-N 2.79Å
436	A	89.9	Confident	76.3	Confident	42 Å²	42	66.8 Å²	66.8	35%	0.347	38%	0.383	S	S	.	.	H	α-helix	trans	-62.3	-32.1	178.5	0	0	0	0	0	112.2	F272 C432 E433 L438 V439	F272-A436 HydrophobicContact CB-CB 4.48Å; C432-A436 WeakPolarHBondContact O-CB 3.41Å; C432-A436 PolarHBondContact O-N 2.85Å; E433-A436 PolarHBondContact O-N 3.48Å; A436-L438 PolarHBondContact O-N 3.39Å; A436-L438 VanDerWaalsContact O-N 3.13Å; A436-V439 PolarHBondContact O-N 3.31Å
437	C	88.2	Confident	73.7	Confident	30 Å²	30	72.7 Å²	72.7	20%	0.203	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.7	174.8	-68.4	0	0	0	0	113.9	E433 R434 C435 K458 M462	E433-C437 PolarHBondContact O-N 3.35Å; E433-C437 PolarHBondContact O-SG 2.7Å; R434-C437 WeakPolarHBondContact O-CB 3.31Å; R434-C437 PolarHBondContact O-N 2.64Å; C435-C437 PolarHBondContact O-N 3.2Å; C437-K458 VanDerWaalsContact O-CE 3.28Å; C437-K458 WeakPolarHBondContact O-CE 3.42Å; C437-K458 PolarHBondContact O-NZ 3.15Å; C437-M462 HydrophobicContact CB-CE 3.91Å
438	L	84.1	Confident	71	Confident	70 Å²	70	80 Å²	80	37%	0.366	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-16.6	176	-67.5	177.7	0	0	0	113.5	C435 A436 R459 M462	C435-L438 WeakPolarHBondContact O-CB 2.97Å; C435-L438 PolarHBondContact O-N 2.79Å; A436-L438 PolarHBondContact O-N 3.39Å; A436-L438 VanDerWaalsContact O-N 3.13Å; L438-R459 HydrophobicContact CD2-CB 4.39Å; L438-R459 HydrophobicContact CD2-CG 3.69Å; L438-M462 HydrophobicContact CD2-CB 4.12Å; L438-M462 HydrophobicContact CD2-CG 4.17Å; L438-M462 HydrophobicContact CD2-SD 3.22Å; L438-M462 WeakPolarHBondContact CD2-SD 2.87Å; L438-M462 HydrophobicContact CG-SD 3.79Å
439	V	77.4	Confident	68.4	Low	103 Å²	103	83.6 Å²	83.6	62%	0.624	48%	0.48	S	S	*	.	S	Bend	trans	-79.3	124.9	178.7	-175.8	0	0	0	0	108.3	A436 A441	A436-V439 PolarHBondContact O-N 3.31Å; V439-A441 PolarHBondContact O-N 3.12Å
440	P	64.7	Low	66	Low	108 Å²	108	83.3 Å²	83.3	70%	0.701	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-58.7	123.7	173.7	-19.4	30.3	0	0	0	109.5	G442	P440-G442 PolarHBondContact O-N 3.49Å
441	A	56.3	Low	63.9	Low	67 Å²	67	86.2 Å²	86.2	55%	0.554	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-60.1	123.4	169.1	0	0	0	0	0	107.7	V439 M443	V439-A441 PolarHBondContact O-N 3.12Å; A441-M443 PolarHBondContact O-N 3.29Å
442	G	43.4	Very low	62.4	Low	84 Å²	84	89.1 Å²	89.1	87%	0.866	55%	0.547	S	S	*	.	S	Bend	trans	-66	18.7	-179.8	0	0	0	0	0	115	P440	P440-G442 PolarHBondContact O-N 3.49Å
443	M	37.5	Very low	61.5	Low	140 Å²	140	90.8 Å²	90.8	69%	0.69	56%	0.557	S	S	*	*			trans	-124.1	119	-178.6	-78.3	-97.2	167.3	0	0	109	A441 H445	A441-M443 PolarHBondContact O-N 3.29Å; M443-H445 PolarHBondContact O-N 2.83Å
444	P	42.4	Very low	61.2	Low	134 Å²	134	91.9 Å²	91.9	87%	0.87	57%	0.567	S	S	*	*			trans	-75.9	22	172.6	32.3	-33.3	0	0	0	112.6
445	H	34.1	Very low	60.9	Low	152 Å²	152	94.4 Å²	94.4	70%	0.704	59%	0.587	S	S	*	*	S	Bend	trans	-101.6	103.5	-177.7	-100.4	-62.1	0	0	0	111.2	M443 D447	M443-H445 PolarHBondContact O-N 2.83Å; H445-D447 PolarHBondContact O-N 3.04Å
446	R	33.3	Very low	60.8	Low	228 Å²	228	96.6 Å²	96.6	86%	0.86	59%	0.593	S	S	*	*			trans	68.2	26.6	154.7	-90.5	-174.9	158.9	-163.4	-4.8	118	I448	R446-I448 VanDerWaalsContact C-N 3.25Å; R446-I448 PolarHBondContact O-N 2.91Å
447	D	41.9	Very low	60.9	Low	134 Å²	134	94.6 Å²	94.6	72%	0.717	58%	0.576	S	S	*	*			trans	-64.3	104.9	143.2	-81.9	-18.2	0	0	0	105.6	H445 A449	H445-D447 PolarHBondContact O-N 3.04Å; D447-A449 PolarHBondContact O-N 3.37Å
448	I	40	Very low	61.1	Low	154 Å²	154	96.1 Å²	96.1	79%	0.79	58%	0.579	S	S	*	*			trans	-54.1	92.9	156.2	-62.6	167.5	0	0	0	102.7	R446 V450	R446-I448 VanDerWaalsContact C-N 3.25Å; R446-I448 PolarHBondContact O-N 2.91Å; I448-V450 VanDerWaalsContact C-N 3.26Å; I448-V450 PolarHBondContact O-N 2.95Å
449	A	41.3	Very low	61.5	Low	77 Å²	77	98.2 Å²	98.2	64%	0.636	58%	0.582	S	S	*	*			trans	-48.5	107.2	165.2	0	0	0	0	0	103.3	D447 A451	D447-A449 PolarHBondContact O-N 3.37Å; A449-A451 VanDerWaalsContact C-N 3.3Å; A449-A451 WeakPolarHBondContact O-CA 3.4Å; A449-A451 PolarHBondContact O-N 2.83Å
450	V	47.7	Very low	62.3	Low	62 Å²	62	93.6 Å²	93.6	38%	0.376	55%	0.554	S	S	.	*			trans	-52.6	109.4	173	172.8	0	0	0	0	103.2	I448 G452 V453 R555	I448-V450 VanDerWaalsContact C-N 3.26Å; I448-V450 PolarHBondContact O-N 2.95Å; V450-G452 PolarHBondContact O-N 3.27Å; V450-V453 PolarHBondContact O-N 2.89Å; V450-R555 WeakPolarHBondContact CG2-O 3.42Å
451	A	50.4	Low	63.7	Low	104 Å²	104	88.6 Å²	88.6	86%	0.86	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	107.5	-157.5	0	0	0	0	0	109.2	A449	A449-A451 VanDerWaalsContact C-N 3.3Å; A449-A451 WeakPolarHBondContact O-CA 3.4Å; A449-A451 PolarHBondContact O-N 2.83Å
452	G	63.3	Low	65.6	Low	73 Å²	73	85.5 Å²	85.5	75%	0.753	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.8	-9.2	173.6	0	0	0	0	0	118.5	V450	V450-G452 PolarHBondContact O-N 3.27Å
453	V	76.8	Confident	68	Low	34 Å²	34	87.6 Å²	87.6	21%	0.206	48%	0.481	C	S	.	.			trans	-99	118.6	178.9	-172	0	0	0	0	111.5	V450 K458 I556	V450-V453 PolarHBondContact O-N 2.89Å; V453-K458 HydrophobicContact CG1-CB 4.24Å; V453-I556 HydrophobicContact CG1-CD1 4.22Å
454	T	86.3	Confident	70.8	Confident	60 Å²	60	80.9 Å²	80.9	37%	0.368	45%	0.448	S	S	.	.			trans	-71.6	157.1	175.1	62.1	0	0	0	0	111.4	E456 G457 K458 M608	T454-E456 PolarHBondContact O-N 3.08Å; T454-G457 CarbonylContact O-C 3.53Å; T454-G457 PolarHBondContact O-N 3.25Å; T454-G457 VanDerWaalsContact O-N 3.12Å; T454-G457 PolarHBondContact OG1-N 2.79Å; T454-K458 PolarHBondContact O-N 2.92Å; T454-M608 PolarHBondContact OG1-O 2.99Å
455	P	87.8	Confident	73.3	Confident	82 Å²	82	74.5 Å²	74.5	53%	0.532	41%	0.407	S	S	.	.	H	α-helix	trans	-58	-32.6	173	-24.9	35	0	0	0	113.6	R459	P455-R459 PolarHBondContact O-N 3.43Å; P455-R459 PolarHBondContact O-NE 3.12Å
456	E	90.8	Very high	76.2	Confident	91 Å²	91	69.5 Å²	69.5	43%	0.425	38%	0.384	S	S	.	.	H	α-helix	trans	-69.2	-45.6	173.5	-65.6	62.9	-137.1	0	0	110.5	T454 K458 R459 S460	T454-E456 PolarHBondContact O-N 3.08Å; E456-K458 VanDerWaalsContact C-N 3.34Å; E456-K458 PolarHBondContact O-N 2.87Å; E456-R459 WeakPolarHBondContact O-CB 3.29Å; E456-R459 PolarHBondContact O-N 3.06Å; E456-R459 IonicContact OE1-CZ 2.74Å; E456-R459 IonicContact OE1-NH2 3.18Å; E456-R459 PolarHBondContact OE1-NH2 3.29Å; E456-S460 PolarHBondContact O-N 3.35Å
457	G	91.5	Very high	79.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-60.3	-41.3	174.7	0	0	0	0	0	112.8	T454 R459 S460 M461 V607 M608	T454-G457 CarbonylContact O-C 3.53Å; T454-G457 PolarHBondContact O-N 3.25Å; T454-G457 VanDerWaalsContact O-N 3.12Å; T454-G457 PolarHBondContact OG1-N 2.79Å; G457-R459 PolarHBondContact O-N 3.27Å; G457-S460 PolarHBondContact O-N 3.1Å; G457-M461 VanDerWaalsContact O-CB 3.28Å; G457-M461 WeakPolarHBondContact O-CB 3.32Å; G457-M461 PolarHBondContact O-N 3.17Å; G457-V607 WeakPolarHBondContact CA-O 3.43Å; G457-M608 WeakPolarHBondContact CA-O 3.43Å
458	K	92	Very high	81.7	Confident	62 Å²	62	55.5 Å²	55.5	27%	0.27	32%	0.321	S	S	.	.	H	α-helix	trans	-58.9	-47.3	173.5	-173.7	-178.2	-176	-175.4	0	111.1	C437 V453 T454 E456 M461 M462 I556	C437-K458 VanDerWaalsContact O-CE 3.28Å; C437-K458 WeakPolarHBondContact O-CE 3.42Å; C437-K458 PolarHBondContact O-NZ 3.15Å; V453-K458 HydrophobicContact CG1-CB 4.24Å; T454-K458 PolarHBondContact O-N 2.92Å; E456-K458 VanDerWaalsContact C-N 3.34Å; E456-K458 PolarHBondContact O-N 2.87Å; K458-M461 PolarHBondContact O-N 3.29Å; K458-M462 HydrophobicContact CG-SD 4.33Å; K458-M462 WeakPolarHBondContact O-CB 3.45Å; K458-M462 VanDerWaalsContact O-CG 3.3Å; K458-M462 WeakPolarHBondContact O-CG 3.5Å; K458-M462 PolarHBondContact O-N 3.39Å; K458-I556 HydrophobicContact CD-CG2 4.28Å; K458-I556 HydrophobicContact CG-CG2 3.79Å
459	R	92.9	Very high	84.4	Confident	114 Å²	114	49 Å²	49	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-59.8	-47.2	176.9	-89.3	177	-79.9	160.4	-6.1	112	L438 P455 E456 G457 M462 K463	L438-R459 HydrophobicContact CD2-CB 4.39Å; L438-R459 HydrophobicContact CD2-CG 3.69Å; P455-R459 PolarHBondContact O-N 3.43Å; P455-R459 PolarHBondContact O-NE 3.12Å; E456-R459 WeakPolarHBondContact O-CB 3.29Å; E456-R459 PolarHBondContact O-N 3.06Å; E456-R459 IonicContact OE1-CZ 2.74Å; E456-R459 IonicContact OE1-NH2 3.18Å; E456-R459 PolarHBondContact OE1-NH2 3.29Å; G457-R459 PolarHBondContact O-N 3.27Å; R459-M462 PolarHBondContact O-N 2.9Å; R459-K463 WeakPolarHBondContact O-CG 3.24Å; R459-K463 PolarHBondContact O-N 3.33Å; R459-K463 VanDerWaalsContact O-N 3.07Å
460	S	94.4	Very high	86.9	Confident	5 Å²	5	47 Å²	47	4%	0.035	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-45.5	179.6	-179.9	0	0	0	0	111.8	E456 G457 M462 K463 L464 V607 E611 P613	E456-S460 PolarHBondContact O-N 3.35Å; G457-S460 PolarHBondContact O-N 3.1Å; S460-M462 VanDerWaalsContact C-N 3.31Å; S460-M462 PolarHBondContact O-N 2.95Å; S460-K463 WeakPolarHBondContact O-CB 3.21Å; S460-K463 PolarHBondContact O-N 3.29Å; S460-K463 VanDerWaalsContact O-N 3.09Å; S460-L464 PolarHBondContact O-N 2.93Å; S460-V607 VanDerWaalsContact CB-O 3.29Å; S460-V607 WeakPolarHBondContact CB-O 3.46Å; S460-V607 WeakPolarHBondContact OG-CG1 3.34Å; S460-V607 PolarHBondContact OG-O 3.36Å; S460-E611 WeakPolarHBondContact CB-O 3.5Å; S460-E611 PolarHBondContact OG-O 3.33Å; S460-P613 WeakPolarHBondContact OG-CD 3.49Å
461	M	94.6	Very high	89	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-40.1	178	-169.7	61.2	69.7	0	0	112	G457 K458 L464 S465 I556 I566 L568 L582 V607 M608	G457-M461 VanDerWaalsContact O-CB 3.28Å; G457-M461 WeakPolarHBondContact O-CB 3.32Å; G457-M461 PolarHBondContact O-N 3.17Å; K458-M461 PolarHBondContact O-N 3.29Å; M461-L464 PolarHBondContact O-N 3.28Å; M461-L464 HydrophobicContact SD-CD2 4.31Å; M461-S465 WeakPolarHBondContact O-CB 3.29Å; M461-S465 PolarHBondContact O-N 2.91Å; M461-I556 HydrophobicContact CB-CD1 3.81Å; M461-I556 HydrophobicContact CG-CD1 3.68Å; M461-I566 HydrophobicContact CG-CG2 4.1Å; M461-L568 HydrophobicContact CE-CD1 3.85Å; M461-L568 HydrophobicContact CE-CD2 4.49Å; M461-L568 HydrophobicContact CE-CG 4.4Å; M461-L582 HydrophobicContact SD-CD1 3.59Å; M461-L582 VanDerWaalsContact SD-CD1 3.59Å; M461-V607 HydrophobicContact CB-CG1 4.05Å; M461-V607 HydrophobicContact CE-CB 4.2Å; M461-V607 HydrophobicContact CE-CG1 3.64Å; M461-V607 HydrophobicContact SD-CG1 3.92Å; M461-M608 HydrophobicContact CE-CG 3.74Å
462	M	94.7	Very high	91.1	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-38.1	174.5	-74.3	-173.3	124.2	0	0	112.3	R434 C437 L438 K458 R459 S460 S465 Q466 I556 N558 I566	R434-M462 HydrophobicContact CG-CE 4.24Å; R434-M462 PolarHBondContact NH2-O 3.46Å; C437-M462 HydrophobicContact CB-CE 3.91Å; L438-M462 HydrophobicContact CD2-CB 4.12Å; L438-M462 HydrophobicContact CD2-CG 4.17Å; L438-M462 HydrophobicContact CD2-SD 3.22Å; L438-M462 WeakPolarHBondContact CD2-SD 2.87Å; L438-M462 HydrophobicContact CG-SD 3.79Å; K458-M462 HydrophobicContact CG-SD 4.33Å; K458-M462 WeakPolarHBondContact O-CB 3.45Å; K458-M462 VanDerWaalsContact O-CG 3.3Å; K458-M462 WeakPolarHBondContact O-CG 3.5Å; K458-M462 PolarHBondContact O-N 3.39Å; R459-M462 PolarHBondContact O-N 2.9Å; S460-M462 VanDerWaalsContact C-N 3.31Å; S460-M462 PolarHBondContact O-N 2.95Å; M462-S465 PolarHBondContact O-OG 2.81Å; M462-Q466 WeakPolarHBondContact O-CB 3.07Å; M462-Q466 PolarHBondContact O-N 3.24Å; M462-I556 HydrophobicContact CE-CG2 4.5Å; M462-N558 HydrophobicContact CE-CB 3.45Å; M462-N558 VanDerWaalsContact CE-CB 3.45Å; M462-I566 HydrophobicContact CB-CD1 4.34Å; M462-I566 HydrophobicContact CE-CD1 4.38Å; M462-I566 HydrophobicContact CG-CD1 3.6Å
463	K	94.4	Very high	92.6	Very high	127 Å²	127	37.4 Å²	37.4	55%	0.552	19%	0.187	S	C	*	.	H	α-helix	trans	-64.3	-43.2	173.5	-73	177.8	178.3	-174.1	0	112	R459 S460 Q466 R467 P613	R459-K463 WeakPolarHBondContact O-CG 3.24Å; R459-K463 PolarHBondContact O-N 3.33Å; R459-K463 VanDerWaalsContact O-N 3.07Å; S460-K463 WeakPolarHBondContact O-CB 3.21Å; S460-K463 PolarHBondContact O-N 3.29Å; S460-K463 VanDerWaalsContact O-N 3.09Å; K463-Q466 PolarHBondContact O-N 2.85Å; K463-R467 PolarHBondContact O-N 2.91Å; K463-R467 VanDerWaalsContact O-N 3.08Å; K463-P613 HydrophobicContact CB-CG 3.86Å
464	L	95.9	Very high	93.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-48.4	178	-178.7	63.6	0	0	0	111.6	S460 M461 Q466 R467 M468 L582 I599 V607 P613 I616 L618	S460-L464 PolarHBondContact O-N 2.93Å; M461-L464 PolarHBondContact O-N 3.28Å; M461-L464 HydrophobicContact SD-CD2 4.31Å; L464-Q466 VanDerWaalsContact C-N 3.34Å; L464-Q466 PolarHBondContact O-N 2.96Å; L464-R467 PolarHBondContact O-N 2.81Å; L464-M468 PolarHBondContact O-N 2.74Å; L464-L582 HydrophobicContact CD2-CD2 3.72Å; L464-L582 HydrophobicContact CG-CD2 3.76Å; L464-I599 HydrophobicContact CD2-CD1 3.7Å; L464-V607 HydrophobicContact CB-CG1 4.41Å; L464-V607 HydrophobicContact CD2-CB 4.48Å; L464-V607 HydrophobicContact CD2-CG1 4.04Å; L464-V607 HydrophobicContact CD2-CG2 3.86Å; L464-P613 HydrophobicContact CB-CB 3.73Å; L464-P613 HydrophobicContact CB-CG 4.21Å; L464-P613 HydrophobicContact CD1-CB 3.91Å; L464-P613 HydrophobicContact CG-CB 4.3Å; L464-I616 HydrophobicContact CD1-CB 4.22Å; L464-I616 HydrophobicContact CD1-CG2 4.27Å; L464-L618 HydrophobicContact CD1-CD1 3.49Å; L464-L618 VanDerWaalsContact CD1-CD1 3.49Å; L464-L618 HydrophobicContact CD1-CD2 4.33Å; L464-L618 HydrophobicContact CD1-CG 4.02Å; L464-L618 HydrophobicContact CG-CD1 4.04Å
465	S	96.1	Very high	93.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.9	-34.7	-178.8	85.6	0	0	0	0	112.1	R434 M461 M462 M468 V469 I566 E584	R434-S465 PolarHBondContact NH2-OG 3.13Å; M461-S465 WeakPolarHBondContact O-CB 3.29Å; M461-S465 PolarHBondContact O-N 2.91Å; M462-S465 PolarHBondContact O-OG 2.81Å; S465-M468 VanDerWaalsContact O-CB 3.26Å; S465-M468 WeakPolarHBondContact O-CB 3.32Å; S465-M468 PolarHBondContact O-N 3.08Å; S465-V469 WeakPolarHBondContact O-CG2 3.44Å; S465-V469 PolarHBondContact O-N 3.09Å; S465-I566 WeakPolarHBondContact OG-CD1 3.41Å; S465-E584 WeakPolarHBondContact CB-OE2 2.97Å; S465-E584 PolarHBondContact OG-OE2 3.18Å
466	Q	94.9	Very high	93.4	Very high	46 Å²	46	32 Å²	32	22%	0.215	16%	0.159	C	C	.	.	H	α-helix	trans	-63.4	-45.6	174.2	-177.2	174.4	18.4	0	0	111.6	E290 M462 K463 L464 M468 V469 S470	E290-Q466 VanDerWaalsContact CD-NE2 3.32Å; E290-Q466 HydrophobicContact CG-CG 4.48Å; E290-Q466 VanDerWaalsContact OE1-CD 3.27Å; E290-Q466 PolarHBondContact OE1-NE2 2.93Å; E290-Q466 PolarHBondContact OE1-OE1 2.78Å; M462-Q466 WeakPolarHBondContact O-CB 3.07Å; M462-Q466 PolarHBondContact O-N 3.24Å; K463-Q466 PolarHBondContact O-N 2.85Å; L464-Q466 VanDerWaalsContact C-N 3.34Å; L464-Q466 PolarHBondContact O-N 2.96Å; Q466-M468 VanDerWaalsContact C-N 3.29Å; Q466-M468 PolarHBondContact O-N 3.39Å; Q466-V469 PolarHBondContact O-N 2.95Å; Q466-S470 PolarHBondContact O-N 3.39Å; Q466-S470 PolarHBondContact O-OG 3.18Å
467	R	93.6	Very high	93.2	Very high	68 Å²	68	27.9 Å²	27.9	26%	0.257	14%	0.14	S	C	.	.	H	α-helix	trans	-60.2	-40.7	173.8	-177.5	179.7	62.5	-163.4	-4.2	111.8	K463 L464 S470 S471 P613 S614 I616	K463-R467 PolarHBondContact O-N 2.91Å; K463-R467 VanDerWaalsContact O-N 3.08Å; L464-R467 PolarHBondContact O-N 2.81Å; R467-S470 PolarHBondContact O-N 2.67Å; R467-S471 VanDerWaalsContact O-CB 3.29Å; R467-S471 WeakPolarHBondContact O-CB 3.3Å; R467-S471 PolarHBondContact O-N 2.93Å; R467-P613 PolarHBondContact NH1-O 2.82Å; R467-P613 VanDerWaalsContact NH1-O 3.14Å; R467-P613 PolarHBondContact NH2-O 2.88Å; R467-S614 PolarHBondContact NH1-O 3.43Å; R467-I616 PolarHBondContact NH2-O 3.13Å
468	M	95.8	Very high	92.5	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-56.7	-49.5	175.1	-169.6	179.9	63.6	0	0	111.2	L464 S465 Q466 S471 F472 L582 E584 V595 A597 L618 P620	L464-M468 PolarHBondContact O-N 2.74Å; S465-M468 VanDerWaalsContact O-CB 3.26Å; S465-M468 WeakPolarHBondContact O-CB 3.32Å; S465-M468 PolarHBondContact O-N 3.08Å; Q466-M468 VanDerWaalsContact C-N 3.29Å; Q466-M468 PolarHBondContact O-N 3.39Å; M468-S471 PolarHBondContact O-N 2.75Å; M468-F472 WeakPolarHBondContact O-CB 3.17Å; M468-F472 PolarHBondContact O-N 3.04Å; M468-L582 HydrophobicContact CE-CD2 4.38Å; M468-L582 HydrophobicContact CE-CG 4.12Å; M468-L582 HydrophobicContact SD-CB 4.42Å; M468-L582 HydrophobicContact SD-CD2 4.03Å; M468-L582 HydrophobicContact SD-CG 4.07Å; M468-E584 HydrophobicContact CE-CB 3.92Å; M468-V595 HydrophobicContact CE-CB 4.2Å; M468-V595 HydrophobicContact CE-CG1 4.15Å; M468-V595 WeakPolarHBondContact CE-O 3.25Å; M468-V595 HydrophobicContact CG-CG1 3.89Å; M468-V595 HydrophobicContact SD-CG1 4.35Å; M468-A597 HydrophobicContact CG-CB 4.15Å; M468-A597 HydrophobicContact SD-CB 3.58Å; M468-A597 VanDerWaalsContact SD-CB 3.58Å; M468-L618 HydrophobicContact CB-CD1 3.73Å; M468-L618 HydrophobicContact CG-CD1 4.13Å; M468-P620 HydrophobicContact CG-CB 3.78Å
469	V	96.2	Very high	91.7	Very high	16 Å²	16	25.9 Å²	25.9	10%	0.097	14%	0.135	C	C	.	.	H	α-helix	trans	-63.9	-47	178.1	169.3	0	0	0	0	111.4	P293 S465 Q466 S471 F472 C473 E584 L593 V595	P293-V469 HydrophobicContact CG-CG1 4.32Å; S465-V469 WeakPolarHBondContact O-CG2 3.44Å; S465-V469 PolarHBondContact O-N 3.09Å; Q466-V469 PolarHBondContact O-N 2.95Å; V469-S471 VanDerWaalsContact C-N 3.34Å; V469-S471 PolarHBondContact O-N 3.21Å; V469-F472 WeakPolarHBondContact O-CB 3.49Å; V469-F472 PolarHBondContact O-N 3.28Å; V469-C473 PolarHBondContact O-N 3.26Å; V469-C473 PolarHBondContact O-SG 2.91Å; V469-E584 HydrophobicContact CG2-CB 4.1Å; V469-E584 HydrophobicContact CG2-CG 4.04Å; V469-L593 HydrophobicContact CG1-CD2 3.74Å; V469-L593 HydrophobicContact CG2-CD2 4.35Å; V469-V595 HydrophobicContact CG2-CB 4.27Å; V469-V595 HydrophobicContact CG2-CG2 4.08Å
470	S	93.9	Very high	90.2	Very high	37 Å²	37	26.2 Å²	26.2	26%	0.259	14%	0.141	S	C	.	.	H	α-helix	trans	-61.2	-42.3	178.7	-63.7	0	0	0	0	112.2	Q466 R467 C473 A474	Q466-S470 PolarHBondContact O-N 3.39Å; Q466-S470 PolarHBondContact O-OG 3.18Å; R467-S470 PolarHBondContact O-N 2.67Å; S470-C473 PolarHBondContact O-N 3.02Å; S470-A474 WeakPolarHBondContact O-CB 3.25Å; S470-A474 PolarHBondContact O-N 3.31Å
471	S	92.2	Very high	88.3	Confident	35 Å²	35	31.9 Å²	31.9	25%	0.245	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-42.6	175.6	174	0	0	0	0	111.9	R467 M468 V469 A474 S475	R467-S471 VanDerWaalsContact O-CB 3.29Å; R467-S471 WeakPolarHBondContact O-CB 3.3Å; R467-S471 PolarHBondContact O-N 2.93Å; M468-S471 PolarHBondContact O-N 2.75Å; V469-S471 VanDerWaalsContact C-N 3.34Å; V469-S471 PolarHBondContact O-N 3.21Å; S471-A474 PolarHBondContact O-N 2.87Å; S471-S475 WeakPolarHBondContact O-CB 3.28Å; S471-S475 PolarHBondContact O-N 3.31Å
472	F	94.9	Very high	86.7	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-58.7	-51.8	174.4	-177.9	-100.6	0	0	0	111.7	M326 M468 V469 A474 S475 L476 L593 V595 P620 G622 T624 A657	M326-F472 HydrophobicContact CE-CD1 3.96Å; M326-F472 HydrophobicContact CE-CE1 3.93Å; M468-F472 WeakPolarHBondContact O-CB 3.17Å; M468-F472 PolarHBondContact O-N 3.04Å; V469-F472 WeakPolarHBondContact O-CB 3.49Å; V469-F472 PolarHBondContact O-N 3.28Å; F472-A474 PolarHBondContact O-N 3.06Å; F472-S475 PolarHBondContact O-N 3.23Å; F472-S475 PolarHBondContact O-OG 3.29Å; F472-L476 HydrophobicContact CD1-CD1 4.15Å; F472-L476 HydrophobicContact CE1-CD1 3.46Å; F472-L476 VanDerWaalsContact CE1-CD1 3.46Å; F472-L476 HydrophobicContact CE2-CD1 4.47Å; F472-L476 HydrophobicContact CZ-CD1 3.66Å; F472-L476 PolarHBondContact O-N 3.39Å; F472-L593 HydrophobicContact CD1-CD1 3.86Å; F472-L593 HydrophobicContact CE1-CD1 3.56Å; F472-V595 HydrophobicContact CB-CG1 3.69Å; F472-V595 HydrophobicContact CB-CG2 4.09Å; F472-V595 HydrophobicContact CD1-CG1 4.49Å; F472-V595 HydrophobicContact CD1-CG2 3.64Å; F472-V595 HydrophobicContact CD2-CG1 4.04Å; F472-V595 HydrophobicContact CD2-CG2 4.5Å; F472-V595 HydrophobicContact CE1-CG2 4.19Å; F472-V595 HydrophobicContact CG-CB 4.48Å; F472-V595 HydrophobicContact CG-CG1 3.82Å; F472-V595 HydrophobicContact CG-CG2 3.81Å; F472-P620 HydrophobicContact CB-CB 3.82Å; F472-P620 HydrophobicContact CB-CG 4.01Å; F472-P620 HydrophobicContact CD2-CB 4.19Å; F472-P620 HydrophobicContact CG-CB 4.47Å; F472-G622 VanDerWaalsContact CE2-N 3.35Å; F472-T624 HydrophobicContact CE1-CG2 3.7Å; F472-T624 HydrophobicContact CZ-CG2 4.23Å; F472-A657 HydrophobicContact CE2-CB 3.79Å; F472-A657 HydrophobicContact CZ-CB 4.01Å
473	C	94.5	Very high	85.2	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-47.7	179.7	-62.5	0	0	0	0	111.9	P293 H324 M326 V469 S470 S475 L476 S477	P293-C473 HydrophobicContact CB-CB 4.18Å; P293-C473 WeakPolarHBondContact O-CB 3.49Å; H324-C473 PolarHBondContact CE1-O 3.24Å; H324-C473 VanDerWaalsContact CE1-O 3.29Å; M326-C473 HydrophobicContact CE-CB 3.85Å; M326-C473 WeakPolarHBondContact CE-SG 3.46Å; M326-C473 HydrophobicContact SD-CB 3.75Å; V469-C473 PolarHBondContact O-N 3.26Å; V469-C473 PolarHBondContact O-SG 2.91Å; S470-C473 PolarHBondContact O-N 3.02Å; C473-S475 PolarHBondContact O-N 3.1Å; C473-L476 PolarHBondContact O-N 3.33Å; C473-L476 VanDerWaalsContact O-N 3.09Å; C473-S477 PolarHBondContact O-N 2.68Å
474	A	89.9	Confident	84.3	Confident	48 Å²	48	39.7 Å²	39.7	40%	0.397	20%	0.199	S	C	.	.	H	α-helix	trans	-58.5	-37.8	178	0	0	0	0	0	111.9	S470 S471 F472 L476 S477	S470-A474 WeakPolarHBondContact O-CB 3.25Å; S470-A474 PolarHBondContact O-N 3.31Å; S471-A474 PolarHBondContact O-N 2.87Å; F472-A474 PolarHBondContact O-N 3.06Å; A474-L476 VanDerWaalsContact C-N 3.26Å; A474-L476 PolarHBondContact O-N 3.37Å; A474-S477 VanDerWaalsContact O-CB 3.32Å; A474-S477 WeakPolarHBondContact O-CB 3.44Å; A474-S477 PolarHBondContact O-N 2.86Å
475	S	88.3	Confident	83.5	Confident	15 Å²	15	41.8 Å²	41.8	11%	0.105	21%	0.212	C	C	.	.	H	α-helix	trans	-68.9	-20.8	179	76.8	0	0	0	0	114.7	S471 F472 C473 W484 Q659	S471-S475 WeakPolarHBondContact O-CB 3.28Å; S471-S475 PolarHBondContact O-N 3.31Å; F472-S475 PolarHBondContact O-N 3.23Å; F472-S475 PolarHBondContact O-OG 3.29Å; C473-S475 PolarHBondContact O-N 3.1Å; S475-W484 WeakPolarHBondContact O-CH2 3.04Å; S475-W484 WeakPolarHBondContact O-CZ2 3.13Å; S475-Q659 PolarHBondContact OG-NE2 3.47Å
476	L	90	Very high	82.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-87.2	-11.2	176.9	-82.3	176.3	0	0	0	113.4	M326 F472 C473 A474 A478 A516 T624 T655 A657	M326-L476 HydrophobicContact CE-CD1 3.77Å; F472-L476 HydrophobicContact CD1-CD1 4.15Å; F472-L476 HydrophobicContact CE1-CD1 3.46Å; F472-L476 VanDerWaalsContact CE1-CD1 3.46Å; F472-L476 HydrophobicContact CE2-CD1 4.47Å; F472-L476 HydrophobicContact CZ-CD1 3.66Å; F472-L476 PolarHBondContact O-N 3.39Å; C473-L476 PolarHBondContact O-N 3.33Å; C473-L476 VanDerWaalsContact O-N 3.09Å; A474-L476 VanDerWaalsContact C-N 3.26Å; A474-L476 PolarHBondContact O-N 3.37Å; L476-A478 PolarHBondContact O-N 3.32Å; L476-A516 HydrophobicContact CD2-CB 3.6Å; L476-T624 HydrophobicContact CD1-CG2 3.65Å; L476-T655 HydrophobicContact CD2-CG2 3.98Å; L476-A657 HydrophobicContact CD1-CB 4.42Å; L476-A657 HydrophobicContact CD2-CB 3.7Å; L476-A657 HydrophobicContact CG-CB 4.21Å
477	S	85.5	Confident	81.6	Confident	4 Å²	4	44.8 Å²	44.8	3%	0.028	23%	0.232	C	C	.	.			trans	-64.2	121.8	-178.6	-174.5	0	0	0	0	110.9	S297 T332 C473 A474 S479 W484	S297-S477 VanDerWaalsContact CB-OG 3.29Å; S297-S477 WeakPolarHBondContact CB-OG 3.24Å; S297-S477 PolarHBondContact OG-OG 2.93Å; T332-S477 WeakPolarHBondContact CG2-OG 3.39Å; C473-S477 PolarHBondContact O-N 2.68Å; A474-S477 VanDerWaalsContact O-CB 3.32Å; A474-S477 WeakPolarHBondContact O-CB 3.44Å; A474-S477 PolarHBondContact O-N 2.86Å; S477-S479 PolarHBondContact O-N 2.92Å; S477-S479 VanDerWaalsContact O-N 3.1Å; S477-W484 PolarHBondContact O-NE1 3.44Å
478	A	78.5	Confident	80.2	Confident	17 Å²	17	47.8 Å²	47.8	14%	0.14	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-86.3	53.1	171	0	0	0	0	0	111.4	V330 L476	V330-A478 WeakPolarHBondContact O-CB 3.15Å; L476-A478 PolarHBondContact O-N 3.32Å
479	S	73.8	Confident	78.4	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.021	28%	0.28	C	S	.	.			trans	-64	149	175.2	-176.7	0	0	0	0	109.9	K298 E322 S477 L481 H482	K298-S479 PolarHBondContact NZ-OG 3.45Å; E322-S479 WeakPolarHBondContact OE2-CB 3.4Å; E322-S479 PolarHBondContact OE2-OG 2.82Å; S477-S479 PolarHBondContact O-N 2.92Å; S477-S479 VanDerWaalsContact O-N 3.1Å; S479-L481 PolarHBondContact O-N 2.62Å; S479-H482 CarbonylContact O-C 3.59Å; S479-H482 PolarHBondContact O-N 3.45Å
480	Q	61.1	Low	76.4	Confident	121 Å²	121	55.4 Å²	55.4	57%	0.565	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.7	178.7	-63.5	-66.2	-12.8	0	0	112.9
481	L	55.7	Low	74.5	Confident	124 Å²	124	55.2 Å²	55.2	65%	0.649	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.1	176.1	-65.4	171.4	0	0	0	113.2	S479	S479-L481 PolarHBondContact O-N 2.62Å
482	H	60.6	Low	72.9	Confident	74 Å²	74	61.7 Å²	61.7	34%	0.343	35%	0.35	S	S	.	.	S	Bend	trans	-101.6	86.8	-177.5	-72.5	41.2	0	0	0	108.8	S479 W484	S479-H482 CarbonylContact O-C 3.59Å; S479-H482 PolarHBondContact O-N 3.45Å; H482-W484 VanDerWaalsContact C-N 3.32Å; H482-W484 VanDerWaalsContact O-CD1 3.27Å; H482-W484 PolarHBondContact O-N 3.08Å
483	R	62.5	Low	71.5	Confident	198 Å²	198	62.5 Å²	62.5	75%	0.747	36%	0.355	S	S	*	.			trans	-74.3	87.7	-179.7	-167.8	176.1	132.7	140.5	-2.3	110.5	T485	R483-T485 PolarHBondContact O-N 3.28Å
484	W	76	Confident	70.8	Confident	24 Å²	24	64.3 Å²	64.3	9%	0.091	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-56.5	126.1	166.8	-70.6	91.8	0	0	0	110	P328 S475 S477 H482 R496 T498 A516	P328-W484 HydrophobicContact CB-CD2 3.75Å; P328-W484 HydrophobicContact CB-CE3 4.03Å; P328-W484 HydrophobicContact CB-CG 4.26Å; P328-W484 HydrophobicContact CB-CH2 4.05Å; P328-W484 HydrophobicContact CB-CZ2 3.77Å; P328-W484 HydrophobicContact CB-CZ3 4.18Å; S475-W484 WeakPolarHBondContact O-CH2 3.04Å; S475-W484 WeakPolarHBondContact O-CZ2 3.13Å; S477-W484 PolarHBondContact O-NE1 3.44Å; H482-W484 VanDerWaalsContact C-N 3.32Å; H482-W484 VanDerWaalsContact O-CD1 3.27Å; H482-W484 PolarHBondContact O-N 3.08Å; W484-R496 HydrophobicContact CB-CB 4.25Å; W484-R496 HydrophobicContact CD2-CB 4.23Å; W484-R496 HydrophobicContact CE3-CB 3.55Å; W484-R496 HydrophobicContact CZ3-CB 4.22Å; W484-R496 WeakPolarHBondContact CZ3-O 3.45Å; W484-T498 HydrophobicContact CD2-CG2 4.26Å; W484-T498 HydrophobicContact CE3-CG2 4.05Å; W484-T498 HydrophobicContact CH2-CG2 4.02Å; W484-T498 HydrophobicContact CZ2-CG2 4.19Å; W484-T498 HydrophobicContact CZ3-CG2 3.93Å; W484-A516 HydrophobicContact CH2-CB 3.85Å; W484-A516 HydrophobicContact CZ3-CB 3.96Å
485	T	79.7	Confident	70.6	Confident	45 Å²	45	62 Å²	62	28%	0.276	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.4	173.2	-57.8	0	0	0	0	108.4	R483 L487 R496 V497	R483-T485 PolarHBondContact O-N 3.28Å; T485-L487 PolarHBondContact O-N 2.98Å; T485-R496 WeakPolarHBondContact O-CA 3.26Å; T485-V497 PolarHBondContact N-O 2.99Å; T485-V497 PolarHBondContact O-N 2.92Å
486	T	77.3	Confident	70.6	Confident	71 Å²	71	64.2 Å²	64.2	44%	0.436	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	125.1	173.2	-52.6	0	0	0	0	109
487	L	74.6	Confident	70.5	Confident	38 Å²	38	64.6 Å²	64.6	20%	0.199	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	124	170.8	-61.5	177.4	0	0	0	109.2	T485 G489 V495 V497 V675 N679	T485-L487 PolarHBondContact O-N 2.98Å; L487-G489 PolarHBondContact O-N 3.43Å; L487-V495 HydrophobicContact CD1-CG1 4.44Å; L487-V495 PolarHBondContact N-O 3.15Å; L487-V497 HydrophobicContact CD1-CB 4.48Å; L487-V497 HydrophobicContact CD1-CG2 3.45Å; L487-V497 VanDerWaalsContact CD1-CG2 3.45Å; L487-V497 HydrophobicContact CG-CG2 3.88Å; L487-V675 HydrophobicContact CD1-CG1 3.46Å; L487-V675 VanDerWaalsContact CD1-CG1 3.46Å; L487-V675 HydrophobicContact CD2-CG1 3.43Å; L487-V675 VanDerWaalsContact CD2-CG1 3.43Å; L487-V675 HydrophobicContact CG-CG1 4.08Å; L487-N679 HydrophobicContact CD1-CB 3.88Å
488	S	62.6	Low	70.6	Confident	131 Å²	131	65.2 Å²	65.2	92%	0.916	37%	0.366	S	S	*	.			trans	-80.4	104.5	167.3	-58.2	0	0	0	0	108.4
489	G	58.8	Low	70.9	Confident	34 Å²	34	66.7 Å²	66.7	35%	0.351	37%	0.373	S	S	.	.			trans	-116.5	174.5	175.9	0	0	0	0	0	112.5	L487 S491	L487-G489 PolarHBondContact O-N 3.43Å; G489-S491 PolarHBondContact O-N 2.77Å
490	P	53.8	Low	71.3	Confident	143 Å²	143	68.9 Å²	68.9	93%	0.929	38%	0.383	S	S	*	.	S	Bend	trans	-69.5	-16.6	174.4	28.3	-34	0	0	0	113.3
491	S	54.5	Low	72.3	Confident	33 Å²	33	69.4 Å²	69.4	23%	0.231	38%	0.38	C	S	.	.	S	Bend	trans	-82.3	135.6	174.8	-172.2	0	0	0	0	110.2	G489 V493	G489-S491 PolarHBondContact O-N 2.77Å; S491-V493 PolarHBondContact O-N 3.24Å; S491-V493 VanDerWaalsContact O-N 3.13Å; S491-V493 PolarHBondContact OG-N 3.22Å
492	D	59.5	Low	73	Confident	170 Å²	170	64 Å²	64	91%	0.909	35%	0.352	S	S	*	.	S	Bend	trans	-64	-12	173.8	-165	34	0	0	0	112.6	G494	D492-G494 PolarHBondContact O-N 3.43Å; D492-G494 VanDerWaalsContact O-N 3.1Å
493	V	65.4	Low	73.4	Confident	19 Å²	19	65.3 Å²	65.3	12%	0.115	37%	0.366	C	S	.	.	S	Bend	trans	-80	90.8	178.6	-176.5	0	0	0	0	108.6	S491 V495 T517 I519 V686	S491-V493 PolarHBondContact O-N 3.24Å; S491-V493 VanDerWaalsContact O-N 3.13Å; S491-V493 PolarHBondContact OG-N 3.22Å; V493-V495 WeakPolarHBondContact O-CG2 3.35Å; V493-V495 PolarHBondContact O-N 2.73Å; V493-T517 HydrophobicContact CG1-CG2 3.52Å; V493-T517 WeakPolarHBondContact CG1-OG1 3.19Å; V493-I519 HydrophobicContact CG1-CG2 3.91Å; V493-I519 HydrophobicContact CG2-CG2 4.3Å; V493-V686 HydrophobicContact CG2-CG1 4.14Å
494	G	78.5	Confident	74	Confident	38 Å²	38	60.2 Å²	60.2	39%	0.392	35%	0.354	S	S	.	.			trans	-58.1	99.3	178.6	0	0	0	0	0	112.3	D492 T517	D492-G494 PolarHBondContact O-N 3.43Å; D492-G494 VanDerWaalsContact O-N 3.1Å; G494-T517 PolarHBondContact O-OG1 3.18Å
495	V	85.8	Confident	73.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	131	178.2	-179.7	0	0	0	0	109.4	L487 V493 V497 A515 N679 I682	L487-V495 HydrophobicContact CD1-CG1 4.44Å; L487-V495 PolarHBondContact N-O 3.15Å; V493-V495 WeakPolarHBondContact O-CG2 3.35Å; V493-V495 PolarHBondContact O-N 2.73Å; V495-V497 HydrophobicContact CG1-CG2 4.18Å; V495-A515 HydrophobicContact CG1-CB 4.39Å; V495-N679 VanDerWaalsContact CB-OD1 3.25Å; V495-N679 WeakPolarHBondContact CB-OD1 3.48Å; V495-N679 WeakPolarHBondContact CG2-OD1 3.38Å; V495-I682 HydrophobicContact CG1-CD1 3.81Å; V495-I682 HydrophobicContact CG1-CG2 4.47Å; V495-I682 HydrophobicContact CG2-CB 4.36Å; V495-I682 HydrophobicContact CG2-CG2 3.78Å
496	R	88.3	Confident	73.3	Confident	62 Å²	62	63.1 Å²	63.1	23%	0.234	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.7	175.7	-66.5	-175.1	178.8	-137.8	-2.8	109.9	P328 W484 T485 A515 A516	P328-R496 HydrophobicContact CB-CB 4.32Å; P328-R496 HydrophobicContact CG-CB 4.35Å; P328-R496 PolarHBondContact O-NH1 3.25Å; P328-R496 VanDerWaalsContact O-NH1 3.1Å; W484-R496 HydrophobicContact CB-CB 4.25Å; W484-R496 HydrophobicContact CD2-CB 4.23Å; W484-R496 HydrophobicContact CE3-CB 3.55Å; W484-R496 HydrophobicContact CZ3-CB 4.22Å; W484-R496 WeakPolarHBondContact CZ3-O 3.45Å; T485-R496 WeakPolarHBondContact O-CA 3.26Å; R496-A515 CarbonylContact O-C 3.57Å; R496-A515 VanDerWaalsContact O-CA 3.26Å; R496-A515 WeakPolarHBondContact O-CA 3.46Å; R496-A516 PolarHBondContact N-O 3.06Å; R496-A516 PolarHBondContact O-N 2.96Å
497	V	87.9	Confident	73.3	Confident	7 Å²	7	63 Å²	63	4%	0.042	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139.9	-177.1	-179.6	0	0	0	0	110.7	T485 L487 V495 L513 S514 A515	T485-V497 PolarHBondContact N-O 2.99Å; T485-V497 PolarHBondContact O-N 2.92Å; L487-V497 HydrophobicContact CD1-CB 4.48Å; L487-V497 HydrophobicContact CD1-CG2 3.45Å; L487-V497 VanDerWaalsContact CD1-CG2 3.45Å; L487-V497 HydrophobicContact CG-CG2 3.88Å; V495-V497 HydrophobicContact CG1-CG2 4.18Å; V497-L513 HydrophobicContact CG1-CD1 3.17Å; V497-L513 HydrophobicContact CG1-CD2 4.47Å; V497-L513 HydrophobicContact CG1-CG 3.89Å; V497-S514 CarbonylContact C-O 3.52Å; V497-S514 WeakPolarHBondContact CA-O 3.46Å; V497-A515 HydrophobicContact CG2-CB 3.81Å
498	T	87.6	Confident	73.4	Confident	18 Å²	18	62.1 Å²	62.1	11%	0.11	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	152.4	171.2	-173.3	0	0	0	0	109.8	W484 S514	W484-T498 HydrophobicContact CD2-CG2 4.26Å; W484-T498 HydrophobicContact CE3-CG2 4.05Å; W484-T498 HydrophobicContact CH2-CG2 4.02Å; W484-T498 HydrophobicContact CZ2-CG2 4.19Å; W484-T498 HydrophobicContact CZ3-CG2 3.93Å; T498-S514 PolarHBondContact N-O 3.42Å; T498-S514 PolarHBondContact O-N 2.78Å
499	V	84.5	Confident	74.3	Confident	47 Å²	47	59.2 Å²	59.2	29%	0.285	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.1	-176	-176.9	0	0	0	0	107.2	V511 L513 L670	V499-V511 HydrophobicContact CG1-CG1 3.58Å; V499-L513 HydrophobicContact CG2-CD1 3.72Å; V499-L670 HydrophobicContact CB-CD1 4.06Å; V499-L670 HydrophobicContact CG1-CD1 3.4Å; V499-L670 HydrophobicContact CG2-CD1 3.43Å; V499-L670 VanDerWaalsContact CG2-CD1 3.43Å; V499-L670 HydrophobicContact CG2-CD2 4.11Å; V499-L670 HydrophobicContact CG2-CG 4.36Å
500	H	82.1	Confident	75.6	Confident	50 Å²	50	57.6 Å²	57.6	23%	0.231	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.6	171.4	63	-99.3	0	0	0	110.6	V512 S514	H500-V512 WeakPolarHBondContact CE1-CG1 3.28Å; H500-V512 PolarHBondContact N-O 3.41Å; H500-V512 VanDerWaalsContact NE2-CB 3.27Å; H500-V512 WeakPolarHBondContact NE2-CB 3.38Å; H500-V512 WeakPolarHBondContact NE2-CG1 3.42Å; H500-V512 PolarHBondContact O-N 2.96Å; H500-S514 PolarHBondContact CE1-OG 3.25Å; H500-S514 VanDerWaalsContact CE1-OG 3.24Å; H500-S514 PolarHBondContact ND1-OG 3.06Å
501	R	81.9	Confident	77.1	Confident	131 Å²	131	50.8 Å²	50.8	49%	0.494	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123.6	175.7	-64.3	-179.6	170.5	153.6	-3	106.9	V511 P666 S668	R501-V511 HydrophobicContact CG-CG2 4.16Å; R501-P666 VanDerWaalsContact CD-O 3.28Å; R501-P666 WeakPolarHBondContact CD-O 3.2Å; R501-P666 PolarHBondContact NE-O 3.48Å; R501-S668 PolarHBondContact NH2-O 3.09Å
502	S	71.7	Confident	78.7	Confident	10 Å²	10	49.3 Å²	49.3	7%	0.07	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	147.3	176.7	-179	0	0	0	0	110.8	D504 Q507 G510	S502-D504 VanDerWaalsContact OG-CB 3.29Å; S502-D504 WeakPolarHBondContact OG-CB 3.43Å; S502-D504 PolarHBondContact OG-N 3.13Å; S502-D504 PolarHBondContact OG-OD2 2.85Å; S502-Q507 PolarHBondContact OG-OE1 2.83Å; S502-G510 PolarHBondContact N-O 3.35Å; S502-G510 PolarHBondContact O-N 2.99Å
503	T	68.8	Low	80	Confident	102 Å²	102	41.2 Å²	41.2	63%	0.626	23%	0.234	S	C	*	.			trans	-119.9	14.5	166.8	55.2	0	0	0	0	110.7	P666	T503-P666 HydrophobicContact CG2-CG 4.01Å
504	D	73.8	Confident	81.2	Confident	92 Å²	92	40.4 Å²	40.4	49%	0.492	23%	0.229	S	C	.	.			trans	-71.9	142.9	-173.8	-60.6	-43.5	0	0	0	111.1	S502 G506 Q507	S502-D504 VanDerWaalsContact OG-CB 3.29Å; S502-D504 WeakPolarHBondContact OG-CB 3.43Å; S502-D504 PolarHBondContact OG-N 3.13Å; S502-D504 PolarHBondContact OG-OD2 2.85Å; D504-G506 PolarHBondContact O-N 2.9Å; D504-Q507 PolarHBondContact O-N 3.04Å; D504-Q507 VanDerWaalsContact O-N 3.13Å
505	P	70	Confident	81.8	Confident	121 Å²	121	38.6 Å²	38.6	79%	0.786	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	131.5	174.2	-24.8	33.8	0	0	0	112.1	Q507	P505-Q507 VanDerWaalsContact C-N 3.33Å
506	G	71.9	Confident	82.2	Confident	9 Å²	9	38.6 Å²	38.6	9%	0.093	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	85	-1.2	-179.4	0	0	0	0	0	115.1	D504 S614 P617 L618	D504-G506 PolarHBondContact O-N 2.9Å; G506-S614 WeakPolarHBondContact CA-O 3.45Å; G506-P617 WeakPolarHBondContact O-CA 3.41Å; G506-L618 PolarHBondContact O-N 3.15Å
507	Q	76.7	Confident	82.5	Confident	68 Å²	68	35.8 Å²	35.8	32%	0.318	20%	0.201	S	C	.	.	S	Bend	trans	-106.7	147.8	162.8	-64.3	-172.3	22.5	0	0	109.6	S502 D504 P505 S509	S502-Q507 PolarHBondContact OG-OE1 2.83Å; D504-Q507 PolarHBondContact O-N 3.04Å; D504-Q507 VanDerWaalsContact O-N 3.13Å; P505-Q507 VanDerWaalsContact C-N 3.33Å; Q507-S509 PolarHBondContact O-N 2.85Å
508	P	78	Confident	82.8	Confident	20 Å²	20	36 Å²	36	13%	0.13	20%	0.203	C	C	.	.			trans	-64.3	126.3	172	27.5	-33.5	0	0	0	109.8	G510 V512 P617 L619 L661	P508-G510 PolarHBondContact O-N 3.18Å; P508-V512 HydrophobicContact CG-CG2 4.17Å; P508-P617 HydrophobicContact CB-CB 4.32Å; P508-L619 HydrophobicContact CG-CD1 4Å; P508-L619 HydrophobicContact CG-CD2 3.43Å; P508-L619 VanDerWaalsContact CG-CD2 3.43Å; P508-L619 HydrophobicContact CG-CG 3.65Å; P508-L661 HydrophobicContact CB-CD1 4.22Å; P508-L661 HydrophobicContact CB-CD2 4.2Å; P508-L661 HydrophobicContact CG-CD1 4.44Å
509	S	81.2	Confident	83.1	Confident	69 Å²	69	35.7 Å²	35.7	48%	0.483	20%	0.2	S	C	.	.	S	Bend	trans	-64.8	122.6	176.4	-54.5	0	0	0	0	110.1	Q507 S664	Q507-S509 PolarHBondContact O-N 2.85Å; S509-S664 WeakPolarHBondContact O-CA 3.17Å
510	G	84.9	Confident	83.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-154.3	178.8	0	0	0	0	0	114.7	S502 P508 S663	S502-G510 PolarHBondContact N-O 3.35Å; S502-G510 PolarHBondContact O-N 2.99Å; P508-G510 PolarHBondContact O-N 3.18Å; G510-S663 CarbonylContact C-O 3.59Å; G510-S663 WeakPolarHBondContact CA-O 3.34Å
511	V	86.1	Confident	84.1	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	115.7	177	-174.5	0	0	0	0	109	V499 R501 V662 S663 S668 L670	V499-V511 HydrophobicContact CG1-CG1 3.58Å; R501-V511 HydrophobicContact CG-CG2 4.16Å; V511-V662 PolarHBondContact O-N 3.47Å; V511-S663 PolarHBondContact N-O 3.14Å; V511-S668 WeakPolarHBondContact CG2-OG 3.18Å; V511-L670 HydrophobicContact CG1-CD1 3.77Å
512	V	87	Confident	84.7	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.6	179.1	-178.7	0	0	0	0	109.1	H500 P508 L619 Q659 I660 L661	H500-V512 WeakPolarHBondContact CE1-CG1 3.28Å; H500-V512 PolarHBondContact N-O 3.41Å; H500-V512 VanDerWaalsContact NE2-CB 3.27Å; H500-V512 WeakPolarHBondContact NE2-CB 3.38Å; H500-V512 WeakPolarHBondContact NE2-CG1 3.42Å; H500-V512 PolarHBondContact O-N 2.96Å; P508-V512 HydrophobicContact CG-CG2 4.17Å; V512-L619 HydrophobicContact CG1-CD2 3.69Å; V512-L619 HydrophobicContact CG2-CD2 3.95Å; V512-Q659 HydrophobicContact CG1-CB 4.18Å; V512-I660 WeakPolarHBondContact CA-O 3.36Å; V512-L661 HydrophobicContact CG2-CD1 4.05Å
513	L	88.7	Confident	85.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	118.9	174.6	-170.4	64	0	0	0	108.4	V497 V499 Q659 I660 V662 L670 V678	V497-L513 HydrophobicContact CG1-CD1 3.17Å; V497-L513 HydrophobicContact CG1-CD2 4.47Å; V497-L513 HydrophobicContact CG1-CG 3.89Å; V499-L513 HydrophobicContact CG2-CD1 3.72Å; L513-Q659 WeakPolarHBondContact O-CA 3.47Å; L513-I660 PolarHBondContact N-O 3.33Å; L513-I660 PolarHBondContact O-N 2.83Å; L513-V662 HydrophobicContact CB-CG2 3.57Å; L513-V662 HydrophobicContact CD2-CG2 4.11Å; L513-V662 HydrophobicContact CG-CG2 4.46Å; L513-L670 HydrophobicContact CD1-CD1 4.25Å; L513-L670 HydrophobicContact CD1-CD2 3.76Å; L513-L670 HydrophobicContact CD2-CD2 4.4Å; L513-V678 HydrophobicContact CD2-CB 3.95Å; L513-V678 HydrophobicContact CD2-CG1 4.39Å; L513-V678 HydrophobicContact CD2-CG2 3.56Å; L513-V678 HydrophobicContact CG-CG2 4.49Å
514	S	89.8	Confident	87	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.014	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.1	172.5	-53.4	0	0	0	0	108.7	V497 T498 H500 F658	V497-S514 CarbonylContact C-O 3.52Å; V497-S514 WeakPolarHBondContact CA-O 3.46Å; T498-S514 PolarHBondContact N-O 3.42Å; T498-S514 PolarHBondContact O-N 2.78Å; H500-S514 PolarHBondContact CE1-OG 3.25Å; H500-S514 VanDerWaalsContact CE1-OG 3.24Å; H500-S514 PolarHBondContact ND1-OG 3.06Å; S514-F658 WeakPolarHBondContact CA-O 3.46Å
515	A	91.9	Very high	88	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.008	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.6	179.3	0	0	0	0	0	109.8	V495 R496 V497 A657 F658 V678 I682	V495-A515 HydrophobicContact CG1-CB 4.39Å; R496-A515 CarbonylContact O-C 3.57Å; R496-A515 VanDerWaalsContact O-CA 3.26Å; R496-A515 WeakPolarHBondContact O-CA 3.46Å; V497-A515 HydrophobicContact CG2-CB 3.81Å; A515-A657 CarbonylContact O-C 3.55Å; A515-A657 VanDerWaalsContact O-CA 3.26Å; A515-A657 WeakPolarHBondContact O-CA 3.45Å; A515-F658 PolarHBondContact N-O 2.89Å; A515-F658 PolarHBondContact O-N 3.37Å; A515-V678 HydrophobicContact CB-CG1 3.25Å; A515-I682 VanDerWaalsContact C-CD1 3.5Å; A515-I682 HydrophobicContact CB-CD1 3.3Å; A515-I682 WeakPolarHBondContact O-CD1 3.49Å
516	A	94.1	Very high	89.1	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	149.9	-175.9	0	0	0	0	0	111.8	P328 L476 W484 R496 V656 A657	P328-A516 HydrophobicContact CB-CB 4.5Å; P328-A516 HydrophobicContact CG-CB 3.84Å; L476-A516 HydrophobicContact CD2-CB 3.6Å; W484-A516 HydrophobicContact CH2-CB 3.85Å; W484-A516 HydrophobicContact CZ3-CB 3.96Å; R496-A516 PolarHBondContact N-O 3.06Å; R496-A516 PolarHBondContact O-N 2.96Å; A516-V656 CarbonylContact C-O 3.54Å; A516-V656 WeakPolarHBondContact CA-O 3.5Å; A516-A657 HydrophobicContact CB-CB 3.75Å
517	T	93.6	Very high	90.3	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.018	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	153.9	172.2	-164.5	0	0	0	0	110.8	V493 G494 T655 V656 I682 V686	V493-T517 HydrophobicContact CG1-CG2 3.52Å; V493-T517 WeakPolarHBondContact CG1-OG1 3.19Å; G494-T517 PolarHBondContact O-OG1 3.18Å; T517-T655 CarbonylContact O-C 3.55Å; T517-T655 VanDerWaalsContact O-CA 3.24Å; T517-T655 WeakPolarHBondContact O-CA 3.42Å; T517-T655 WeakPolarHBondContact O-CG2 3.4Å; T517-V656 HydrophobicContact CG2-CB 4.44Å; T517-V656 PolarHBondContact N-O 2.86Å; T517-V656 PolarHBondContact O-N 3.43Å; T517-I682 HydrophobicContact CG2-CG2 3.4Å; T517-I682 VanDerWaalsContact CG2-CG2 3.4Å; T517-V686 HydrophobicContact CG2-CG2 3.9Å
518	S	94.1	Very high	91.2	Very high	12 Å²	12	25.7 Å²	25.7	8%	0.084	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.3	179.5	-62.7	0	0	0	0	109.9	S327 L408 Y409 V654 T655	S327-S518 PolarHBondContact OG-OG 3Å; L408-S518 WeakPolarHBondContact CD1-O 3.36Å; Y409-S518 VanDerWaalsContact OH-CB 3.26Å; Y409-S518 WeakPolarHBondContact OH-CB 3.46Å; Y409-S518 PolarHBondContact OH-OG 3.42Å; S518-V654 CarbonylContact C-O 3.54Å; S518-V654 WeakPolarHBondContact CA-O 3.05Å; S518-T655 WeakPolarHBondContact OG-CG2 2.99Å; S518-T655 PolarHBondContact OG-OG1 3.38Å
519	I	94.2	Very high	92.1	Very high	10 Å²	10	25 Å²	25	5%	0.051	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	157.3	180	64.1	177.9	0	0	0	110.2	V493 L521 L653 V654 V686	V493-I519 HydrophobicContact CG1-CG2 3.91Å; V493-I519 HydrophobicContact CG2-CG2 4.3Å; I519-L521 HydrophobicContact CD1-CD1 4.48Å; I519-L521 HydrophobicContact CD1-CD2 3.93Å; I519-L521 HydrophobicContact CD1-CG 4.18Å; I519-L521 HydrophobicContact CG1-CG 4.41Å; I519-L653 WeakPolarHBondContact O-CA 3.33Å; I519-V654 HydrophobicContact CG1-CB 3.98Å; I519-V654 PolarHBondContact N-O 3.22Å; I519-V654 PolarHBondContact O-N 2.93Å; I519-V686 HydrophobicContact CD1-CG1 3.82Å; I519-V686 HydrophobicContact CD1-CG2 4.45Å; I519-V686 HydrophobicContact CG2-CG1 4.08Å
520	W	94.1	Very high	92.8	Very high	60 Å²	60	23.9 Å²	23.9	23%	0.227	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.2	166.7	176.9	84.2	0	0	0	109.5	L408 P522 D628 S652 L653 H698	L408-W520 HydrophobicContact CD2-CB 3.88Å; W520-P522 HydrophobicContact CH2-CB 3.64Å; W520-P522 HydrophobicContact CH2-CG 4.5Å; W520-P522 HydrophobicContact CZ2-CB 4.25Å; W520-P522 HydrophobicContact CZ3-CB 3.97Å; W520-P522 HydrophobicContact CZ3-CG 4.36Å; W520-D628 PolarHBondContact NE1-OD2 3.32Å; W520-S652 CarbonylContact C-O 3.54Å; W520-S652 WeakPolarHBondContact CA-O 3.25Å; W520-L653 HydrophobicContact CB-CD2 4.09Å; W520-L653 HydrophobicContact CG-CD2 4.42Å; W520-H698 AromaticContact CZ3-ND1 3.98Å
521	L	94.4	Very high	93.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.3	173.3	-62.9	179	0	0	0	109.5	I519 V523 V528 G651 S652 V654 I689 K690 L693 C695	I519-L521 HydrophobicContact CD1-CD1 4.48Å; I519-L521 HydrophobicContact CD1-CD2 3.93Å; I519-L521 HydrophobicContact CD1-CG 4.18Å; I519-L521 HydrophobicContact CG1-CG 4.41Å; L521-V523 HydrophobicContact CB-CB 4.36Å; L521-V523 HydrophobicContact CB-CG2 4.43Å; L521-V523 PolarHBondContact O-N 3.47Å; L521-V528 HydrophobicContact CD1-CG2 4.16Å; L521-G651 CarbonylContact O-C 3.59Å; L521-G651 WeakPolarHBondContact O-CA 3.47Å; L521-S652 PolarHBondContact N-O 2.9Å; L521-S652 PolarHBondContact O-N 3.26Å; L521-V654 HydrophobicContact CD1-CG2 3.74Å; L521-V654 HydrophobicContact CG-CG2 4.23Å; L521-I689 HydrophobicContact CD1-CG2 4.17Å; L521-K690 HydrophobicContact CD2-CG 3.92Å; L521-L693 HydrophobicContact CD1-CD1 3.88Å; L521-C695 HydrophobicContact CD2-CB 4.43Å
522	P	93.6	Very high	93.9	Very high	45 Å²	45	24.8 Å²	24.8	29%	0.292	13%	0.13	S	C	.	.	S	Bend	trans	-75.7	41.8	172.1	34.8	-37.7	0	0	0	111.6	W520 C695	W520-P522 HydrophobicContact CH2-CB 3.64Å; W520-P522 HydrophobicContact CH2-CG 4.5Å; W520-P522 HydrophobicContact CZ2-CB 4.25Å; W520-P522 HydrophobicContact CZ3-CB 3.97Å; W520-P522 HydrophobicContact CZ3-CG 4.36Å; P522-C695 HydrophobicContact CG-CB 4.42Å
523	V	94	Very high	94.2	Very high	6 Å²	6	28 Å²	28	4%	0.036	14%	0.142	C	C	.	.	S	Bend	trans	-130.5	131	-175.8	-176	0	0	0	0	108.3	L521 R527 V528 G651 S652 L693 C695	L521-V523 HydrophobicContact CB-CB 4.36Å; L521-V523 HydrophobicContact CB-CG2 4.43Å; L521-V523 PolarHBondContact O-N 3.47Å; V523-R527 HydrophobicContact CG1-CB 3.68Å; V523-V528 HydrophobicContact CB-CG2 3.84Å; V523-V528 HydrophobicContact CG1-CG2 3.7Å; V523-G651 CarbonylContact O-C 3.56Å; V523-S652 VanDerWaalsContact O-CB 3.28Å; V523-S652 WeakPolarHBondContact O-CB 3.44Å; V523-S652 PolarHBondContact O-N 3.44Å; V523-S652 PolarHBondContact O-OG 2.79Å; V523-L693 HydrophobicContact CG2-CB 4.36Å; V523-C695 WeakPolarHBondContact CG2-SG 3.45Å
524	P	94.1	Very high	94.5	Very high	31 Å²	31	30.9 Å²	30.9	20%	0.201	16%	0.157	C	C	.	.			trans	-55	147	174.2	-30.7	38.2	0	0	0	113.7	D526 R527 V528 A649 A650	P524-D526 VanDerWaalsContact C-N 3.3Å; P524-D526 WeakPolarHBondContact CB-OD1 3.36Å; P524-D526 PolarHBondContact O-N 2.85Å; P524-R527 PolarHBondContact O-N 3.42Å; P524-R527 VanDerWaalsContact O-N 3.14Å; P524-V528 PolarHBondContact O-N 3.39Å; P524-V528 VanDerWaalsContact O-N 3.15Å; P524-A649 HydrophobicContact CG-CB 4.11Å; P524-A650 WeakPolarHBondContact CA-O 3.38Å
525	C	95	Very high	94.5	Very high	28 Å²	28	33.2 Å²	33.2	19%	0.189	17%	0.168	C	C	.	.	H	α-helix	trans	-57.2	-40.4	-175.1	-67.8	0	0	0	0	113.2	R527 V528 F529 I625 L626 S652	C525-R527 VanDerWaalsContact C-N 3.33Å; C525-R527 PolarHBondContact O-N 2.97Å; C525-V528 PolarHBondContact O-N 3.44Å; C525-F529 VanDerWaalsContact O-CB 3.24Å; C525-F529 WeakPolarHBondContact O-CB 3.39Å; C525-F529 PolarHBondContact O-N 3.14Å; C525-I625 HydrophobicContact CB-CG2 3.82Å; C525-L626 PolarHBondContact SG-O 2.84Å; C525-L626 VanDerWaalsContact SG-O 3.38Å; C525-S652 VanDerWaalsContact SG-CB 3.59Å
526	D	94.6	Very high	94.5	Very high	103 Å²	103	39.7 Å²	39.7	55%	0.551	20%	0.198	S	C	*	.	H	α-helix	trans	-62.2	-39.8	179.3	62.1	-53.8	0	0	0	111.9	P524 A530	P524-D526 VanDerWaalsContact C-N 3.3Å; P524-D526 WeakPolarHBondContact CB-OD1 3.36Å; P524-D526 PolarHBondContact O-N 2.85Å; D526-A530 VanDerWaalsContact O-CB 3.29Å; D526-A530 WeakPolarHBondContact O-CB 3.44Å; D526-A530 PolarHBondContact O-N 3.19Å
527	R	95.3	Very high	94.5	Very high	147 Å²	147	40.7 Å²	40.7	56%	0.555	20%	0.204	S	C	*	.	H	α-helix	trans	-69.7	-42.9	176.7	-73	-171.7	64.2	-164.3	-3.8	112.1	V523 P524 C525 F529 F531	V523-R527 HydrophobicContact CG1-CB 3.68Å; P524-R527 PolarHBondContact O-N 3.42Å; P524-R527 VanDerWaalsContact O-N 3.14Å; C525-R527 VanDerWaalsContact C-N 3.33Å; C525-R527 PolarHBondContact O-N 2.97Å; R527-F529 VanDerWaalsContact C-N 3.34Å; R527-F531 WeakPolarHBondContact O-CB 3.37Å; R527-F531 PolarHBondContact O-N 3.35Å
528	V	96.4	Very high	94.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-46	175.2	-179	0	0	0	0	109.9	L521 V523 P524 C525 A530 F531 V532 I625 S652 V654 L693	L521-V528 HydrophobicContact CD1-CG2 4.16Å; V523-V528 HydrophobicContact CB-CG2 3.84Å; V523-V528 HydrophobicContact CG1-CG2 3.7Å; P524-V528 PolarHBondContact O-N 3.39Å; P524-V528 VanDerWaalsContact O-N 3.15Å; C525-V528 PolarHBondContact O-N 3.44Å; V528-A530 PolarHBondContact O-N 3.02Å; V528-F531 WeakPolarHBondContact O-CB 3.38Å; V528-F531 PolarHBondContact O-N 3.24Å; V528-F531 VanDerWaalsContact O-N 3.16Å; V528-V532 HydrophobicContact CG1-CG1 4.44Å; V528-V532 WeakPolarHBondContact O-CG2 3.21Å; V528-V532 PolarHBondContact O-N 3.5Å; V528-I625 HydrophobicContact CB-CD1 4.22Å; V528-I625 HydrophobicContact CB-CG2 4.25Å; V528-I625 HydrophobicContact CG1-CD1 3.76Å; V528-I625 HydrophobicContact CG1-CG1 4.08Å; V528-I625 HydrophobicContact CG1-CG2 4.39Å; V528-S652 WeakPolarHBondContact CG2-OG 3.29Å; V528-V654 HydrophobicContact CG1-CG2 3.86Å; V528-L693 HydrophobicContact CG2-CD1 4.16Å
529	F	97.4	Very high	94.2	Very high	7 Å²	7	42.1 Å²	42.1	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-60.9	-45.8	178.9	173.7	-110.3	0	0	0	112.2	C525 R527 F531 R533 C586 T587 S592 V594 I625	C525-F529 VanDerWaalsContact O-CB 3.24Å; C525-F529 WeakPolarHBondContact O-CB 3.39Å; C525-F529 PolarHBondContact O-N 3.14Å; R527-F529 VanDerWaalsContact C-N 3.34Å; F529-F531 VanDerWaalsContact C-N 3.29Å; F529-F531 PolarHBondContact O-N 3.29Å; F529-R533 WeakPolarHBondContact O-CB 3.24Å; F529-R533 PolarHBondContact O-N 2.91Å; F529-R533 VanDerWaalsContact O-N 3.15Å; F529-C586 WeakPolarHBondContact CE2-O 3.45Å; F529-T587 HydrophobicContact CD1-CG2 4.07Å; F529-T587 HydrophobicContact CE1-CG2 3.45Å; F529-T587 VanDerWaalsContact CE1-CG2 3.45Å; F529-T587 HydrophobicContact CZ-CG2 3.78Å; F529-S592 VanDerWaalsContact CD2-CB 3.41Å; F529-V594 HydrophobicContact CD2-CG2 3.79Å; F529-V594 HydrophobicContact CE2-CG2 3.73Å; F529-I625 VanDerWaalsContact CA-CD1 3.48Å; F529-I625 HydrophobicContact CB-CD1 3.82Å; F529-I625 HydrophobicContact CD2-CD1 4.39Å
530	A	96.3	Very high	94	Very high	45 Å²	45	45.8 Å²	45.8	37%	0.372	23%	0.23	S	C	.	.	H	α-helix	trans	-58.6	-43.1	174.6	0	0	0	0	0	111.3	D526 V528 D534	D526-A530 VanDerWaalsContact O-CB 3.29Å; D526-A530 WeakPolarHBondContact O-CB 3.44Å; D526-A530 PolarHBondContact O-N 3.19Å; V528-A530 PolarHBondContact O-N 3.02Å; A530-D534 VanDerWaalsContact O-CB 3.24Å; A530-D534 WeakPolarHBondContact O-CB 3.46Å; A530-D534 PolarHBondContact O-N 3.49Å
531	F	96.7	Very high	93.8	Very high	19 Å²	19	43 Å²	43	8%	0.083	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-47.3	-179.6	173.1	-100.4	0	0	0	113.9	R527 V528 F529 R533 T537 Q540 W541 I689 A692 L693	R527-F531 WeakPolarHBondContact O-CB 3.37Å; R527-F531 PolarHBondContact O-N 3.35Å; V528-F531 WeakPolarHBondContact O-CB 3.38Å; V528-F531 PolarHBondContact O-N 3.24Å; V528-F531 VanDerWaalsContact O-N 3.16Å; F529-F531 VanDerWaalsContact C-N 3.29Å; F529-F531 PolarHBondContact O-N 3.29Å; F531-R533 VanDerWaalsContact C-N 3.31Å; F531-R533 PolarHBondContact O-N 3.35Å; F531-T537 HydrophobicContact CD2-CG2 3.94Å; F531-T537 HydrophobicContact CE2-CG2 4.17Å; F531-T537 PolarHBondContact O-OG1 3.43Å; F531-Q540 HydrophobicContact CZ-CB 4.27Å; F531-W541 HydrophobicContact CE1-CB 4.44Å; F531-W541 AromaticContact CE1-CD1 3.57Å; F531-W541 HydrophobicContact CE1-CG 4.26Å; F531-W541 AromaticContact CZ-CD1 3.7Å; F531-I689 HydrophobicContact CE1-CG1 4.29Å; F531-I689 HydrophobicContact CE1-CG2 4.37Å; F531-A692 HydrophobicContact CE1-CB 4.28Å; F531-A692 HydrophobicContact CE2-CB 3.69Å; F531-A692 HydrophobicContact CZ-CB 3.34Å; F531-L693 HydrophobicContact CB-CD2 4.01Å; F531-L693 HydrophobicContact CD1-CD1 4.27Å; F531-L693 HydrophobicContact CD1-CD2 4.04Å; F531-L693 HydrophobicContact CD1-CG 4.15Å; F531-L693 HydrophobicContact CD2-CD2 4.1Å; F531-L693 HydrophobicContact CE1-CG 4.38Å; F531-L693 HydrophobicContact CG-CD2 3.77Å; F531-L693 HydrophobicContact CG-CG 4.37Å
532	V	96	Very high	93.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-77.3	-18.6	-177.1	-62.6	0	0	0	0	113.2	V528 W541 V594 F623 I625	V528-V532 HydrophobicContact CG1-CG1 4.44Å; V528-V532 WeakPolarHBondContact O-CG2 3.21Å; V528-V532 PolarHBondContact O-N 3.5Å; V532-W541 WeakPolarHBondContact O-CZ2 3.36Å; V532-V594 HydrophobicContact CG2-CB 4.27Å; V532-V594 HydrophobicContact CG2-CG2 3.81Å; V532-F623 HydrophobicContact CB-CD2 3.91Å; V532-F623 HydrophobicContact CB-CE2 4.15Å; V532-F623 HydrophobicContact CB-CG 4.35Å; V532-F623 HydrophobicContact CG1-CD2 4.27Å; V532-F623 HydrophobicContact CG1-CE2 4.39Å; V532-F623 HydrophobicContact CG1-CG 4.33Å; V532-F623 HydrophobicContact CG2-CB 4.41Å; V532-F623 HydrophobicContact CG2-CD2 4.16Å; V532-F623 HydrophobicContact CG2-CG 4.39Å; V532-I625 HydrophobicContact CG2-CD1 3.87Å
533	R	95	Very high	92.7	Very high	68 Å²	68	43 Å²	43	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-87.3	-35.3	179.3	-178.6	-172.7	64.7	123.5	0.8	113.1	F529 F531 P562 G563 Q583 S585 V594	F529-R533 WeakPolarHBondContact O-CB 3.24Å; F529-R533 PolarHBondContact O-N 2.91Å; F529-R533 VanDerWaalsContact O-N 3.15Å; F531-R533 VanDerWaalsContact C-N 3.31Å; F531-R533 PolarHBondContact O-N 3.35Å; R533-P562 PolarHBondContact NH1-O 2.92Å; R533-G563 WeakPolarHBondContact CD-O 3.24Å; R533-Q583 PolarHBondContact O-NE2 3.2Å; R533-Q583 VanDerWaalsContact O-NE2 3.15Å; R533-S585 VanDerWaalsContact CD-CB 3.47Å; R533-S585 WeakPolarHBondContact CD-OG 3.37Å; R533-V594 HydrophobicContact CB-CG2 4.13Å
534	D	93.3	Very high	91.7	Very high	61 Å²	61	47 Å²	47	33%	0.326	24%	0.239	S	C	.	.			trans	-65.7	133.4	-171	-179.5	6.3	0	0	0	112	A530 H536 T537 R538	A530-D534 VanDerWaalsContact O-CB 3.24Å; A530-D534 WeakPolarHBondContact O-CB 3.46Å; A530-D534 PolarHBondContact O-N 3.49Å; D534-H536 VanDerWaalsContact C-N 3.26Å; D534-H536 PolarHBondContact O-N 3.34Å; D534-H536 IonicContact OD1-CG 2.82Å; D534-H536 PolarHBondContact OD1-N 2.85Å; D534-H536 IonicContact OD1-ND1 3.51Å; D534-H536 PolarHBondContact OD1-ND1 2.97Å; D534-T537 WeakPolarHBondContact CB-OG1 3.44Å; D534-T537 PolarHBondContact O-N 2.96Å; D534-T537 PolarHBondContact O-OG1 3.27Å; D534-T537 VanDerWaalsContact O-OG1 3.1Å; D534-R538 PolarHBondContact O-N 3.46Å
535	E	91	Very high	90.8	Very high	51 Å²	51	46.1 Å²	46.1	24%	0.238	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.7	179.9	68.4	177.4	165.9	0	0	111.9	V550 E552	E535-V550 HydrophobicContact CB-CG2 4.03Å; E535-V550 WeakPolarHBondContact O-CG2 3.42Å; E535-E552 VanDerWaalsContact OE2-CB 3.28Å; E535-E552 WeakPolarHBondContact OE2-CB 3.02Å; E535-E552 PolarHBondContact OE2-N 2.77Å
536	H	91.8	Very high	89.7	Confident	136 Å²	136	51.9 Å²	51.9	63%	0.63	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-27.4	-175.5	-58.1	87.2	0	0	0	112.5	D534	D534-H536 VanDerWaalsContact C-N 3.26Å; D534-H536 PolarHBondContact O-N 3.34Å; D534-H536 IonicContact OD1-CG 2.82Å; D534-H536 PolarHBondContact OD1-N 2.85Å; D534-H536 IonicContact OD1-ND1 3.51Å; D534-H536 PolarHBondContact OD1-ND1 2.97Å
537	T	92.7	Very high	88.8	Confident	22 Å²	22	49.2 Å²	49.2	14%	0.135	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-11.9	179.2	52.7	0	0	0	0	112.5	F531 D534 S539 Q540	F531-T537 HydrophobicContact CD2-CG2 3.94Å; F531-T537 HydrophobicContact CE2-CG2 4.17Å; F531-T537 PolarHBondContact O-OG1 3.43Å; D534-T537 WeakPolarHBondContact CB-OG1 3.44Å; D534-T537 PolarHBondContact O-N 2.96Å; D534-T537 PolarHBondContact O-OG1 3.27Å; D534-T537 VanDerWaalsContact O-OG1 3.1Å; T537-S539 VanDerWaalsContact C-N 3.3Å; T537-S539 PolarHBondContact O-N 3.12Å; T537-Q540 VanDerWaalsContact O-CB 3.22Å; T537-Q540 WeakPolarHBondContact O-CB 3.32Å; T537-Q540 WeakPolarHBondContact O-CG 3.2Å; T537-Q540 PolarHBondContact O-N 3.49Å
538	R	91.8	Very high	88.3	Confident	3 Å²	3	44.3 Å²	44.3	1%	0.011	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-53.9	-42.5	-177	-171.2	175.5	-170.5	106.9	10.8	113.7	D534 Q540 W541 D542 V550 Y596	D534-R538 PolarHBondContact O-N 3.46Å; R538-Q540 PolarHBondContact O-N 2.99Å; R538-W541 HydrophobicContact CB-CZ2 4.32Å; R538-W541 HydrophobicContact CG-CH2 4.08Å; R538-W541 HydrophobicContact CG-CZ2 3.71Å; R538-W541 PolarHBondContact O-N 3.24Å; R538-W541 VanDerWaalsContact O-N 3.13Å; R538-D542 HydrophobicContact CG-CB 3.7Å; R538-D542 IonicContact CZ-OD2 3.08Å; R538-D542 IonicContact NE-OD2 2.8Å; R538-D542 PolarHBondContact NE-OD2 3.26Å; R538-D542 IonicContact NH2-OD2 3.18Å; R538-D542 PolarHBondContact NH2-OD2 3.28Å; R538-D542 VanDerWaalsContact NH2-OD2 3.15Å; R538-D542 VanDerWaalsContact O-CB 3.22Å; R538-D542 WeakPolarHBondContact O-CB 3.4Å; R538-D542 PolarHBondContact O-N 3.38Å; R538-V550 HydrophobicContact CB-CG2 4.05Å; R538-V550 HydrophobicContact CG-CG2 4.36Å; R538-Y596 VanDerWaalsContact NH2-CD2 3.31Å
539	S	89.7	Confident	87.9	Confident	41 Å²	41	47.6 Å²	47.6	29%	0.287	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-62.1	-15.7	178.9	57.1	0	0	0	0	114	T537	T537-S539 VanDerWaalsContact C-N 3.3Å; T537-S539 PolarHBondContact O-N 3.12Å
540	Q	90.5	Very high	87.5	Confident	88 Å²	88	48 Å²	48	41%	0.411	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-79.9	-21.7	178.8	-56.2	179.8	34	0	0	112.9	F531 T537 R538 Q688 A692	F531-Q540 HydrophobicContact CZ-CB 4.27Å; T537-Q540 VanDerWaalsContact O-CB 3.22Å; T537-Q540 WeakPolarHBondContact O-CB 3.32Å; T537-Q540 WeakPolarHBondContact O-CG 3.2Å; T537-Q540 PolarHBondContact O-N 3.49Å; R538-Q540 PolarHBondContact O-N 2.99Å; Q540-Q688 WeakPolarHBondContact O-CB 3.44Å; Q540-Q688 PolarHBondContact O-OE1 3.19Å; Q540-A692 HydrophobicContact CB-CB 4.29Å
541	W	90.7	Very high	87.2	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-22.1	-176.4	62.3	-100.8	0	0	0	114.4	F531 V532 R538 V543 Y596 F623 Q688 I689	F531-W541 HydrophobicContact CE1-CB 4.44Å; F531-W541 AromaticContact CE1-CD1 3.57Å; F531-W541 HydrophobicContact CE1-CG 4.26Å; F531-W541 AromaticContact CZ-CD1 3.7Å; V532-W541 WeakPolarHBondContact O-CZ2 3.36Å; R538-W541 HydrophobicContact CB-CZ2 4.32Å; R538-W541 HydrophobicContact CG-CH2 4.08Å; R538-W541 HydrophobicContact CG-CZ2 3.71Å; R538-W541 PolarHBondContact O-N 3.24Å; R538-W541 VanDerWaalsContact O-N 3.13Å; W541-V543 PolarHBondContact O-N 3.04Å; W541-Y596 AromaticContact CH2-CE1 3.93Å; W541-Y596 HydrophobicContact CH2-CE1 3.93Å; W541-Y596 HydrophobicContact CZ3-CE1 4.06Å; W541-F623 HydrophobicContact CD2-CE2 4.42Å; W541-F623 HydrophobicContact CD2-CZ 4.17Å; W541-F623 AromaticContact CE3-CE2 3.93Å; W541-F623 HydrophobicContact CE3-CE2 3.93Å; W541-F623 AromaticContact CE3-CZ 3.55Å; W541-F623 HydrophobicContact CE3-CZ 3.55Å; W541-F623 AromaticContact CH2-CE2 3.62Å; W541-F623 HydrophobicContact CH2-CE2 3.62Å; W541-F623 HydrophobicContact CH2-CZ 4.12Å; W541-F623 HydrophobicContact CZ2-CE2 4.09Å; W541-F623 AromaticContact CZ3-CE2 3.52Å; W541-F623 HydrophobicContact CZ3-CE2 3.52Å; W541-F623 AromaticContact CZ3-CZ 3.55Å; W541-F623 HydrophobicContact CZ3-CZ 3.55Å; W541-Q688 VanDerWaalsContact CA-OE1 3.31Å; W541-Q688 PolarHBondContact O-OE1 3.25Å; W541-I689 HydrophobicContact CB-CD1 4.47Å; W541-I689 HydrophobicContact CB-CG1 3.67Å; W541-I689 HydrophobicContact CG-CG1 4.33Å
542	D	86.5	Confident	87	Confident	7 Å²	7	53.2 Å²	53.2	4%	0.037	28%	0.281	C	S	.	.			trans	-78.9	88.3	-178.7	-170.7	-13.4	0	0	0	109.8	R538 L544 S545	R538-D542 HydrophobicContact CG-CB 3.7Å; R538-D542 IonicContact CZ-OD2 3.08Å; R538-D542 IonicContact NE-OD2 2.8Å; R538-D542 PolarHBondContact NE-OD2 3.26Å; R538-D542 IonicContact NH2-OD2 3.18Å; R538-D542 PolarHBondContact NH2-OD2 3.28Å; R538-D542 VanDerWaalsContact NH2-OD2 3.15Å; R538-D542 VanDerWaalsContact O-CB 3.22Å; R538-D542 WeakPolarHBondContact O-CB 3.4Å; R538-D542 PolarHBondContact O-N 3.38Å; D542-L544 PolarHBondContact O-N 2.92Å; D542-L544 VanDerWaalsContact O-N 3.16Å; D542-L544 WeakPolarHBondContact OD1-CB 3.47Å; D542-L544 PolarHBondContact OD1-N 3.44Å; D542-L544 VanDerWaalsContact OD1-N 3.08Å; D542-S545 WeakPolarHBondContact O-CB 3.47Å; D542-S545 PolarHBondContact O-N 2.89Å; D542-S545 PolarHBondContact O-OG 3.03Å; D542-S545 PolarHBondContact OD1-N 3.21Å
543	V	77.3	Confident	86.7	Confident	37 Å²	37	56.7 Å²	56.7	22%	0.224	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-56.4	-30	178.3	-176.8	0	0	0	0	111.8	W541 S545 H546 L681 T684	W541-V543 PolarHBondContact O-N 3.04Å; V543-S545 VanDerWaalsContact C-N 3.29Å; V543-S545 PolarHBondContact O-N 2.86Å; V543-H546 PolarHBondContact O-N 2.92Å; V543-L681 HydrophobicContact CB-CD1 3.68Å; V543-L681 HydrophobicContact CG1-CD1 3.67Å; V543-L681 HydrophobicContact CG2-CD1 4.38Å; V543-T684 HydrophobicContact CG2-CG2 3.89Å
544	L	73.9	Confident	86.5	Confident	91 Å²	91	54 Å²	54	48%	0.476	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-73.8	-22.3	179.5	-57.3	175.7	0	0	0	112.4	D542 H546 L681	D542-L544 PolarHBondContact O-N 2.92Å; D542-L544 VanDerWaalsContact O-N 3.16Å; D542-L544 WeakPolarHBondContact OD1-CB 3.47Å; D542-L544 PolarHBondContact OD1-N 3.44Å; D542-L544 VanDerWaalsContact OD1-N 3.08Å; L544-H546 PolarHBondContact O-N 2.82Å; L544-L681 HydrophobicContact CD2-CD1 4.1Å; L544-L681 HydrophobicContact CD2-CD2 4.33Å
545	S	74.1	Confident	86.4	Confident	13 Å²	13	55 Å²	55	9%	0.091	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-76.1	-9.4	174.6	76.3	0	0	0	0	113.4	D542 V543 G547 N548	D542-S545 WeakPolarHBondContact O-CB 3.47Å; D542-S545 PolarHBondContact O-N 2.89Å; D542-S545 PolarHBondContact O-OG 3.03Å; D542-S545 PolarHBondContact OD1-N 3.21Å; V543-S545 VanDerWaalsContact C-N 3.29Å; V543-S545 PolarHBondContact O-N 2.86Å; S545-G547 PolarHBondContact O-N 2.87Å; S545-G547 VanDerWaalsContact O-N 3.16Å; S545-G547 PolarHBondContact OG-N 3.44Å; S545-N548 VanDerWaalsContact O-CB 3.31Å; S545-N548 WeakPolarHBondContact O-CB 3.29Å; S545-N548 PolarHBondContact O-N 2.86Å; S545-N548 PolarHBondContact O-ND2 2.72Å
546	H	73.6	Confident	86.5	Confident	148 Å²	148	53 Å²	53	69%	0.685	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	36.1	-173.7	-60.6	-69.8	0	0	0	113.5	V543 L544 N548	V543-H546 PolarHBondContact O-N 2.92Å; L544-H546 PolarHBondContact O-N 2.82Å; H546-N548 VanDerWaalsContact C-N 3.28Å; H546-N548 PolarHBondContact O-N 2.85Å; H546-N548 PolarHBondContact O-ND2 3.3Å
547	G	75.4	Confident	86.6	Confident	47 Å²	47	49.1 Å²	49.1	49%	0.485	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	7.5	-179.8	0	0	0	0	0	114.8	S545	S545-G547 PolarHBondContact O-N 2.87Å; S545-G547 VanDerWaalsContact O-N 3.16Å; S545-G547 PolarHBondContact OG-N 3.44Å
548	N	84.3	Confident	86.6	Confident	45 Å²	45	48.3 Å²	48.3	24%	0.241	27%	0.265	C	S	.	.			trans	-84.5	137.9	-177.2	-61.5	-70.7	0	0	0	111.1	S545 H546 N573	S545-N548 VanDerWaalsContact O-CB 3.31Å; S545-N548 WeakPolarHBondContact O-CB 3.29Å; S545-N548 PolarHBondContact O-N 2.86Å; S545-N548 PolarHBondContact O-ND2 2.72Å; H546-N548 VanDerWaalsContact C-N 3.28Å; H546-N548 PolarHBondContact O-N 2.85Å; H546-N548 PolarHBondContact O-ND2 3.3Å; N548-N573 VanDerWaalsContact CB-OD1 3.31Å; N548-N573 WeakPolarHBondContact CB-OD1 3.43Å; N548-N573 PolarHBondContact ND2-ND2 2.92Å; N548-N573 PolarHBondContact ND2-OD1 3.35Å; N548-N573 PolarHBondContact OD1-OD1 3.47Å
549	P	87	Confident	86.6	Confident	68 Å²	68	48.8 Å²	48.8	44%	0.442	27%	0.271	S	S	.	.			trans	-66.1	148.8	177.2	26.2	-32.2	0	0	0	111	L572	P549-L572 HydrophobicContact CB-CD1 4.2Å; P549-L572 HydrophobicContact CG-CB 4.37Å; P549-L572 HydrophobicContact CG-CD1 3.93Å; P549-L572 PolarHBondContact O-N 3.36Å
550	V	89.5	Confident	86.6	Confident	15 Å²	15	51.3 Å²	51.3	9%	0.091	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	157.2	172	-64.1	0	0	0	0	109.7	E535 R538 L569 R570 I581	E535-V550 HydrophobicContact CB-CG2 4.03Å; E535-V550 WeakPolarHBondContact O-CG2 3.42Å; R538-V550 HydrophobicContact CB-CG2 4.05Å; R538-V550 HydrophobicContact CG-CG2 4.36Å; V550-L569 HydrophobicContact CB-CB 4.31Å; V550-L569 HydrophobicContact CG2-CD1 4.32Å; V550-R570 CarbonylContact C-O 3.58Å; V550-R570 VanDerWaalsContact CA-O 3.3Å; V550-R570 WeakPolarHBondContact CA-O 3.41Å; V550-I581 HydrophobicContact CG1-CD1 4.44Å
551	Q	90.6	Very high	86.7	Confident	107 Å²	107	51.2 Å²	51.2	50%	0.5	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131	175.5	-178.5	-178.8	23.2	0	0	109.7	V553 L569 R570 L572	Q551-V553 PolarHBondContact O-N 3.3Å; Q551-L569 CarbonylContact O-C 3.59Å; Q551-L569 WeakPolarHBondContact O-CA 3.26Å; Q551-R570 PolarHBondContact N-O 3.21Å; Q551-R570 PolarHBondContact O-N 2.87Å; Q551-L572 HydrophobicContact CB-CD2 4.23Å
552	E	91.8	Very high	86.7	Confident	68 Å²	68	55.3 Å²	55.3	32%	0.318	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	120.2	170.7	-170.6	174.8	81.2	0	0	111.1	E535 R555 S567 L569	E535-E552 VanDerWaalsContact OE2-CB 3.28Å; E535-E552 WeakPolarHBondContact OE2-CB 3.02Å; E535-E552 PolarHBondContact OE2-N 2.77Å; E552-R555 HydrophobicContact CG-CB 4.47Å; E552-R555 WeakPolarHBondContact OE1-CB 3.31Å; E552-R555 WeakPolarHBondContact OE1-CD 3.31Å; E552-S567 VanDerWaalsContact OE2-CB 3.24Å; E552-S567 WeakPolarHBondContact OE2-CB 3.39Å; E552-S567 PolarHBondContact OE2-OG 3.44Å; E552-L569 HydrophobicContact CB-CD2 3.93Å; E552-L569 HydrophobicContact CG-CD2 4.18Å
553	V	89.9	Confident	87.1	Confident	73 Å²	73	55 Å²	55	44%	0.442	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-35.4	179.4	-178.7	0	0	0	0	111	Q551 L568 R570	Q551-V553 PolarHBondContact O-N 3.3Å; V553-L568 PolarHBondContact N-O 3.16Å; V553-R570 HydrophobicContact CG2-CB 3.58Å
554	S	90.5	Very high	88	Confident	13 Å²	13	53.5 Å²	53.5	9%	0.091	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	145.8	-178.7	165.4	0	0	0	0	109.6	S567 L568	S554-S567 WeakPolarHBondContact O-CA 3.22Å; S554-L568 PolarHBondContact O-N 2.98Å
555	R	92.1	Very high	89.1	Confident	80 Å²	80	49.2 Å²	49.2	30%	0.302	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	124.9	178	-171.8	170.5	175.4	-95	-3.8	110.9	V450 E552 P562 C565 I566	V450-R555 WeakPolarHBondContact CG2-O 3.42Å; E552-R555 HydrophobicContact CG-CB 4.47Å; E552-R555 WeakPolarHBondContact OE1-CB 3.31Å; E552-R555 WeakPolarHBondContact OE1-CD 3.31Å; R555-P562 PolarHBondContact NH2-O 3.46Å; R555-C565 HydrophobicContact CG-CB 4.06Å; R555-I566 CarbonylContact C-O 3.58Å; R555-I566 WeakPolarHBondContact CA-O 3.24Å
556	I	93.3	Very high	90.1	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.051	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	109.1	177.8	-57.6	175.6	0	0	0	107.9	V453 K458 M461 M462 N558 C565 I566	V453-I556 HydrophobicContact CG1-CD1 4.22Å; K458-I556 HydrophobicContact CD-CG2 4.28Å; K458-I556 HydrophobicContact CG-CG2 3.79Å; M461-I556 HydrophobicContact CB-CD1 3.81Å; M461-I556 HydrophobicContact CG-CD1 3.68Å; M462-I556 HydrophobicContact CE-CG2 4.5Å; I556-N558 PolarHBondContact O-N 2.99Å; I556-C565 CarbonylContact O-C 3.48Å; I556-C565 VanDerWaalsContact O-CA 3.29Å; I556-C565 WeakPolarHBondContact O-CA 3.37Å; I556-I566 HydrophobicContact CB-CB 4.28Å; I556-I566 PolarHBondContact N-O 2.98Å; I556-I566 PolarHBondContact O-N 3.16Å
557	P	92.7	Very high	91.1	Very high	54 Å²	54	41.9 Å²	41.9	35%	0.351	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	136.1	171.7	-22.4	33.6	0	0	0	111.1
558	N	93	Very high	92	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.032	22%	0.224	C	C	.	.			trans	-124.5	15.1	177.7	71.3	-5.8	0	0	0	113	R434 M462 I556 N564 C565 E584	R434-N558 WeakPolarHBondContact CA-O 3.36Å; R434-N558 HydrophobicContact CG-CB 4.42Å; R434-N558 PolarHBondContact NH1-ND2 2.93Å; M462-N558 HydrophobicContact CE-CB 3.45Å; M462-N558 VanDerWaalsContact CE-CB 3.45Å; I556-N558 PolarHBondContact O-N 2.99Å; N558-N564 PolarHBondContact N-O 2.72Å; N558-N564 VanDerWaalsContact N-O 3.16Å; N558-N564 WeakPolarHBondContact OD1-CA 3.24Å; N558-N564 WeakPolarHBondContact OD1-CB 3.32Å; N558-N564 PolarHBondContact OD1-O 3.46Å; N558-C565 PolarHBondContact OD1-N 2.97Å; N558-E584 PolarHBondContact ND2-OE1 2.92Å
559	G	91.6	Very high	92.4	Very high	13 Å²	13	37.8 Å²	37.8	13%	0.134	21%	0.214	C	C	.	.	S	Bend	trans	-175.6	-178.5	176.3	0	0	0	0	0	112.1
560	S	89.9	Confident	92.5	Very high	94 Å²	94	39.3 Å²	39.3	66%	0.657	21%	0.21	S	C	*	.	S	Bend	trans	-73.3	-34.8	-178.4	60.1	0	0	0	0	113	E433	E433-S560 VanDerWaalsContact CD-OG 3.3Å; E433-S560 PolarHBondContact OE1-OG 2.92Å; E433-S560 PolarHBondContact OE2-N 2.88Å; E433-S560 PolarHBondContact OE2-OG 2.88Å; E433-S560 VanDerWaalsContact OE2-OG 3.11Å
561	H	92.9	Very high	92.3	Very high	86 Å²	86	39.6 Å²	39.6	40%	0.398	22%	0.216	S	C	.	.	S	Bend	trans	-72.1	135	179.8	-173.2	-96.3	0	0	0	111	G563 N564 T587	H561-G563 PolarHBondContact CE1-N 3.39Å; H561-G563 WeakPolarHBondContact ND1-CA 3.49Å; H561-G563 PolarHBondContact ND1-N 3.24Å; H561-G563 PolarHBondContact O-N 3.1Å; H561-N564 HydrophobicContact CB-CB 4.46Å; H561-N564 WeakPolarHBondContact O-CB 3.37Å; H561-N564 PolarHBondContact O-N 2.88Å; H561-T587 WeakPolarHBondContact CE1-CG2 3.44Å; H561-T587 WeakPolarHBondContact ND1-CG2 3.46Å
562	P	91.7	Very high	91.8	Very high	87 Å²	87	39.3 Å²	39.3	57%	0.565	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17	179.6	26.7	-36	0	0	0	113.6	R533 R555 N564	R533-P562 PolarHBondContact NH1-O 2.92Å; R555-P562 PolarHBondContact NH2-O 3.46Å; P562-N564 VanDerWaalsContact C-N 3.27Å
563	G	94.2	Very high	90.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-31	166.6	0	0	0	0	0	114.8	R533 H561 C565 S585	R533-G563 WeakPolarHBondContact CD-O 3.24Å; H561-G563 PolarHBondContact CE1-N 3.39Å; H561-G563 WeakPolarHBondContact ND1-CA 3.49Å; H561-G563 PolarHBondContact ND1-N 3.24Å; H561-G563 PolarHBondContact O-N 3.1Å; G563-C565 PolarHBondContact O-N 3.38Å; G563-S585 WeakPolarHBondContact O-CB 3.38Å; G563-S585 PolarHBondContact O-OG 2.89Å
564	N	96.5	Very high	89.1	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.027	23%	0.228	C	C	.	.			trans	-91.4	98.8	-166.4	-64.7	0.4	0	0	0	107.9	N558 H561 P562 S585 C586 T587	N558-N564 PolarHBondContact N-O 2.72Å; N558-N564 VanDerWaalsContact N-O 3.16Å; N558-N564 WeakPolarHBondContact OD1-CA 3.24Å; N558-N564 WeakPolarHBondContact OD1-CB 3.32Å; N558-N564 PolarHBondContact OD1-O 3.46Å; H561-N564 HydrophobicContact CB-CB 4.46Å; H561-N564 WeakPolarHBondContact O-CB 3.37Å; H561-N564 PolarHBondContact O-N 2.88Å; P562-N564 VanDerWaalsContact C-N 3.27Å; N564-S585 WeakPolarHBondContact CA-O 3.27Å; N564-C586 VanDerWaalsContact OD1-CA 3.32Å; N564-C586 WeakPolarHBondContact OD1-CA 3.28Å; N564-T587 PolarHBondContact ND2-O 3.28Å; N564-T587 VanDerWaalsContact ND2-O 3.16Å; N564-T587 WeakPolarHBondContact OD1-CG2 3.19Å; N564-T587 PolarHBondContact OD1-N 3.09Å; N564-T587 PolarHBondContact OD1-O 2.91Å
565	C	96.1	Very high	87.5	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.014	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	162.3	178.3	55.7	0	0	0	0	113	R555 I556 N558 G563 S585	R555-C565 HydrophobicContact CG-CB 4.06Å; I556-C565 CarbonylContact O-C 3.48Å; I556-C565 VanDerWaalsContact O-CA 3.29Å; I556-C565 WeakPolarHBondContact O-CA 3.37Å; N558-C565 PolarHBondContact OD1-N 2.97Å; G563-C565 PolarHBondContact O-N 3.38Å; C565-S585 PolarHBondContact N-O 3.47Å; C565-S585 VanDerWaalsContact N-O 3.13Å; C565-S585 PolarHBondContact O-N 3.22Å; C565-S585 PolarHBondContact O-OG 3.5Å
566	I	96.4	Very high	86	Confident	3 Å²	3	44 Å²	44	2%	0.015	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.2	164.7	-55.1	158	0	0	0	106.9	M461 M462 S465 R555 I556 L582 Q583 E584	M461-I566 HydrophobicContact CG-CG2 4.1Å; M462-I566 HydrophobicContact CB-CD1 4.34Å; M462-I566 HydrophobicContact CE-CD1 4.38Å; M462-I566 HydrophobicContact CG-CD1 3.6Å; S465-I566 WeakPolarHBondContact OG-CD1 3.41Å; R555-I566 CarbonylContact C-O 3.58Å; R555-I566 WeakPolarHBondContact CA-O 3.24Å; I556-I566 HydrophobicContact CB-CB 4.28Å; I556-I566 PolarHBondContact N-O 2.98Å; I556-I566 PolarHBondContact O-N 3.16Å; I566-L582 HydrophobicContact CG2-CD1 3.52Å; I566-Q583 CarbonylContact C-O 3.54Å; I566-Q583 VanDerWaalsContact CA-O 3.23Å; I566-Q583 WeakPolarHBondContact CA-O 3.34Å; I566-E584 HydrophobicContact CG1-CB 4.39Å; I566-E584 HydrophobicContact CG1-CG 4.28Å
567	S	94.8	Very high	84.7	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.028	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	138.4	-179.5	-62.5	0	0	0	0	110.1	E552 S554 Q583	E552-S567 VanDerWaalsContact OE2-CB 3.24Å; E552-S567 WeakPolarHBondContact OE2-CB 3.39Å; E552-S567 PolarHBondContact OE2-OG 3.44Å; S554-S567 WeakPolarHBondContact O-CA 3.22Å; S567-Q583 PolarHBondContact N-O 3.39Å; S567-Q583 PolarHBondContact O-N 3.25Å
568	L	93.9	Very high	84.1	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.9	166	-77.1	174.5	0	0	0	108.3	M461 V553 S554 I581 L582 I599 M608	M461-L568 HydrophobicContact CE-CD1 3.85Å; M461-L568 HydrophobicContact CE-CD2 4.49Å; M461-L568 HydrophobicContact CE-CG 4.4Å; V553-L568 PolarHBondContact N-O 3.16Å; S554-L568 PolarHBondContact O-N 2.98Å; L568-I581 WeakPolarHBondContact CA-O 3.34Å; L568-L582 HydrophobicContact CD2-CB 4.23Å; L568-L582 HydrophobicContact CD2-CD1 3.96Å; L568-I599 HydrophobicContact CD2-CG2 4.24Å; L568-M608 HydrophobicContact CD1-CE 4.5Å; L568-M608 HydrophobicContact CD1-SD 3.82Å
569	L	92.4	Very high	83.9	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.016	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	140.5	-178.6	-45.9	174.5	0	0	0	110.1	V550 Q551 E552 L580 I581	V550-L569 HydrophobicContact CB-CB 4.31Å; V550-L569 HydrophobicContact CG2-CD1 4.32Å; Q551-L569 CarbonylContact O-C 3.59Å; Q551-L569 WeakPolarHBondContact O-CA 3.26Å; E552-L569 HydrophobicContact CB-CD2 3.93Å; E552-L569 HydrophobicContact CG-CD2 4.18Å; L569-L580 CarbonylContact O-C 3.55Å; L569-L580 WeakPolarHBondContact O-CA 3.29Å; L569-I581 HydrophobicContact CB-CB 4.19Å; L569-I581 PolarHBondContact N-O 3.28Å; L569-I581 PolarHBondContact O-N 3.02Å
570	R	89.6	Confident	83.9	Confident	100 Å²	100	53.6 Å²	53.6	38%	0.377	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.6	173.8	176.9	178.4	-72.6	176.1	-2.3	109.3	V550 Q551 V553 L580	V550-R570 CarbonylContact C-O 3.58Å; V550-R570 VanDerWaalsContact CA-O 3.3Å; V550-R570 WeakPolarHBondContact CA-O 3.41Å; Q551-R570 PolarHBondContact N-O 3.21Å; Q551-R570 PolarHBondContact O-N 2.87Å; V553-R570 HydrophobicContact CG2-CB 3.58Å; R570-L580 HydrophobicContact CB-CD2 3.78Å; R570-L580 HydrophobicContact CG-CD2 4.19Å
571	G	85.6	Confident	84	Confident	21 Å²	21	50.8 Å²	50.8	22%	0.216	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.4	169.6	0	0	0	0	0	111.3	N573	G571-N573 PolarHBondContact O-N 3.33Å; G571-N573 VanDerWaalsContact O-N 3.16Å
572	L	79.8	Confident	84.1	Confident	101 Å²	101	46.7 Å²	46.7	53%	0.529	27%	0.274	S	S	.	.			trans	-81.8	18.9	-179	-66	175.4	0	0	0	114	P549 Q551	P549-L572 HydrophobicContact CB-CD1 4.2Å; P549-L572 HydrophobicContact CG-CB 4.37Å; P549-L572 HydrophobicContact CG-CD1 3.93Å; P549-L572 PolarHBondContact O-N 3.36Å; Q551-L572 HydrophobicContact CB-CD2 4.23Å
573	N	71.6	Confident	84.4	Confident	35 Å²	35	42.7 Å²	42.7	19%	0.187	25%	0.247	C	C	.	.			trans	-88.9	128.2	178.8	-81.1	-6.7	0	0	0	112.9	N548 G571 S575 Q576	N548-N573 VanDerWaalsContact CB-OD1 3.31Å; N548-N573 WeakPolarHBondContact CB-OD1 3.43Å; N548-N573 PolarHBondContact ND2-ND2 2.92Å; N548-N573 PolarHBondContact ND2-OD1 3.35Å; N548-N573 PolarHBondContact OD1-OD1 3.47Å; G571-N573 PolarHBondContact O-N 3.33Å; G571-N573 VanDerWaalsContact O-N 3.16Å; N573-S575 PolarHBondContact O-N 2.82Å; N573-Q576 PolarHBondContact O-N 3.11Å
574	A	52.4	Low	84.5	Confident	95 Å²	95	43.2 Å²	43.2	79%	0.785	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-22.8	178.2	0	0	0	0	0	114.7
575	S	58.1	Low	84.6	Confident	106 Å²	106	43 Å²	43	74%	0.741	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-18	-176.8	58.2	0	0	0	0	115.1	N573	N573-S575 PolarHBondContact O-N 2.82Å
576	Q	58.9	Low	84.6	Confident	97 Å²	97	43.6 Å²	43.6	45%	0.453	25%	0.253	S	S	.	.			trans	-111.2	31.7	-175.8	-69.9	-170.8	-13.2	0	0	113	N573 S578 M579	N573-Q576 PolarHBondContact O-N 3.11Å; Q576-S578 PolarHBondContact O-N 3.35Å; Q576-M579 PolarHBondContact O-N 2.72Å
577	N	66.1	Low	84.6	Confident	106 Å²	106	44.5 Å²	44.5	57%	0.567	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	0.6	-176.9	-89.1	-9.7	0	0	0	115.4	I601	N577-I601 WeakPolarHBondContact O-CD1 3.26Å
578	S	80.9	Confident	84.5	Confident	75 Å²	75	46 Å²	46	52%	0.524	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-10.2	-177.8	62.8	0	0	0	0	114.8	Q576 I601	Q576-S578 PolarHBondContact O-N 3.35Å; S578-I601 PolarHBondContact O-N 3.47Å
579	M	88.1	Confident	84.2	Confident	97 Å²	97	49.9 Å²	49.9	48%	0.478	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.6	-174.7	-69.2	-70.1	-171.1	0	0	111.4	Q576 D600	Q576-M579 PolarHBondContact O-N 2.72Å; M579-D600 HydrophobicContact CE-CB 4.34Å; M579-D600 HydrophobicContact SD-CB 3.86Å
580	L	91.4	Very high	84.2	Confident	7 Å²	7	50.7 Å²	50.7	4%	0.037	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	165.6	167.6	-58.9	176.4	0	0	0	108.9	L569 R570 P598 I599 I601 A604	L569-L580 CarbonylContact O-C 3.55Å; L569-L580 WeakPolarHBondContact O-CA 3.29Å; R570-L580 HydrophobicContact CB-CD2 3.78Å; R570-L580 HydrophobicContact CG-CD2 4.19Å; L580-P598 CarbonylContact O-C 3.54Å; L580-P598 WeakPolarHBondContact O-CA 3.22Å; L580-I599 HydrophobicContact CB-CG2 3.89Å; L580-I599 PolarHBondContact N-O 2.78Å; L580-I599 PolarHBondContact O-N 3.03Å; L580-I601 HydrophobicContact CD1-CG1 4.21Å; L580-I601 HydrophobicContact CD2-CG1 4.32Å; L580-I601 HydrophobicContact CG-CG1 3.86Å; L580-A604 HydrophobicContact CD1-CB 3.92Å
581	I	92.6	Very high	84.4	Confident	34 Å²	34	46.4 Å²	46.4	17%	0.174	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116.1	170.9	-60.5	161.5	0	0	0	107.1	V550 L568 L569 Y596	V550-I581 HydrophobicContact CG1-CD1 4.44Å; L568-I581 WeakPolarHBondContact CA-O 3.34Å; L569-I581 HydrophobicContact CB-CB 4.19Å; L569-I581 PolarHBondContact N-O 3.28Å; L569-I581 PolarHBondContact O-N 3.02Å; I581-Y596 HydrophobicContact CG2-CD2 4.28Å; I581-Y596 HydrophobicContact CG2-CG 4.41Å
582	L	95.7	Very high	84.9	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	121.6	166.2	177.3	63.1	0	0	0	107.9	M461 L464 M468 I566 L568 Y596 A597 I599	M461-L582 HydrophobicContact SD-CD1 3.59Å; M461-L582 VanDerWaalsContact SD-CD1 3.59Å; L464-L582 HydrophobicContact CD2-CD2 3.72Å; L464-L582 HydrophobicContact CG-CD2 3.76Å; M468-L582 HydrophobicContact CE-CD2 4.38Å; M468-L582 HydrophobicContact CE-CG 4.12Å; M468-L582 HydrophobicContact SD-CB 4.42Å; M468-L582 HydrophobicContact SD-CD2 4.03Å; M468-L582 HydrophobicContact SD-CG 4.07Å; I566-L582 HydrophobicContact CG2-CD1 3.52Å; L568-L582 HydrophobicContact CD2-CB 4.23Å; L568-L582 HydrophobicContact CD2-CD1 3.96Å; L582-Y596 CarbonylContact O-C 3.51Å; L582-Y596 WeakPolarHBondContact O-CA 3.35Å; L582-Y596 WeakPolarHBondContact O-CB 3.35Å; L582-A597 PolarHBondContact N-O 3.5Å; L582-A597 PolarHBondContact O-N 3.05Å; L582-I599 HydrophobicContact CB-CG2 4.19Å
583	Q	97.1	Very high	85.8	Confident	3 Å²	3	41.7 Å²	41.7	1%	0.014	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.2	177.3	178.3	171.3	-78.9	0	0	110	R533 I566 S567 V594 V595	R533-Q583 PolarHBondContact O-NE2 3.2Å; R533-Q583 VanDerWaalsContact O-NE2 3.15Å; I566-Q583 CarbonylContact C-O 3.54Å; I566-Q583 VanDerWaalsContact CA-O 3.23Å; I566-Q583 WeakPolarHBondContact CA-O 3.34Å; S567-Q583 PolarHBondContact N-O 3.39Å; S567-Q583 PolarHBondContact O-N 3.25Å; Q583-V594 HydrophobicContact CG-CG1 4.02Å; Q583-V595 CarbonylContact C-O 3.59Å; Q583-V595 WeakPolarHBondContact CA-O 3.37Å
584	E	97.5	Very high	87	Confident	11 Å²	11	40 Å²	40	5%	0.051	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.4	164.4	178.1	160.3	177.8	0	0	109.3	R434 S465 M468 V469 N558 I566 V594 V595	R434-E584 IonicContact CZ-OE1 2.67Å; R434-E584 IonicContact CZ-OE2 2.64Å; R434-E584 VanDerWaalsContact NH1-CD 3.29Å; R434-E584 IonicContact NH1-OE1 3.49Å; R434-E584 PolarHBondContact NH1-OE1 3.38Å; R434-E584 IonicContact NH1-OE2 3.8Å; R434-E584 PolarHBondContact NH1-OE2 3.37Å; R434-E584 IonicContact NH2-OE2 3.53Å; S465-E584 WeakPolarHBondContact CB-OE2 2.97Å; S465-E584 PolarHBondContact OG-OE2 3.18Å; M468-E584 HydrophobicContact CE-CB 3.92Å; V469-E584 HydrophobicContact CG2-CB 4.1Å; V469-E584 HydrophobicContact CG2-CG 4.04Å; N558-E584 PolarHBondContact ND2-OE1 2.92Å; I566-E584 HydrophobicContact CG1-CB 4.39Å; I566-E584 HydrophobicContact CG1-CG 4.28Å; E584-V594 WeakPolarHBondContact O-CA 3.33Å; E584-V595 PolarHBondContact N-O 2.94Å; E584-V595 PolarHBondContact O-N 3.43Å
585	S	97.8	Very high	89.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	137.3	171.8	55.8	0	0	0	0	110.1	R533 G563 N564 C565 L593	R533-S585 VanDerWaalsContact CD-CB 3.47Å; R533-S585 WeakPolarHBondContact CD-OG 3.37Å; G563-S585 WeakPolarHBondContact O-CB 3.38Å; G563-S585 PolarHBondContact O-OG 2.89Å; N564-S585 WeakPolarHBondContact CA-O 3.27Å; C565-S585 PolarHBondContact N-O 3.47Å; C565-S585 VanDerWaalsContact N-O 3.13Å; C565-S585 PolarHBondContact O-N 3.22Å; C565-S585 PolarHBondContact O-OG 3.5Å; S585-L593 CarbonylContact C-O 3.56Å; S585-L593 WeakPolarHBondContact CA-O 3.45Å
586	C	96.3	Very high	91	Very high	15 Å²	15	31 Å²	31	10%	0.101	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	148.5	172.5	64.5	0	0	0	0	111.3	F529 N564 S592 L593	F529-C586 WeakPolarHBondContact CE2-O 3.45Å; N564-C586 VanDerWaalsContact OD1-CA 3.32Å; N564-C586 WeakPolarHBondContact OD1-CA 3.28Å; C586-S592 CarbonylContact O-C 3.57Å; C586-S592 VanDerWaalsContact O-CA 3.24Å; C586-S592 WeakPolarHBondContact O-CA 3.3Å; C586-S592 WeakPolarHBondContact O-CB 3.36Å; C586-L593 PolarHBondContact N-O 3.33Å; C586-L593 PolarHBondContact O-N 3.05Å
587	T	96.2	Very high	92.7	Very high	23 Å²	23	26.3 Å²	26.3	14%	0.141	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	145.6	178.3	-176.2	0	0	0	0	109.7	F529 H561 N564 S592	F529-T587 HydrophobicContact CD1-CG2 4.07Å; F529-T587 HydrophobicContact CE1-CG2 3.45Å; F529-T587 VanDerWaalsContact CE1-CG2 3.45Å; F529-T587 HydrophobicContact CZ-CG2 3.78Å; H561-T587 WeakPolarHBondContact CE1-CG2 3.44Å; H561-T587 WeakPolarHBondContact ND1-CG2 3.46Å; N564-T587 PolarHBondContact ND2-O 3.28Å; N564-T587 VanDerWaalsContact ND2-O 3.16Å; N564-T587 WeakPolarHBondContact OD1-CG2 3.19Å; N564-T587 PolarHBondContact OD1-N 3.09Å; N564-T587 PolarHBondContact OD1-O 2.91Å; T587-S592 VanDerWaalsContact CB-OG 3.25Å; T587-S592 WeakPolarHBondContact CB-OG 3.48Å; T587-S592 PolarHBondContact OG1-OG 3.49Å
588	D	92.6	Very high	93.9	Very high	36 Å²	36	24.9 Å²	24.9	19%	0.193	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	-177.4	172.5	61.7	54.4	0	0	0	109.9	A426 R430 T590 G591	A426-D588 HydrophobicContact CB-CB 4.22Å; R430-D588 IonicContact CZ-OD2 3.24Å; R430-D588 IonicContact NE-OD2 2.72Å; R430-D588 PolarHBondContact NE-OD2 2.91Å; R430-D588 IonicContact NH2-OD2 3.3Å; R430-D588 PolarHBondContact NH2-OD2 3.31Å; D588-T590 PolarHBondContact O-N 2.85Å; D588-T590 VanDerWaalsContact O-N 3.08Å; D588-T590 WeakPolarHBondContact OD1-CA 3.27Å; D588-T590 WeakPolarHBondContact OD1-CB 3.46Å; D588-T590 PolarHBondContact OD1-N 3.48Å; D588-T590 PolarHBondContact OD1-OG1 2.82Å; D588-G591 PolarHBondContact N-O 3.45Å; D588-G591 PolarHBondContact O-N 2.92Å; D588-G591 PolarHBondContact OD1-N 3.22Å; D588-G591 VanDerWaalsContact OD1-N 3.15Å
589	G	86.8	Confident	94.5	Very high	83 Å²	83	21.5 Å²	21.5	86%	0.856	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.9	-178.4	0	0	0	0	0	115.4
590	T	92.4	Very high	94.6	Very high	19 Å²	19	20 Å²	20	12%	0.117	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-15.9	-176.5	68.2	0	0	0	0	114.1	R423 A426 D588 P627	R423-T590 HydrophobicContact CB-CG2 4.26Å; R423-T590 HydrophobicContact CG-CG2 4.5Å; A426-T590 HydrophobicContact CB-CG2 3.85Å; D588-T590 PolarHBondContact O-N 2.85Å; D588-T590 VanDerWaalsContact O-N 3.08Å; D588-T590 WeakPolarHBondContact OD1-CA 3.27Å; D588-T590 WeakPolarHBondContact OD1-CB 3.46Å; D588-T590 PolarHBondContact OD1-N 3.48Å; D588-T590 PolarHBondContact OD1-OG1 2.82Å; T590-P627 WeakPolarHBondContact O-CD 3.38Å
591	G	94.2	Very high	94.6	Very high	10 Å²	10	21.3 Å²	21.3	10%	0.103	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.3	176.9	178.3	0	0	0	0	0	113.3	D588 I625	D588-G591 PolarHBondContact N-O 3.45Å; D588-G591 PolarHBondContact O-N 2.92Å; D588-G591 PolarHBondContact OD1-N 3.22Å; D588-G591 VanDerWaalsContact OD1-N 3.15Å; G591-I625 CarbonylContact C-O 3.52Å; G591-I625 WeakPolarHBondContact CA-O 3.38Å
592	S	97.4	Very high	94.6	Very high	10 Å²	10	23.8 Å²	23.8	7%	0.07	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	156.5	177	-45.4	0	0	0	0	111.3	F529 C586 T587 I625	F529-S592 VanDerWaalsContact CD2-CB 3.41Å; C586-S592 CarbonylContact O-C 3.57Å; C586-S592 VanDerWaalsContact O-CA 3.24Å; C586-S592 WeakPolarHBondContact O-CA 3.3Å; C586-S592 WeakPolarHBondContact O-CB 3.36Å; T587-S592 VanDerWaalsContact CB-OG 3.25Å; T587-S592 WeakPolarHBondContact CB-OG 3.48Å; T587-S592 PolarHBondContact OG1-OG 3.49Å; S592-I625 PolarHBondContact N-O 2.67Å; S592-I625 PolarHBondContact O-N 3.24Å
593	L	97.2	Very high	94.4	Very high	14 Å²	14	24.3 Å²	24.3	7%	0.073	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.6	-179.5	-176	78	0	0	0	108.8	M326 V469 F472 S585 C586 V595 F623 T624	M326-L593 HydrophobicContact CE-CD1 4Å; V469-L593 HydrophobicContact CG1-CD2 3.74Å; V469-L593 HydrophobicContact CG2-CD2 4.35Å; F472-L593 HydrophobicContact CD1-CD1 3.86Å; F472-L593 HydrophobicContact CE1-CD1 3.56Å; S585-L593 CarbonylContact C-O 3.56Å; S585-L593 WeakPolarHBondContact CA-O 3.45Å; C586-L593 PolarHBondContact N-O 3.33Å; C586-L593 PolarHBondContact O-N 3.05Å; L593-V595 HydrophobicContact CD1-CG2 3.85Å; L593-V595 HydrophobicContact CD2-CG2 3.46Å; L593-V595 VanDerWaalsContact CD2-CG2 3.46Å; L593-V595 HydrophobicContact CG-CG2 3.5Å; L593-F623 WeakPolarHBondContact CA-O 3.38Å; L593-F623 WeakPolarHBondContact CD1-O 3.18Å; L593-T624 HydrophobicContact CD1-CG2 3.73Å
594	V	97.9	Very high	94.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	106	167.7	-179.1	0	0	0	0	107.5	F529 V532 R533 Q583 E584 G622 F623	F529-V594 HydrophobicContact CD2-CG2 3.79Å; F529-V594 HydrophobicContact CE2-CG2 3.73Å; V532-V594 HydrophobicContact CG2-CB 4.27Å; V532-V594 HydrophobicContact CG2-CG2 3.81Å; R533-V594 HydrophobicContact CB-CG2 4.13Å; Q583-V594 HydrophobicContact CG-CG1 4.02Å; E584-V594 WeakPolarHBondContact O-CA 3.33Å; V594-G622 CarbonylContact O-C 3.46Å; V594-G622 WeakPolarHBondContact O-CA 3.44Å; V594-F623 HydrophobicContact CB-CD2 4.3Å; V594-F623 PolarHBondContact N-O 2.86Å; V594-F623 PolarHBondContact O-N 3.47Å
595	V	97.8	Very high	93.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137.4	178.5	-170.8	0	0	0	0	108.7	M468 V469 F472 Q583 E584 L593 P620 S621	M468-V595 HydrophobicContact CE-CB 4.2Å; M468-V595 HydrophobicContact CE-CG1 4.15Å; M468-V595 WeakPolarHBondContact CE-O 3.25Å; M468-V595 HydrophobicContact CG-CG1 3.89Å; M468-V595 HydrophobicContact SD-CG1 4.35Å; V469-V595 HydrophobicContact CG2-CB 4.27Å; V469-V595 HydrophobicContact CG2-CG2 4.08Å; F472-V595 HydrophobicContact CB-CG1 3.69Å; F472-V595 HydrophobicContact CB-CG2 4.09Å; F472-V595 HydrophobicContact CD1-CG1 4.49Å; F472-V595 HydrophobicContact CD1-CG2 3.64Å; F472-V595 HydrophobicContact CD2-CG1 4.04Å; F472-V595 HydrophobicContact CD2-CG2 4.5Å; F472-V595 HydrophobicContact CE1-CG2 4.19Å; F472-V595 HydrophobicContact CG-CB 4.48Å; F472-V595 HydrophobicContact CG-CG1 3.82Å; F472-V595 HydrophobicContact CG-CG2 3.81Å; Q583-V595 CarbonylContact C-O 3.59Å; Q583-V595 WeakPolarHBondContact CA-O 3.37Å; E584-V595 PolarHBondContact N-O 2.94Å; E584-V595 PolarHBondContact O-N 3.43Å; L593-V595 HydrophobicContact CD1-CG2 3.85Å; L593-V595 HydrophobicContact CD2-CG2 3.46Å; L593-V595 VanDerWaalsContact CD2-CG2 3.46Å; L593-V595 HydrophobicContact CG-CG2 3.5Å; V595-P620 HydrophobicContact CG1-CB 3.58Å; V595-S621 CarbonylContact C-O 3.59Å; V595-S621 WeakPolarHBondContact CA-O 2.95Å
596	Y	96.4	Very high	93.6	Very high	10 Å²	10	30.2 Å²	30.2	4%	0.039	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	153.2	175.8	60.9	-89.2	0	0	0	112.1	R538 W541 I581 L582 P620 S621 F623 F658	R538-Y596 VanDerWaalsContact NH2-CD2 3.31Å; W541-Y596 AromaticContact CH2-CE1 3.93Å; W541-Y596 HydrophobicContact CH2-CE1 3.93Å; W541-Y596 HydrophobicContact CZ3-CE1 4.06Å; I581-Y596 HydrophobicContact CG2-CD2 4.28Å; I581-Y596 HydrophobicContact CG2-CG 4.41Å; L582-Y596 CarbonylContact O-C 3.51Å; L582-Y596 WeakPolarHBondContact O-CA 3.35Å; L582-Y596 WeakPolarHBondContact O-CB 3.35Å; Y596-P620 WeakPolarHBondContact O-CA 3.42Å; Y596-S621 PolarHBondContact N-O 3.1Å; Y596-S621 PolarHBondContact O-N 3.05Å; Y596-S621 VanDerWaalsContact O-O 3.07Å; Y596-F623 HydrophobicContact CE1-CD2 4.38Å; Y596-F623 AromaticContact CE1-CE2 3.84Å; Y596-F623 HydrophobicContact CE1-CE2 3.84Å; Y596-F658 WeakPolarHBondContact OH-CE1 3.5Å
597	A	94.7	Very high	93.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	146.9	175	0	0	0	0	0	110.3	M468 L582 L618	M468-A597 HydrophobicContact CG-CB 4.15Å; M468-A597 HydrophobicContact SD-CB 3.58Å; M468-A597 VanDerWaalsContact SD-CB 3.58Å; L582-A597 PolarHBondContact N-O 3.5Å; L582-A597 PolarHBondContact O-N 3.05Å; A597-L618 HydrophobicContact CB-CB 4.42Å; A597-L618 HydrophobicContact CB-CD2 4.06Å
598	P	91.9	Very high	93.1	Very high	75 Å²	75	30.4 Å²	30.4	49%	0.487	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	142.2	169.1	30	-33.9	0	0	0	110.2	L580	L580-P598 CarbonylContact O-C 3.54Å; L580-P598 WeakPolarHBondContact O-CA 3.22Å
599	I	92.3	Very high	93	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	136	174.8	-171.6	174.7	0	0	0	109.3	L464 L568 L580 L582 A603 A604 I616	L464-I599 HydrophobicContact CD2-CD1 3.7Å; L568-I599 HydrophobicContact CD2-CG2 4.24Å; L580-I599 HydrophobicContact CB-CG2 3.89Å; L580-I599 PolarHBondContact N-O 2.78Å; L580-I599 PolarHBondContact O-N 3.03Å; L582-I599 HydrophobicContact CB-CG2 4.19Å; I599-A603 HydrophobicContact CD1-CB 4.39Å; I599-A603 HydrophobicContact CG1-CB 4.07Å; I599-A604 HydrophobicContact CD1-CB 4.09Å; I599-A604 HydrophobicContact CG1-CB 4.4Å; I599-A604 HydrophobicContact CG2-CB 4.34Å; I599-I616 HydrophobicContact CD1-CG2 4.45Å
600	D	90.7	Very high	93.2	Very high	64 Å²	64	29.4 Å²	29.4	34%	0.342	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	150.7	175.7	68.8	64.4	0	0	0	111.6	M579 P602 A603 A604	M579-D600 HydrophobicContact CE-CB 4.34Å; M579-D600 HydrophobicContact SD-CB 3.86Å; D600-P602 VanDerWaalsContact OD1-CD 3.25Å; D600-P602 WeakPolarHBondContact OD1-CD 3.46Å; D600-A603 PolarHBondContact O-N 2.86Å; D600-A603 WeakPolarHBondContact OD1-CA 3.19Å; D600-A603 WeakPolarHBondContact OD1-CB 3.26Å; D600-A603 PolarHBondContact OD1-N 3.18Å; D600-A604 WeakPolarHBondContact O-CB 3.27Å; D600-A604 PolarHBondContact O-N 3.01Å
601	I	91.1	Very high	93.2	Very high	36 Å²	36	33.9 Å²	33.9	19%	0.185	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-44	-178.6	-70.1	174.5	0	0	0	112.5	N577 S578 L580 A603 A604 N605	N577-I601 WeakPolarHBondContact O-CD1 3.26Å; S578-I601 PolarHBondContact O-N 3.47Å; L580-I601 HydrophobicContact CD1-CG1 4.21Å; L580-I601 HydrophobicContact CD2-CG1 4.32Å; L580-I601 HydrophobicContact CG-CG1 3.86Å; I601-A603 PolarHBondContact O-N 2.89Å; I601-A604 PolarHBondContact O-N 3.14Å; I601-N605 WeakPolarHBondContact O-CB 3.35Å; I601-N605 VanDerWaalsContact O-CG 3.23Å; I601-N605 PolarHBondContact O-N 2.91Å; I601-N605 PolarHBondContact O-ND2 2.89Å
602	P	91.9	Very high	93.1	Very high	85 Å²	85	38.4 Å²	38.4	55%	0.552	23%	0.225	S	C	*	.	H	α-helix	trans	-55.1	-48.1	174.8	-27.8	35.6	0	0	0	113.9	D600 N605 V606	D600-P602 VanDerWaalsContact OD1-CD 3.25Å; D600-P602 WeakPolarHBondContact OD1-CD 3.46Å; P602-N605 WeakPolarHBondContact O-CB 3.42Å; P602-N605 PolarHBondContact O-N 3.28Å; P602-V606 WeakPolarHBondContact O-CG2 3.32Å; P602-V606 PolarHBondContact O-N 2.88Å
603	A	92.6	Very high	92.8	Very high	12 Å²	12	38.2 Å²	38.2	10%	0.099	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-41.9	178.1	0	0	0	0	0	111.1	I599 D600 I601 N605 V606 V607 I616	I599-A603 HydrophobicContact CD1-CB 4.39Å; I599-A603 HydrophobicContact CG1-CB 4.07Å; D600-A603 PolarHBondContact O-N 2.86Å; D600-A603 WeakPolarHBondContact OD1-CA 3.19Å; D600-A603 WeakPolarHBondContact OD1-CB 3.26Å; D600-A603 PolarHBondContact OD1-N 3.18Å; I601-A603 PolarHBondContact O-N 2.89Å; A603-N605 VanDerWaalsContact C-N 3.32Å; A603-N605 PolarHBondContact O-N 2.98Å; A603-V606 WeakPolarHBondContact O-CB 3.37Å; A603-V606 PolarHBondContact O-N 2.87Å; A603-V607 WeakPolarHBondContact O-CG2 3.07Å; A603-V607 PolarHBondContact O-N 3.03Å; A603-I616 HydrophobicContact CB-CD1 4.12Å; A603-I616 HydrophobicContact CB-CG1 4.32Å; A603-I616 HydrophobicContact CB-CG2 4.28Å
604	A	92.4	Very high	92.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.7	-42.8	173.3	0	0	0	0	0	111.7	L580 I599 D600 I601 V607 M608	L580-A604 HydrophobicContact CD1-CB 3.92Å; I599-A604 HydrophobicContact CD1-CB 4.09Å; I599-A604 HydrophobicContact CG1-CB 4.4Å; I599-A604 HydrophobicContact CG2-CB 4.34Å; D600-A604 WeakPolarHBondContact O-CB 3.27Å; D600-A604 PolarHBondContact O-N 3.01Å; I601-A604 PolarHBondContact O-N 3.14Å; A604-V607 PolarHBondContact O-N 3.34Å; A604-M608 HydrophobicContact CB-CE 4.43Å; A604-M608 WeakPolarHBondContact O-CB 3.26Å; A604-M608 VanDerWaalsContact O-CG 3.25Å; A604-M608 WeakPolarHBondContact O-CG 3.33Å; A604-M608 PolarHBondContact O-N 3.28Å
605	N	91.2	Very high	92	Very high	86 Å²	86	43.9 Å²	43.9	46%	0.46	27%	0.269	S	S	.	.	H	α-helix	trans	-65.4	-41.1	177.2	-70.1	-25	0	0	0	112.4	I601 P602 A603 V607 M608 S609	I601-N605 WeakPolarHBondContact O-CB 3.35Å; I601-N605 VanDerWaalsContact O-CG 3.23Å; I601-N605 PolarHBondContact O-N 2.91Å; I601-N605 PolarHBondContact O-ND2 2.89Å; P602-N605 WeakPolarHBondContact O-CB 3.42Å; P602-N605 PolarHBondContact O-N 3.28Å; A603-N605 VanDerWaalsContact C-N 3.32Å; A603-N605 PolarHBondContact O-N 2.98Å; N605-V607 VanDerWaalsContact C-N 3.35Å; N605-V607 PolarHBondContact O-N 2.85Å; N605-M608 PolarHBondContact O-N 3.33Å; N605-M608 WeakPolarHBondContact OD1-CE 3.36Å; N605-S609 WeakPolarHBondContact O-CB 3.42Å; N605-S609 PolarHBondContact O-N 3.3Å
606	V	91.3	Very high	91.7	Very high	51 Å²	51	44.8 Å²	44.8	31%	0.309	27%	0.274	S	S	.	.	H	α-helix	trans	-57	-48.9	174	164.1	0	0	0	0	110.3	P602 A603 S609 G610 E611	P602-V606 WeakPolarHBondContact O-CG2 3.32Å; P602-V606 PolarHBondContact O-N 2.88Å; A603-V606 WeakPolarHBondContact O-CB 3.37Å; A603-V606 PolarHBondContact O-N 2.87Å; V606-S609 WeakPolarHBondContact O-CB 3.26Å; V606-S609 PolarHBondContact O-N 3.42Å; V606-S609 VanDerWaalsContact O-N 3.17Å; V606-S609 PolarHBondContact O-OG 3.45Å; V606-G610 PolarHBondContact O-N 2.89Å; V606-E611 HydrophobicContact CG1-CB 3.64Å; V606-E611 HydrophobicContact CG1-CG 4.24Å; V606-E611 WeakPolarHBondContact CG1-OE2 3.38Å; V606-E611 PolarHBondContact O-N 2.93Å
607	V	92.6	Very high	91.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.5	-44.9	178.7	176.5	0	0	0	0	111.1	G457 S460 M461 L464 A603 A604 N605 S609 G610 P613 I616	G457-V607 WeakPolarHBondContact CA-O 3.43Å; S460-V607 VanDerWaalsContact CB-O 3.29Å; S460-V607 WeakPolarHBondContact CB-O 3.46Å; S460-V607 WeakPolarHBondContact OG-CG1 3.34Å; S460-V607 PolarHBondContact OG-O 3.36Å; M461-V607 HydrophobicContact CB-CG1 4.05Å; M461-V607 HydrophobicContact CE-CB 4.2Å; M461-V607 HydrophobicContact CE-CG1 3.64Å; M461-V607 HydrophobicContact SD-CG1 3.92Å; L464-V607 HydrophobicContact CB-CG1 4.41Å; L464-V607 HydrophobicContact CD2-CB 4.48Å; L464-V607 HydrophobicContact CD2-CG1 4.04Å; L464-V607 HydrophobicContact CD2-CG2 3.86Å; A603-V607 WeakPolarHBondContact O-CG2 3.07Å; A603-V607 PolarHBondContact O-N 3.03Å; A604-V607 PolarHBondContact O-N 3.34Å; N605-V607 VanDerWaalsContact C-N 3.35Å; N605-V607 PolarHBondContact O-N 2.85Å; V607-S609 PolarHBondContact O-N 2.89Å; V607-G610 PolarHBondContact O-N 3.36Å; V607-P613 HydrophobicContact CG2-CB 4.23Å; V607-I616 HydrophobicContact CG2-CD1 3.08Å
608	M	90.4	Very high	91.3	Very high	43 Å²	43	48.1 Å²	48.1	21%	0.212	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-22.1	177.4	-73.4	-172.2	-64.3	0	0	113.2	T454 G457 M461 L568 A604 N605 G610	T454-M608 PolarHBondContact OG1-O 2.99Å; G457-M608 WeakPolarHBondContact CA-O 3.43Å; M461-M608 HydrophobicContact CE-CG 3.74Å; L568-M608 HydrophobicContact CD1-CE 4.5Å; L568-M608 HydrophobicContact CD1-SD 3.82Å; A604-M608 HydrophobicContact CB-CE 4.43Å; A604-M608 WeakPolarHBondContact O-CB 3.26Å; A604-M608 VanDerWaalsContact O-CG 3.25Å; A604-M608 WeakPolarHBondContact O-CG 3.33Å; A604-M608 PolarHBondContact O-N 3.28Å; N605-M608 PolarHBondContact O-N 3.33Å; N605-M608 WeakPolarHBondContact OD1-CE 3.36Å; M608-G610 VanDerWaalsContact C-N 3.29Å
609	S	90.2	Very high	91.3	Very high	67 Å²	67	46 Å²	46	47%	0.469	28%	0.28	S	S	.	.	H	α-helix	trans	-79	-12.6	173	79.2	0	0	0	0	113.6	N605 V606 V607	N605-S609 WeakPolarHBondContact O-CB 3.42Å; N605-S609 PolarHBondContact O-N 3.3Å; V606-S609 WeakPolarHBondContact O-CB 3.26Å; V606-S609 PolarHBondContact O-N 3.42Å; V606-S609 VanDerWaalsContact O-N 3.17Å; V606-S609 PolarHBondContact O-OG 3.45Å; V607-S609 PolarHBondContact O-N 2.89Å
610	G	90.9	Very high	91.4	Very high	31 Å²	31	45.8 Å²	45.8	32%	0.32	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	99	7.5	178.5	0	0	0	0	0	115.3	V606 V607 M608	V606-G610 PolarHBondContact O-N 2.89Å; V607-G610 PolarHBondContact O-N 3.36Å; M608-G610 VanDerWaalsContact C-N 3.29Å
611	E	92.3	Very high	91.6	Very high	112 Å²	112	43.1 Å²	43.1	52%	0.523	27%	0.266	S	S	.	.			trans	-67.6	166	174.6	-69.5	-174.5	-146.3	0	0	112.2	S460 V606 P613	S460-E611 WeakPolarHBondContact CB-O 3.5Å; S460-E611 PolarHBondContact OG-O 3.33Å; V606-E611 HydrophobicContact CG1-CB 3.64Å; V606-E611 HydrophobicContact CG1-CG 4.24Å; V606-E611 WeakPolarHBondContact CG1-OE2 3.38Å; V606-E611 PolarHBondContact O-N 2.93Å; E611-P613 WeakPolarHBondContact O-CD 3.22Å
612	D	91.3	Very high	91.9	Very high	106 Å²	106	41.4 Å²	41.4	57%	0.567	26%	0.257	S	S	*	.			trans	-71.7	120.7	-177.6	-179.2	20.7	0	0	0	111.8	S614	D612-S614 PolarHBondContact O-N 3.36Å; D612-S614 WeakPolarHBondContact OD1-CB 3.35Å; D612-S614 PolarHBondContact OD1-N 3.15Å; D612-S614 VanDerWaalsContact OD1-N 3.14Å; D612-S614 VanDerWaalsContact OD2-CB 3.26Å; D612-S614 WeakPolarHBondContact OD2-CB 3.36Å; D612-S614 PolarHBondContact OD2-OG 2.97Å
613	P	92.4	Very high	92.1	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.039	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-77.1	-3.8	179.8	31.4	-34.6	0	0	0	113.6	S460 K463 L464 R467 V607 E611 A615 I616	S460-P613 WeakPolarHBondContact OG-CD 3.49Å; K463-P613 HydrophobicContact CB-CG 3.86Å; L464-P613 HydrophobicContact CB-CB 3.73Å; L464-P613 HydrophobicContact CB-CG 4.21Å; L464-P613 HydrophobicContact CD1-CB 3.91Å; L464-P613 HydrophobicContact CG-CB 4.3Å; R467-P613 PolarHBondContact NH1-O 2.82Å; R467-P613 VanDerWaalsContact NH1-O 3.14Å; R467-P613 PolarHBondContact NH2-O 2.88Å; V607-P613 HydrophobicContact CG2-CB 4.23Å; E611-P613 WeakPolarHBondContact O-CD 3.22Å; P613-A615 PolarHBondContact O-N 2.9Å; P613-I616 HydrophobicContact CB-CD1 4.35Å; P613-I616 PolarHBondContact O-N 2.91Å
614	S	90.2	Very high	92.4	Very high	58 Å²	58	36.9 Å²	36.9	41%	0.406	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-52.8	-33.1	-170.6	66.7	0	0	0	0	114.7	R467 G506 D612	R467-S614 PolarHBondContact NH1-O 3.43Å; G506-S614 WeakPolarHBondContact CA-O 3.45Å; D612-S614 PolarHBondContact O-N 3.36Å; D612-S614 WeakPolarHBondContact OD1-CB 3.35Å; D612-S614 PolarHBondContact OD1-N 3.15Å; D612-S614 VanDerWaalsContact OD1-N 3.14Å; D612-S614 VanDerWaalsContact OD2-CB 3.26Å; D612-S614 WeakPolarHBondContact OD2-CB 3.36Å; D612-S614 PolarHBondContact OD2-OG 2.97Å
615	A	87.9	Confident	92.6	Very high	75 Å²	75	36.9 Å²	36.9	62%	0.62	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-85.2	-11.6	-179.2	0	0	0	0	0	114.9	P613 P617	P613-A615 PolarHBondContact O-N 2.9Å; A615-P617 WeakPolarHBondContact O-CD 3.49Å
616	I	91.4	Very high	92.9	Very high	18 Å²	18	33.4 Å²	33.4	9%	0.092	21%	0.208	C	C	.	.			trans	-76.3	118.1	-172.5	-62.6	170.9	0	0	0	110.6	L464 R467 I599 A603 V607 P613 L618	L464-I616 HydrophobicContact CD1-CB 4.22Å; L464-I616 HydrophobicContact CD1-CG2 4.27Å; R467-I616 PolarHBondContact NH2-O 3.13Å; I599-I616 HydrophobicContact CD1-CG2 4.45Å; A603-I616 HydrophobicContact CB-CD1 4.12Å; A603-I616 HydrophobicContact CB-CG1 4.32Å; A603-I616 HydrophobicContact CB-CG2 4.28Å; V607-I616 HydrophobicContact CG2-CD1 3.08Å; P613-I616 HydrophobicContact CB-CD1 4.35Å; P613-I616 PolarHBondContact O-N 2.91Å; I616-L618 HydrophobicContact CG2-CD2 4.44Å
617	P	90.7	Very high	93	Very high	71 Å²	71	33.1 Å²	33.1	46%	0.461	21%	0.207	S	C	.	.			trans	-70.7	134.4	178.2	29.7	-33.7	0	0	0	111	G506 P508 A615	G506-P617 WeakPolarHBondContact O-CA 3.41Å; P508-P617 HydrophobicContact CB-CB 4.32Å; A615-P617 WeakPolarHBondContact O-CD 3.49Å
618	L	92.2	Very high	92.8	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.052	21%	0.21	C	C	.	.			trans	-128.6	145.3	174.5	-65.9	178.5	0	0	0	111.3	L464 M468 G506 A597 I616	L464-L618 HydrophobicContact CD1-CD1 3.49Å; L464-L618 VanDerWaalsContact CD1-CD1 3.49Å; L464-L618 HydrophobicContact CD1-CD2 4.33Å; L464-L618 HydrophobicContact CD1-CG 4.02Å; L464-L618 HydrophobicContact CG-CD1 4.04Å; M468-L618 HydrophobicContact CB-CD1 3.73Å; M468-L618 HydrophobicContact CG-CD1 4.13Å; G506-L618 PolarHBondContact O-N 3.15Å; A597-L618 HydrophobicContact CB-CB 4.42Å; A597-L618 HydrophobicContact CB-CD2 4.06Å; I616-L618 HydrophobicContact CG2-CD2 4.44Å
619	L	91.7	Very high	92.6	Very high	30 Å²	30	32.3 Å²	32.3	16%	0.157	21%	0.207	C	C	.	.			trans	-123.3	90.8	168.6	-71.3	170.3	0	0	0	109	P508 V512 Q659 L661	P508-L619 HydrophobicContact CG-CD1 4Å; P508-L619 HydrophobicContact CG-CD2 3.43Å; P508-L619 VanDerWaalsContact CG-CD2 3.43Å; P508-L619 HydrophobicContact CG-CG 3.65Å; V512-L619 HydrophobicContact CG1-CD2 3.69Å; V512-L619 HydrophobicContact CG2-CD2 3.95Å; L619-Q659 HydrophobicContact CB-CB 4.33Å; L619-Q659 HydrophobicContact CD2-CB 4.18Å; L619-L661 HydrophobicContact CD1-CB 3.7Å
620	P	94.8	Very high	92.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.21	C	C	.	.			trans	-70.9	134.3	-178.8	27.2	-34.4	0	0	0	112.2	M468 F472 V595 Y596 Q659	M468-P620 HydrophobicContact CG-CB 3.78Å; F472-P620 HydrophobicContact CB-CB 3.82Å; F472-P620 HydrophobicContact CB-CG 4.01Å; F472-P620 HydrophobicContact CD2-CB 4.19Å; F472-P620 HydrophobicContact CG-CB 4.47Å; V595-P620 HydrophobicContact CG1-CB 3.58Å; Y596-P620 WeakPolarHBondContact O-CA 3.42Å; P620-Q659 WeakPolarHBondContact O-CB 3.08Å; P620-Q659 VanDerWaalsContact O-CG 3.24Å; P620-Q659 WeakPolarHBondContact O-CG 3.14Å
621	S	95	Very high	90.9	Very high	8 Å²	8	40 Å²	40	6%	0.056	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	163.8	164.3	-58	0	0	0	0	108.5	V595 Y596 A657 F658 Q659	V595-S621 CarbonylContact C-O 3.59Å; V595-S621 WeakPolarHBondContact CA-O 2.95Å; Y596-S621 PolarHBondContact N-O 3.1Å; Y596-S621 PolarHBondContact O-N 3.05Å; Y596-S621 VanDerWaalsContact O-O 3.07Å; S621-A657 CarbonylContact C-O 3.6Å; S621-A657 VanDerWaalsContact CA-O 3.29Å; S621-A657 WeakPolarHBondContact CA-O 3.23Å; S621-A657 WeakPolarHBondContact CB-O 3.33Å; S621-F658 WeakPolarHBondContact OG-CA 3.28Å; S621-Q659 PolarHBondContact OG-N 2.62Å
622	G	96.2	Very high	89.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.8	-168.8	-177	0	0	0	0	0	116.7	F472 V594 A657	F472-G622 VanDerWaalsContact CE2-N 3.35Å; V594-G622 CarbonylContact O-C 3.46Å; V594-G622 WeakPolarHBondContact O-CA 3.44Å; G622-A657 PolarHBondContact N-O 3.4Å; G622-A657 PolarHBondContact O-N 2.87Å
623	F	97.4	Very high	86.4	Confident	0 Å²	0	36 Å²	36	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.9	-173	-53.6	-78.6	0	0	0	110.9	V532 W541 L593 V594 Y596 T655 V656 T685 I689	V532-F623 HydrophobicContact CB-CD2 3.91Å; V532-F623 HydrophobicContact CB-CE2 4.15Å; V532-F623 HydrophobicContact CB-CG 4.35Å; V532-F623 HydrophobicContact CG1-CD2 4.27Å; V532-F623 HydrophobicContact CG1-CE2 4.39Å; V532-F623 HydrophobicContact CG1-CG 4.33Å; V532-F623 HydrophobicContact CG2-CB 4.41Å; V532-F623 HydrophobicContact CG2-CD2 4.16Å; V532-F623 HydrophobicContact CG2-CG 4.39Å; W541-F623 HydrophobicContact CD2-CE2 4.42Å; W541-F623 HydrophobicContact CD2-CZ 4.17Å; W541-F623 AromaticContact CE3-CE2 3.93Å; W541-F623 HydrophobicContact CE3-CE2 3.93Å; W541-F623 AromaticContact CE3-CZ 3.55Å; W541-F623 HydrophobicContact CE3-CZ 3.55Å; W541-F623 AromaticContact CH2-CE2 3.62Å; W541-F623 HydrophobicContact CH2-CE2 3.62Å; W541-F623 HydrophobicContact CH2-CZ 4.12Å; W541-F623 HydrophobicContact CZ2-CE2 4.09Å; W541-F623 AromaticContact CZ3-CE2 3.52Å; W541-F623 HydrophobicContact CZ3-CE2 3.52Å; W541-F623 AromaticContact CZ3-CZ 3.55Å; W541-F623 HydrophobicContact CZ3-CZ 3.55Å; L593-F623 WeakPolarHBondContact CA-O 3.38Å; L593-F623 WeakPolarHBondContact CD1-O 3.18Å; V594-F623 HydrophobicContact CB-CD2 4.3Å; V594-F623 PolarHBondContact N-O 2.86Å; V594-F623 PolarHBondContact O-N 3.47Å; Y596-F623 HydrophobicContact CE1-CD2 4.38Å; Y596-F623 AromaticContact CE1-CE2 3.84Å; Y596-F623 HydrophobicContact CE1-CE2 3.84Å; F623-T655 CarbonylContact C-O 3.57Å; F623-T655 VanDerWaalsContact CA-O 3.28Å; F623-T655 WeakPolarHBondContact CA-O 3.46Å; F623-V656 HydrophobicContact CD1-CB 4.36Å; F623-V656 HydrophobicContact CD1-CG1 4.2Å; F623-V656 HydrophobicContact CD1-CG2 3.92Å; F623-V656 HydrophobicContact CE1-CB 4.34Å; F623-V656 HydrophobicContact CE1-CG1 3.77Å; F623-V656 HydrophobicContact CE1-CG2 3.94Å; F623-T685 HydrophobicContact CE1-CG2 4.36Å; F623-T685 HydrophobicContact CZ-CG2 4.42Å; F623-I689 HydrophobicContact CD1-CD1 4.31Å; F623-I689 HydrophobicContact CE1-CD1 3.54Å; F623-I689 HydrophobicContact CZ-CD1 4.13Å
624	T	97.5	Very high	83.5	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.1	167	80.9	0	0	0	0	107.3	M326 F472 L476 L593 V654 T655	M326-T624 HydrophobicContact CB-CG2 3.76Å; M326-T624 HydrophobicContact CE-CG2 3.64Å; M326-T624 PolarHBondContact O-OG1 3.3Å; F472-T624 HydrophobicContact CE1-CG2 3.7Å; F472-T624 HydrophobicContact CZ-CG2 4.23Å; L476-T624 HydrophobicContact CD1-CG2 3.65Å; L593-T624 HydrophobicContact CD1-CG2 3.73Å; T624-V654 CarbonylContact O-C 3.58Å; T624-V654 VanDerWaalsContact O-CA 3.26Å; T624-V654 WeakPolarHBondContact O-CA 3.44Å; T624-T655 PolarHBondContact N-O 2.73Å; T624-T655 PolarHBondContact O-N 3.3Å; T624-T655 WeakPolarHBondContact OG1-CB 3.35Å; T624-T655 PolarHBondContact OG1-OG1 3.03Å
625	I	97.5	Very high	80.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	111.2	-174.9	-54.2	164.8	0	0	0	106.8	C525 V528 F529 V532 G591 S592 L653	C525-I625 HydrophobicContact CB-CG2 3.82Å; V528-I625 HydrophobicContact CB-CD1 4.22Å; V528-I625 HydrophobicContact CB-CG2 4.25Å; V528-I625 HydrophobicContact CG1-CD1 3.76Å; V528-I625 HydrophobicContact CG1-CG1 4.08Å; V528-I625 HydrophobicContact CG1-CG2 4.39Å; F529-I625 VanDerWaalsContact CA-CD1 3.48Å; F529-I625 HydrophobicContact CB-CD1 3.82Å; F529-I625 HydrophobicContact CD2-CD1 4.39Å; V532-I625 HydrophobicContact CG2-CD1 3.87Å; G591-I625 CarbonylContact C-O 3.52Å; G591-I625 WeakPolarHBondContact CA-O 3.38Å; S592-I625 PolarHBondContact N-O 2.67Å; S592-I625 PolarHBondContact O-N 3.24Å; I625-L653 WeakPolarHBondContact CA-O 3.34Å
626	L	96.2	Very high	77.7	Confident	14 Å²	14	45 Å²	45	7%	0.073	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	152.1	-178.4	-61.8	175	0	0	0	109.7	V325 Y409 L412 C525 S652 L653	V325-L626 HydrophobicContact CG1-CD1 3.75Å; Y409-L626 HydrophobicContact CE1-CD1 4.23Å; L412-L626 HydrophobicContact CD2-CB 4.32Å; L412-L626 HydrophobicContact CD2-CD1 4.07Å; C525-L626 PolarHBondContact SG-O 2.84Å; C525-L626 VanDerWaalsContact SG-O 3.38Å; L626-S652 CarbonylContact O-C 3.55Å; L626-S652 WeakPolarHBondContact O-CA 3.15Å; L626-L653 HydrophobicContact CB-CB 4.34Å; L626-L653 PolarHBondContact N-O 3.46Å; L626-L653 PolarHBondContact O-N 3.37Å
627	P	93.7	Very high	74.7	Confident	44 Å²	44	49.8 Å²	49.8	29%	0.286	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	152.6	171	26.2	-32.6	0	0	0	110.5	L412 T590 G629	L412-P627 HydrophobicContact CD1-CG 3.92Å; L412-P627 WeakPolarHBondContact CD1-O 3.38Å; T590-P627 WeakPolarHBondContact O-CD 3.38Å; P627-G629 PolarHBondContact O-N 3.23Å
628	D	89.9	Confident	71.8	Confident	12 Å²	12	51 Å²	51	6%	0.064	34%	0.34	C	S	.	.			trans	-73.1	-10	178.1	67.3	2.9	0	0	0	114.2	W520 R630 G651 L653	W520-D628 PolarHBondContact NE1-OD2 3.32Å; D628-R630 PolarHBondContact O-N 3.43Å; D628-R630 PolarHBondContact OD1-N 3.39Å; D628-R630 VanDerWaalsContact OD1-N 3.08Å; D628-G651 PolarHBondContact N-O 2.93Å; D628-G651 WeakPolarHBondContact OD2-CA 3.37Å; D628-G651 PolarHBondContact OD2-N 3.44Å; D628-L653 HydrophobicContact CB-CG 4.47Å
629	G	84.4	Confident	68.9	Low	15 Å²	15	55.7 Å²	55.7	16%	0.155	38%	0.38	C	S	.	.			trans	77.3	2.2	177.9	0	0	0	0	0	114.2	P627	P627-G629 PolarHBondContact O-N 3.23Å
630	R	81.7	Confident	65.8	Low	137 Å²	137	58.6 Å²	58.6	52%	0.517	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-72.1	135	178.6	-67.9	-179.9	177.1	172.1	4.4	109.7	D411 D628 G632	D411-R630 IonicContact OD2-NE 3.63Å; D628-R630 PolarHBondContact O-N 3.43Å; D628-R630 PolarHBondContact OD1-N 3.39Å; D628-R630 VanDerWaalsContact OD1-N 3.08Å; R630-G632 PolarHBondContact O-N 3.14Å
631	P	64.5	Low	62.6	Low	122 Å²	122	61.1 Å²	61.1	79%	0.792	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-60.8	118.1	171.4	23.7	-29.4	0	0	0	107.7	A633	P631-A633 PolarHBondContact O-N 2.86Å
632	G	54.3	Low	59.6	Low	63 Å²	63	66.7 Å²	66.7	65%	0.649	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-50.5	132.7	171.5	0	0	0	0	0	108.4	R630 P634	R630-G632 PolarHBondContact O-N 3.14Å; G632-P634 VanDerWaalsContact O-N 3.17Å
633	A	35	Very low	56.5	Low	71 Å²	71	74.2 Å²	74.2	59%	0.587	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-49.7	128.9	177	0	0	0	0	0	108	P631 S635	P631-A633 PolarHBondContact O-N 2.86Å; A633-S635 PolarHBondContact O-N 3.05Å
634	P	31.1	Very low	53.3	Low	119 Å²	119	81.3 Å²	81.3	77%	0.773	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-55.9	119.6	179.6	21.1	-30.4	0	0	0	107	G632 S636	G632-P634 VanDerWaalsContact O-N 3.17Å; P634-S636 PolarHBondContact O-N 2.73Å
635	S	29.8	Very low	50	Low	110 Å²	110	83.4 Å²	83.4	77%	0.769	58%	0.584	S	S	*	*			trans	-59.3	96.7	168.7	53.3	0	0	0	0	106.2	A633 S637	A633-S635 PolarHBondContact O-N 3.05Å; S635-S637 PolarHBondContact O-N 2.7Å
636	S	27.6	Very low	46.8	Very low	100 Å²	100	88.9 Å²	88.9	70%	0.699	62%	0.622	S	S	*	*			trans	-65.8	90.9	171.5	44.6	0	0	0	0	107.1	P634 S638	P634-S636 PolarHBondContact O-N 2.73Å; S636-S638 PolarHBondContact O-N 3.01Å
637	S	28.5	Very low	44	Very low	118 Å²	118	93.3 Å²	93.3	83%	0.825	65%	0.652	S	S	*	*			trans	-69.8	66.8	158.8	54.2	0	0	0	0	108.5	S635	S635-S637 PolarHBondContact O-N 2.7Å
638	S	29	Very low	41.8	Very low	97 Å²	97	95.6 Å²	95.6	68%	0.678	68%	0.675	S	S	*	*			trans	-147.4	93	175.1	-57.2	0	0	0	0	108.8	S636	S636-S638 PolarHBondContact O-N 3.01Å
639	A	30.9	Very low	40.2	Very low	107 Å²	107	98.1 Å²	98.1	88%	0.884	70%	0.697	S	S	*	*			trans	39.5	114.6	150.9	0	0	0	0	0	120
640	G	26.7	Very low	39.9	Very low	91 Å²	91	100.3 Å²	100.3	94%	0.938	71%	0.714	S	S	*	*			trans	76.4	79	132.4	0	0	0	0	0	118
641	G	28.3	Very low	40.3	Very low	54 Å²	54	93.8 Å²	93.8	56%	0.557	69%	0.689	S	S	*	*			trans	-173.5	142.1	160	0	0	0	0	0	110.3	L643	G641-L643 PolarHBondContact O-N 3.36Å
642	P	31.7	Very low	41.8	Very low	125 Å²	125	88 Å²	88	81%	0.812	65%	0.652	S	S	*	*			trans	-68.9	107.2	-179.4	28.2	-30.2	0	0	0	108.6	V644	P642-V644 VanDerWaalsContact C-N 3.3Å; P642-V644 PolarHBondContact O-N 2.73Å
643	L	31	Very low	43.8	Very low	158 Å²	158	85 Å²	85	83%	0.827	62%	0.621	S	S	*	*			trans	-67.6	86.3	177.4	-71.7	165.6	0	0	0	109.8	G641 G645	G641-L643 PolarHBondContact O-N 3.36Å; L643-G645 PolarHBondContact O-N 3.22Å; L643-G645 VanDerWaalsContact O-N 3.17Å
644	V	30.6	Very low	46.7	Very low	148 Å²	148	81.7 Å²	81.7	90%	0.897	59%	0.593	S	S	*	*			trans	-78.2	85.2	156.5	-178.8	0	0	0	0	106.4	P642	P642-V644 VanDerWaalsContact C-N 3.3Å; P642-V644 PolarHBondContact O-N 2.73Å
645	G	27.9	Very low	49.8	Very low	47 Å²	47	76 Å²	76	49%	0.485	56%	0.557	S	S	.	*	S	Bend	trans	152.6	92	180	0	0	0	0	0	109.2	L643	L643-G645 PolarHBondContact O-N 3.22Å; L643-G645 VanDerWaalsContact O-N 3.17Å
646	S	30	Very low	52.9	Low	115 Å²	115	70.9 Å²	70.9	80%	0.804	52%	0.52	S	S	*	.			trans	-47.5	137.8	164.4	-77.3	0	0	0	0	108.5	A648	S646-A648 PolarHBondContact O-N 2.93Å; S646-A648 VanDerWaalsContact O-N 3.1Å
647	P	38.8	Very low	56.1	Low	106 Å²	106	66.3 Å²	66.3	69%	0.688	49%	0.488	S	S	*	.			trans	-50	127.5	170.3	21.7	-30.7	0	0	0	106.9	A649	P647-A649 PolarHBondContact O-N 2.76Å
648	A	46.9	Very low	59.2	Low	93 Å²	93	60.9 Å²	60.9	77%	0.769	45%	0.45	S	S	*	.			trans	-49.1	107.3	-178.8	0	0	0	0	0	107.6	S646 A650	S646-A648 PolarHBondContact O-N 2.93Å; S646-A648 VanDerWaalsContact O-N 3.1Å; A648-A650 PolarHBondContact O-N 3.45Å
649	A	54.9	Low	62.1	Low	64 Å²	64	56.8 Å²	56.8	53%	0.529	42%	0.42	S	S	.	.			trans	-59.6	131.3	-176.4	0	0	0	0	0	107.1	P524 P647 G651	P524-A649 HydrophobicContact CG-CB 4.11Å; P647-A649 PolarHBondContact O-N 2.76Å; A649-G651 PolarHBondContact O-N 2.92Å
650	A	78.5	Confident	64.9	Low	61 Å²	61	54.1 Å²	54.1	50%	0.504	39%	0.39	S	S	.	.			trans	-53.1	129.4	178.2	0	0	0	0	0	109.2	P524 A648	P524-A650 WeakPolarHBondContact CA-O 3.38Å; A648-A650 PolarHBondContact O-N 3.45Å
651	G	91.5	Very high	67.8	Low	1 Å²	1	52.9 Å²	52.9	1%	0.01	36%	0.362	C	S	.	.			trans	-77.2	177.8	176	0	0	0	0	0	111.3	L521 V523 D628 A649	L521-G651 CarbonylContact O-C 3.59Å; L521-G651 WeakPolarHBondContact O-CA 3.47Å; V523-G651 CarbonylContact O-C 3.56Å; D628-G651 PolarHBondContact N-O 2.93Å; D628-G651 WeakPolarHBondContact OD2-CA 3.37Å; D628-G651 PolarHBondContact OD2-N 3.44Å; A649-G651 PolarHBondContact O-N 2.92Å
652	S	94.9	Very high	70.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.3	175.4	52.6	0	0	0	0	111	W520 L521 V523 C525 V528 L626	W520-S652 CarbonylContact C-O 3.54Å; W520-S652 WeakPolarHBondContact CA-O 3.25Å; L521-S652 PolarHBondContact N-O 2.9Å; L521-S652 PolarHBondContact O-N 3.26Å; V523-S652 VanDerWaalsContact O-CB 3.28Å; V523-S652 WeakPolarHBondContact O-CB 3.44Å; V523-S652 PolarHBondContact O-N 3.44Å; V523-S652 PolarHBondContact O-OG 2.79Å; C525-S652 VanDerWaalsContact SG-CB 3.59Å; V528-S652 WeakPolarHBondContact CG2-OG 3.29Å; L626-S652 CarbonylContact O-C 3.55Å; L626-S652 WeakPolarHBondContact O-CA 3.15Å
653	L	95.8	Very high	73	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.7	169.3	-61	171.6	0	0	0	107.5	L408 Y409 L412 I519 W520 I625 L626 D628	L408-L653 HydrophobicContact CB-CD2 4.32Å; L408-L653 HydrophobicContact CD2-CD2 4.48Å; L408-L653 WeakPolarHBondContact O-CD1 3.34Å; L408-L653 VanDerWaalsContact O-CD2 3.27Å; L408-L653 WeakPolarHBondContact O-CD2 3.49Å; Y409-L653 HydrophobicContact CD1-CD1 3.67Å; Y409-L653 HydrophobicContact CE1-CB 4.15Å; Y409-L653 HydrophobicContact CE1-CD1 3.75Å; Y409-L653 HydrophobicContact CG-CD1 4.35Å; L412-L653 HydrophobicContact CB-CD1 4.35Å; L412-L653 HydrophobicContact CD2-CD1 4.33Å; I519-L653 WeakPolarHBondContact O-CA 3.33Å; W520-L653 HydrophobicContact CB-CD2 4.09Å; W520-L653 HydrophobicContact CG-CD2 4.42Å; I625-L653 WeakPolarHBondContact CA-O 3.34Å; L626-L653 HydrophobicContact CB-CB 4.34Å; L626-L653 PolarHBondContact N-O 3.46Å; L626-L653 PolarHBondContact O-N 3.37Å; D628-L653 HydrophobicContact CB-CG 4.47Å
654	V	96.5	Very high	75.4	Confident	1 Å²	1	44 Å²	44	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.1	-178.4	-176.7	0	0	0	0	109.1	S518 I519 L521 V528 T624 V656	S518-V654 CarbonylContact C-O 3.54Å; S518-V654 WeakPolarHBondContact CA-O 3.05Å; I519-V654 HydrophobicContact CG1-CB 3.98Å; I519-V654 PolarHBondContact N-O 3.22Å; I519-V654 PolarHBondContact O-N 2.93Å; L521-V654 HydrophobicContact CD1-CG2 3.74Å; L521-V654 HydrophobicContact CG-CG2 4.23Å; V528-V654 HydrophobicContact CG1-CG2 3.86Å; T624-V654 CarbonylContact O-C 3.58Å; T624-V654 VanDerWaalsContact O-CA 3.26Å; T624-V654 WeakPolarHBondContact O-CA 3.44Å; V654-V656 HydrophobicContact CG1-CG2 4.33Å
655	T	96.3	Very high	77.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.1	167.2	-50.1	0	0	0	0	109.3	M326 Y409 L476 T517 S518 F623 T624	M326-T655 PolarHBondContact O-OG1 3.34Å; Y409-T655 PolarHBondContact OH-OG1 2.86Å; L476-T655 HydrophobicContact CD2-CG2 3.98Å; T517-T655 CarbonylContact O-C 3.55Å; T517-T655 VanDerWaalsContact O-CA 3.24Å; T517-T655 WeakPolarHBondContact O-CA 3.42Å; T517-T655 WeakPolarHBondContact O-CG2 3.4Å; S518-T655 WeakPolarHBondContact OG-CG2 2.99Å; S518-T655 PolarHBondContact OG-OG1 3.38Å; F623-T655 CarbonylContact C-O 3.57Å; F623-T655 VanDerWaalsContact CA-O 3.28Å; F623-T655 WeakPolarHBondContact CA-O 3.46Å; T624-T655 PolarHBondContact N-O 2.73Å; T624-T655 PolarHBondContact O-N 3.3Å; T624-T655 WeakPolarHBondContact OG1-CB 3.35Å; T624-T655 PolarHBondContact OG1-OG1 3.03Å
656	V	95.7	Very high	79.7	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.2	172.7	-173.2	0	0	0	0	107.7	A516 T517 F623 V654 F658 T685 V686	A516-V656 CarbonylContact C-O 3.54Å; A516-V656 WeakPolarHBondContact CA-O 3.5Å; T517-V656 HydrophobicContact CG2-CB 4.44Å; T517-V656 PolarHBondContact N-O 2.86Å; T517-V656 PolarHBondContact O-N 3.43Å; F623-V656 HydrophobicContact CD1-CB 4.36Å; F623-V656 HydrophobicContact CD1-CG1 4.2Å; F623-V656 HydrophobicContact CD1-CG2 3.92Å; F623-V656 HydrophobicContact CE1-CB 4.34Å; F623-V656 HydrophobicContact CE1-CG1 3.77Å; F623-V656 HydrophobicContact CE1-CG2 3.94Å; V654-V656 HydrophobicContact CG1-CG2 4.33Å; V656-F658 HydrophobicContact CG1-CD2 4.24Å; V656-F658 HydrophobicContact CG1-CE2 3.58Å; V656-F658 HydrophobicContact CG1-CZ 4.23Å; V656-T685 HydrophobicContact CG1-CG2 4.28Å; V656-V686 HydrophobicContact CG2-CG2 3.97Å
657	A	94.6	Very high	81.8	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.033	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	141.9	176.4	0	0	0	0	0	112.8	F472 L476 A515 A516 S621 G622	F472-A657 HydrophobicContact CE2-CB 3.79Å; F472-A657 HydrophobicContact CZ-CB 4.01Å; L476-A657 HydrophobicContact CD1-CB 4.42Å; L476-A657 HydrophobicContact CD2-CB 3.7Å; L476-A657 HydrophobicContact CG-CB 4.21Å; A515-A657 CarbonylContact O-C 3.55Å; A515-A657 VanDerWaalsContact O-CA 3.26Å; A515-A657 WeakPolarHBondContact O-CA 3.45Å; A516-A657 HydrophobicContact CB-CB 3.75Å; S621-A657 CarbonylContact C-O 3.6Å; S621-A657 VanDerWaalsContact CA-O 3.29Å; S621-A657 WeakPolarHBondContact CA-O 3.23Å; S621-A657 WeakPolarHBondContact CB-O 3.33Å; G622-A657 PolarHBondContact N-O 3.4Å; G622-A657 PolarHBondContact O-N 2.87Å
658	F	92.5	Very high	83.3	Confident	5 Å²	5	37.7 Å²	37.7	2%	0.022	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.4	176.8	-66.8	-86.3	0	0	0	110.8	S514 A515 Y596 S621 V656 I660 L681 I682 T685	S514-F658 WeakPolarHBondContact CA-O 3.46Å; A515-F658 PolarHBondContact N-O 2.89Å; A515-F658 PolarHBondContact O-N 3.37Å; Y596-F658 WeakPolarHBondContact OH-CE1 3.5Å; S621-F658 WeakPolarHBondContact OG-CA 3.28Å; V656-F658 HydrophobicContact CG1-CD2 4.24Å; V656-F658 HydrophobicContact CG1-CE2 3.58Å; V656-F658 HydrophobicContact CG1-CZ 4.23Å; F658-I660 HydrophobicContact CB-CD1 4.31Å; F658-I660 HydrophobicContact CB-CG1 4.47Å; F658-L681 HydrophobicContact CD1-CD2 4.13Å; F658-L681 HydrophobicContact CE1-CD2 4.28Å; F658-L681 HydrophobicContact CG-CD2 4.27Å; F658-L681 HydrophobicContact CZ-CG 4.43Å; F658-I682 HydrophobicContact CD2-CD1 4.05Å; F658-I682 HydrophobicContact CD2-CG1 3.37Å; F658-I682 HydrophobicContact CE2-CG1 3.7Å; F658-T685 HydrophobicContact CE2-CG2 4.45Å; F658-T685 HydrophobicContact CZ-CG2 4.07Å
659	Q	91.4	Very high	84.4	Confident	11 Å²	11	41.7 Å²	41.7	5%	0.051	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.6	165.9	-65.1	-173.4	14.5	0	0	109.7	S475 V512 L513 L619 P620 S621	S475-Q659 PolarHBondContact OG-NE2 3.47Å; V512-Q659 HydrophobicContact CG1-CB 4.18Å; L513-Q659 WeakPolarHBondContact O-CA 3.47Å; L619-Q659 HydrophobicContact CB-CB 4.33Å; L619-Q659 HydrophobicContact CD2-CB 4.18Å; P620-Q659 WeakPolarHBondContact O-CB 3.08Å; P620-Q659 VanDerWaalsContact O-CG 3.24Å; P620-Q659 WeakPolarHBondContact O-CG 3.14Å; S621-Q659 PolarHBondContact OG-N 2.62Å
660	I	89	Confident	85.3	Confident	50 Å²	50	39.7 Å²	39.7	26%	0.256	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.1	-173.9	-64.6	167.9	0	0	0	109.2	V512 L513 F658 V662 V678 L681	V512-I660 WeakPolarHBondContact CA-O 3.36Å; L513-I660 PolarHBondContact N-O 3.33Å; L513-I660 PolarHBondContact O-N 2.83Å; F658-I660 HydrophobicContact CB-CD1 4.31Å; F658-I660 HydrophobicContact CB-CG1 4.47Å; I660-V662 PolarHBondContact O-N 3.02Å; I660-V678 HydrophobicContact CB-CG2 4.45Å; I660-V678 HydrophobicContact CD1-CB 4.36Å; I660-V678 HydrophobicContact CD1-CG1 4.17Å; I660-V678 HydrophobicContact CD1-CG2 3.45Å; I660-V678 VanDerWaalsContact CD1-CG2 3.45Å; I660-V678 HydrophobicContact CG1-CG2 4.49Å; I660-L681 HydrophobicContact CD1-CD2 3.71Å
661	L	87.8	Confident	85.3	Confident	66 Å²	66	39.9 Å²	39.9	35%	0.346	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	111	170.7	-176.4	69.5	0	0	0	108.8	P508 V512 L619 S663	P508-L661 HydrophobicContact CB-CD1 4.22Å; P508-L661 HydrophobicContact CB-CD2 4.2Å; P508-L661 HydrophobicContact CG-CD1 4.44Å; V512-L661 HydrophobicContact CG2-CD1 4.05Å; L619-L661 HydrophobicContact CD1-CB 3.7Å; L661-S663 WeakPolarHBondContact CD1-O 3.41Å
662	V	85.8	Confident	84.8	Confident	38 Å²	38	43 Å²	43	23%	0.23	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-31.7	179.4	176.6	0	0	0	0	110.9	V511 L513 I660 S674	V511-V662 PolarHBondContact O-N 3.47Å; L513-V662 HydrophobicContact CB-CG2 3.57Å; L513-V662 HydrophobicContact CD2-CG2 4.11Å; L513-V662 HydrophobicContact CG-CG2 4.46Å; I660-V662 PolarHBondContact O-N 3.02Å; V662-S674 WeakPolarHBondContact CG1-OG 3.49Å
663	S	83.2	Confident	84.2	Confident	25 Å²	25	50 Å²	50	18%	0.175	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	139.8	-178.3	166	0	0	0	0	110.4	G510 V511 L661 L665 S668	G510-S663 CarbonylContact C-O 3.59Å; G510-S663 WeakPolarHBondContact CA-O 3.34Å; V511-S663 PolarHBondContact N-O 3.14Å; L661-S663 WeakPolarHBondContact CD1-O 3.41Å; S663-L665 PolarHBondContact O-N 2.76Å; S663-L665 PolarHBondContact OG-N 2.75Å; S663-L665 PolarHBondContact OG-O 2.79Å; S663-S668 WeakPolarHBondContact CB-OG 3.22Å; S663-S668 VanDerWaalsContact OG-CB 3.23Å; S663-S668 WeakPolarHBondContact OG-CB 3.27Å; S663-S668 PolarHBondContact OG-OG 3.44Å
664	S	81.1	Confident	83.6	Confident	87 Å²	87	51.1 Å²	51.1	61%	0.608	29%	0.288	S	S	*	.	S	Bend	trans	-77.7	-8.2	172.8	55.5	0	0	0	0	113.5	S509 P666	S509-S664 WeakPolarHBondContact O-CA 3.17Å; S664-P666 WeakPolarHBondContact O-CD 3.34Å
665	L	79.1	Confident	83	Confident	109 Å²	109	51.9 Å²	51.9	57%	0.571	29%	0.292	S	S	*	.			trans	-95.2	113.4	176.1	-66.3	171.8	0	0	0	109.3	S663 S667 S668	S663-L665 PolarHBondContact O-N 2.76Å; S663-L665 PolarHBondContact OG-N 2.75Å; S663-L665 PolarHBondContact OG-O 2.79Å; L665-S667 PolarHBondContact O-N 3.35Å; L665-S668 WeakPolarHBondContact O-CB 3.37Å; L665-S668 PolarHBondContact O-N 2.82Å; L665-S668 PolarHBondContact O-OG 3.44Å
666	P	69.5	Low	82.5	Confident	47 Å²	47	54.7 Å²	54.7	31%	0.305	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.1	178.7	-24.9	34.2	0	0	0	113.8	R501 T503 S664 S668	R501-P666 VanDerWaalsContact CD-O 3.28Å; R501-P666 WeakPolarHBondContact CD-O 3.2Å; R501-P666 PolarHBondContact NE-O 3.48Å; T503-P666 HydrophobicContact CG2-CG 4.01Å; S664-P666 WeakPolarHBondContact O-CD 3.34Å; P666-S668 VanDerWaalsContact C-N 3.35Å
667	S	73.4	Confident	82	Confident	101 Å²	101	59.1 Å²	59.1	71%	0.706	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-10	178.6	55.9	0	0	0	0	114.5	L665	L665-S667 PolarHBondContact O-N 3.35Å
668	S	71.5	Confident	81.6	Confident	26 Å²	26	59.1 Å²	59.1	18%	0.182	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-66.7	144.9	-177.9	63.3	0	0	0	0	111.9	R501 V511 S663 L665 P666	R501-S668 PolarHBondContact NH2-O 3.09Å; V511-S668 WeakPolarHBondContact CG2-OG 3.18Å; S663-S668 WeakPolarHBondContact CB-OG 3.22Å; S663-S668 VanDerWaalsContact OG-CB 3.23Å; S663-S668 WeakPolarHBondContact OG-CB 3.27Å; S663-S668 PolarHBondContact OG-OG 3.44Å; L665-S668 WeakPolarHBondContact O-CB 3.37Å; L665-S668 PolarHBondContact O-N 2.82Å; L665-S668 PolarHBondContact O-OG 3.44Å; P666-S668 VanDerWaalsContact C-N 3.35Å
669	R	70.4	Confident	81.3	Confident	178 Å²	178	60.1 Å²	60.1	67%	0.672	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-83.7	151	169.9	-66.3	-171.4	-178.6	-162.6	2.3	110.1	D181	D181-R669 IonicContact OD1-NH1 3.87Å; D181-R669 PolarHBondContact OD1-NH1 3.33Å
670	L	73.4	Confident	81.1	Confident	21 Å²	21	62.9 Å²	62.9	11%	0.11	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-69.6	135.9	169.5	-124.4	100.8	0	0	0	109.6	L180 V499 V511 L513 V675	L180-L670 VanDerWaalsContact CD2-O 3.31Å; L180-L670 WeakPolarHBondContact CD2-O 3.28Å; V499-L670 HydrophobicContact CB-CD1 4.06Å; V499-L670 HydrophobicContact CG1-CD1 3.4Å; V499-L670 HydrophobicContact CG2-CD1 3.43Å; V499-L670 VanDerWaalsContact CG2-CD1 3.43Å; V499-L670 HydrophobicContact CG2-CD2 4.11Å; V499-L670 HydrophobicContact CG2-CG 4.36Å; V511-L670 HydrophobicContact CG1-CD1 3.77Å; L513-L670 HydrophobicContact CD1-CD1 4.25Å; L513-L670 HydrophobicContact CD1-CD2 3.76Å; L513-L670 HydrophobicContact CD2-CD2 4.4Å; L670-V675 HydrophobicContact CD2-CG2 3.32Å
671	N	77.6	Confident	81.1	Confident	66 Å²	66	61.5 Å²	61.5	35%	0.353	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-92.8	151.8	168.3	59.4	0.3	0	0	0	109.5	E673 S674	N671-E673 PolarHBondContact O-N 3.13Å; N671-S674 PolarHBondContact O-N 3.04Å; N671-S674 WeakPolarHBondContact OD1-CA 3.26Å; N671-S674 WeakPolarHBondContact OD1-CB 3.28Å; N671-S674 PolarHBondContact OD1-N 3.17Å; N671-S674 PolarHBondContact OD1-OG 3.12Å
672	A	80.9	Confident	81.3	Confident	66 Å²	66	58.3 Å²	58.3	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-28.7	174.2	0	0	0	0	0	112	L180 V675 A676	L180-A672 HydrophobicContact CD2-CB 4.33Å; A672-V675 PolarHBondContact O-N 3.34Å; A672-A676 PolarHBondContact O-N 3.09Å
673	E	83.6	Confident	81.5	Confident	147 Å²	147	57.1 Å²	57.1	69%	0.687	34%	0.338	S	S	*	.	H	α-helix	trans	-64.6	-41.3	178.9	-67.5	-178.8	172.7	0	0	113.3	N671 A676 T677	N671-E673 PolarHBondContact O-N 3.13Å; E673-A676 PolarHBondContact O-N 3Å; E673-T677 WeakPolarHBondContact O-CB 3.49Å; E673-T677 PolarHBondContact O-N 3.05Å; E673-T677 PolarHBondContact O-OG1 2.98Å
674	S	83	Confident	81.8	Confident	25 Å²	25	58 Å²	58	18%	0.175	34%	0.342	C	S	.	.	H	α-helix	trans	-68.2	-37.7	176.2	-67.2	0	0	0	0	111.5	V662 N671 A676 T677 V678	V662-S674 WeakPolarHBondContact CG1-OG 3.49Å; N671-S674 PolarHBondContact O-N 3.04Å; N671-S674 WeakPolarHBondContact OD1-CA 3.26Å; N671-S674 WeakPolarHBondContact OD1-CB 3.28Å; N671-S674 PolarHBondContact OD1-N 3.17Å; N671-S674 PolarHBondContact OD1-OG 3.12Å; S674-A676 VanDerWaalsContact C-N 3.34Å; S674-A676 PolarHBondContact O-N 3.19Å; S674-T677 PolarHBondContact O-N 2.75Å; S674-V678 WeakPolarHBondContact O-CG2 3.39Å; S674-V678 PolarHBondContact O-N 3.42Å
675	V	83.7	Confident	82.4	Confident	16 Å²	16	53.9 Å²	53.9	10%	0.097	31%	0.313	C	S	.	.	H	α-helix	trans	-59.4	-47.2	173.1	-176.2	0	0	0	0	110.8	L487 L670 A672 T677 V678 N679	L487-V675 HydrophobicContact CD1-CG1 3.46Å; L487-V675 VanDerWaalsContact CD1-CG1 3.46Å; L487-V675 HydrophobicContact CD2-CG1 3.43Å; L487-V675 VanDerWaalsContact CD2-CG1 3.43Å; L487-V675 HydrophobicContact CG-CG1 4.08Å; L670-V675 HydrophobicContact CD2-CG2 3.32Å; A672-V675 PolarHBondContact O-N 3.34Å; V675-T677 VanDerWaalsContact C-N 3.34Å; V675-T677 PolarHBondContact O-N 2.96Å; V675-V678 PolarHBondContact O-N 2.8Å; V675-N679 WeakPolarHBondContact O-CB 3.46Å; V675-N679 PolarHBondContact O-N 3.13Å
676	A	85	Confident	83	Confident	59 Å²	59	48.7 Å²	48.7	49%	0.488	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-39.4	179	0	0	0	0	0	112.4	A672 E673 S674 N679 S680	A672-A676 PolarHBondContact O-N 3.09Å; E673-A676 PolarHBondContact O-N 3Å; S674-A676 VanDerWaalsContact C-N 3.34Å; S674-A676 PolarHBondContact O-N 3.19Å; A676-N679 PolarHBondContact O-N 2.83Å; A676-S680 WeakPolarHBondContact O-CB 3.11Å; A676-S680 PolarHBondContact O-N 3.47Å
677	T	85.1	Confident	84.1	Confident	95 Å²	95	51.9 Å²	51.9	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-65.3	-45	178.3	-58.6	0	0	0	0	111.2	E673 S674 V675 S680 L681	E673-T677 WeakPolarHBondContact O-CB 3.49Å; E673-T677 PolarHBondContact O-N 3.05Å; E673-T677 PolarHBondContact O-OG1 2.98Å; S674-T677 PolarHBondContact O-N 2.75Å; V675-T677 VanDerWaalsContact C-N 3.34Å; V675-T677 PolarHBondContact O-N 2.96Å; T677-S680 PolarHBondContact O-N 3.43Å; T677-L681 WeakPolarHBondContact O-CB 3.4Å; T677-L681 PolarHBondContact O-N 2.93Å
678	V	86	Confident	85	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-68.8	-37.9	178.1	176.2	0	0	0	0	111.8	L513 A515 I660 S674 V675 S680 L681 I682	L513-V678 HydrophobicContact CD2-CB 3.95Å; L513-V678 HydrophobicContact CD2-CG1 4.39Å; L513-V678 HydrophobicContact CD2-CG2 3.56Å; L513-V678 HydrophobicContact CG-CG2 4.49Å; A515-V678 HydrophobicContact CB-CG1 3.25Å; I660-V678 HydrophobicContact CB-CG2 4.45Å; I660-V678 HydrophobicContact CD1-CB 4.36Å; I660-V678 HydrophobicContact CD1-CG1 4.17Å; I660-V678 HydrophobicContact CD1-CG2 3.45Å; I660-V678 VanDerWaalsContact CD1-CG2 3.45Å; I660-V678 HydrophobicContact CG1-CG2 4.49Å; S674-V678 WeakPolarHBondContact O-CG2 3.39Å; S674-V678 PolarHBondContact O-N 3.42Å; V675-V678 PolarHBondContact O-N 2.8Å; V678-S680 VanDerWaalsContact C-N 3.35Å; V678-L681 PolarHBondContact O-N 3.37Å; V678-I682 HydrophobicContact CG1-CD1 4.3Å; V678-I682 PolarHBondContact O-N 3.45Å
679	N	86.4	Confident	86	Confident	26 Å²	26	48.9 Å²	48.9	14%	0.139	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-47.6	172.4	-170.8	50.4	0	0	0	111.1	L487 V495 V675 A676 L681 I682 S683	L487-N679 HydrophobicContact CD1-CB 3.88Å; V495-N679 VanDerWaalsContact CB-OD1 3.25Å; V495-N679 WeakPolarHBondContact CB-OD1 3.48Å; V495-N679 WeakPolarHBondContact CG2-OD1 3.38Å; V675-N679 WeakPolarHBondContact O-CB 3.46Å; V675-N679 PolarHBondContact O-N 3.13Å; A676-N679 PolarHBondContact O-N 2.83Å; N679-L681 PolarHBondContact O-N 3.5Å; N679-I682 PolarHBondContact O-N 3.35Å; N679-S683 PolarHBondContact O-N 3.32Å; N679-S683 PolarHBondContact O-OG 2.9Å
680	S	88	Confident	87.1	Confident	68 Å²	68	41.7 Å²	41.7	48%	0.476	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-44.1	175.9	-170.8	0	0	0	0	111.8	A676 T677 V678 I682 S683 T684	A676-S680 WeakPolarHBondContact O-CB 3.11Å; A676-S680 PolarHBondContact O-N 3.47Å; T677-S680 PolarHBondContact O-N 3.43Å; V678-S680 VanDerWaalsContact C-N 3.35Å; S680-I682 VanDerWaalsContact C-N 3.34Å; S680-I682 PolarHBondContact O-N 3.37Å; S680-S683 PolarHBondContact O-N 3.48Å; S680-T684 WeakPolarHBondContact O-CB 3.26Å; S680-T684 PolarHBondContact O-N 3.35Å; S680-T684 PolarHBondContact O-OG1 2.99Å
681	L	89.3	Confident	88	Confident	21 Å²	21	43.3 Å²	43.3	11%	0.11	26%	0.259	C	S	.	.	H	α-helix	trans	-58.4	-46.2	179.3	-178.2	68.5	0	0	0	111.6	V543 L544 F658 I660 T677 V678 N679 T685	V543-L681 HydrophobicContact CB-CD1 3.68Å; V543-L681 HydrophobicContact CG1-CD1 3.67Å; V543-L681 HydrophobicContact CG2-CD1 4.38Å; L544-L681 HydrophobicContact CD2-CD1 4.1Å; L544-L681 HydrophobicContact CD2-CD2 4.33Å; F658-L681 HydrophobicContact CD1-CD2 4.13Å; F658-L681 HydrophobicContact CE1-CD2 4.28Å; F658-L681 HydrophobicContact CG-CD2 4.27Å; F658-L681 HydrophobicContact CZ-CG 4.43Å; I660-L681 HydrophobicContact CD1-CD2 3.71Å; T677-L681 WeakPolarHBondContact O-CB 3.4Å; T677-L681 PolarHBondContact O-N 2.93Å; V678-L681 PolarHBondContact O-N 3.37Å; N679-L681 PolarHBondContact O-N 3.5Å; L681-T685 WeakPolarHBondContact O-CB 3.29Å; L681-T685 PolarHBondContact O-N 2.91Å; L681-T685 PolarHBondContact O-OG1 3.03Å
682	I	90.8	Very high	88.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-50.5	177.7	-75.9	171.6	0	0	0	111.1	V495 A515 T517 F658 V678 N679 S680 T684 T685 V686	V495-I682 HydrophobicContact CG1-CD1 3.81Å; V495-I682 HydrophobicContact CG1-CG2 4.47Å; V495-I682 HydrophobicContact CG2-CB 4.36Å; V495-I682 HydrophobicContact CG2-CG2 3.78Å; A515-I682 VanDerWaalsContact C-CD1 3.5Å; A515-I682 HydrophobicContact CB-CD1 3.3Å; A515-I682 WeakPolarHBondContact O-CD1 3.49Å; T517-I682 HydrophobicContact CG2-CG2 3.4Å; T517-I682 VanDerWaalsContact CG2-CG2 3.4Å; F658-I682 HydrophobicContact CD2-CD1 4.05Å; F658-I682 HydrophobicContact CD2-CG1 3.37Å; F658-I682 HydrophobicContact CE2-CG1 3.7Å; V678-I682 HydrophobicContact CG1-CD1 4.3Å; V678-I682 PolarHBondContact O-N 3.45Å; N679-I682 PolarHBondContact O-N 3.35Å; S680-I682 VanDerWaalsContact C-N 3.34Å; S680-I682 PolarHBondContact O-N 3.37Å; I682-T684 VanDerWaalsContact C-N 3.35Å; I682-T684 PolarHBondContact O-N 3.25Å; I682-T685 PolarHBondContact O-N 3.04Å; I682-V686 HydrophobicContact CG2-CG2 4.4Å; I682-V686 WeakPolarHBondContact O-CG2 3.45Å; I682-V686 PolarHBondContact O-N 2.79Å
683	S	89.9	Confident	89.3	Confident	12 Å²	12	39.4 Å²	39.4	8%	0.084	23%	0.233	C	C	.	.	H	α-helix	trans	-59.2	-46	-179.2	-63	0	0	0	0	111.5	N679 S680 T685 V686 E687	N679-S683 PolarHBondContact O-N 3.32Å; N679-S683 PolarHBondContact O-OG 2.9Å; S680-S683 PolarHBondContact O-N 3.48Å; S683-T685 PolarHBondContact O-N 3.31Å; S683-V686 PolarHBondContact O-N 2.75Å; S683-E687 WeakPolarHBondContact O-CB 3.41Å; S683-E687 WeakPolarHBondContact O-CG 2.94Å; S683-E687 PolarHBondContact O-N 3.13Å
684	T	90.9	Very high	89.5	Confident	43 Å²	43	39.5 Å²	39.5	26%	0.264	24%	0.238	S	C	.	.	H	α-helix	trans	-62.5	-42.6	176.6	-56.6	0	0	0	0	111.8	V543 S680 I682 V686 E687 Q688	V543-T684 HydrophobicContact CG2-CG2 3.89Å; S680-T684 WeakPolarHBondContact O-CB 3.26Å; S680-T684 PolarHBondContact O-N 3.35Å; S680-T684 PolarHBondContact O-OG1 2.99Å; I682-T684 VanDerWaalsContact C-N 3.35Å; I682-T684 PolarHBondContact O-N 3.25Å; T684-V686 VanDerWaalsContact C-N 3.33Å; T684-V686 PolarHBondContact O-N 3.1Å; T684-E687 PolarHBondContact O-N 3.26Å; T684-Q688 HydrophobicContact CG2-CG 4.47Å; T684-Q688 WeakPolarHBondContact O-CB 3.5Å; T684-Q688 WeakPolarHBondContact O-CG 3.35Å; T684-Q688 PolarHBondContact O-N 3.31Å
685	T	92.4	Very high	89.6	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-45.1	176.7	-57.5	0	0	0	0	110.9	F623 V656 F658 L681 I682 S683 Q688 I689	F623-T685 HydrophobicContact CE1-CG2 4.36Å; F623-T685 HydrophobicContact CZ-CG2 4.42Å; V656-T685 HydrophobicContact CG1-CG2 4.28Å; F658-T685 HydrophobicContact CE2-CG2 4.45Å; F658-T685 HydrophobicContact CZ-CG2 4.07Å; L681-T685 WeakPolarHBondContact O-CB 3.29Å; L681-T685 PolarHBondContact O-N 2.91Å; L681-T685 PolarHBondContact O-OG1 3.03Å; I682-T685 PolarHBondContact O-N 3.04Å; S683-T685 PolarHBondContact O-N 3.31Å; T685-Q688 PolarHBondContact O-N 2.74Å; T685-I689 HydrophobicContact CG2-CD1 3.96Å; T685-I689 VanDerWaalsContact O-CG1 3.27Å; T685-I689 WeakPolarHBondContact O-CG1 3.42Å; T685-I689 PolarHBondContact O-N 3.08Å
686	V	92.6	Very high	89.2	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-62.7	-46.2	177.9	166.1	0	0	0	0	111.5	V493 T517 I519 V656 I682 S683 T684 Q688 I689 K690	V493-V686 HydrophobicContact CG2-CG1 4.14Å; T517-V686 HydrophobicContact CG2-CG2 3.9Å; I519-V686 HydrophobicContact CD1-CG1 3.82Å; I519-V686 HydrophobicContact CD1-CG2 4.45Å; I519-V686 HydrophobicContact CG2-CG1 4.08Å; V656-V686 HydrophobicContact CG2-CG2 3.97Å; I682-V686 HydrophobicContact CG2-CG2 4.4Å; I682-V686 WeakPolarHBondContact O-CG2 3.45Å; I682-V686 PolarHBondContact O-N 2.79Å; S683-V686 PolarHBondContact O-N 2.75Å; T684-V686 VanDerWaalsContact C-N 3.33Å; T684-V686 PolarHBondContact O-N 3.1Å; V686-Q688 VanDerWaalsContact C-N 3.33Å; V686-Q688 PolarHBondContact O-N 3.36Å; V686-I689 PolarHBondContact O-N 3.3Å; V686-K690 HydrophobicContact CG1-CD 4.1Å; V686-K690 WeakPolarHBondContact O-CB 3.32Å; V686-K690 WeakPolarHBondContact O-CG 3.42Å; V686-K690 PolarHBondContact O-N 3.15Å
687	E	92	Very high	88.5	Confident	114 Å²	114	44 Å²	44	53%	0.533	27%	0.272	S	S	.	.	H	α-helix	trans	-61.3	-41.7	177.3	-75	171.1	-171.7	0	0	111.9	S683 T684 K690 A691	S683-E687 WeakPolarHBondContact O-CB 3.41Å; S683-E687 WeakPolarHBondContact O-CG 2.94Å; S683-E687 PolarHBondContact O-N 3.13Å; T684-E687 PolarHBondContact O-N 3.26Å; E687-K690 PolarHBondContact O-N 2.95Å; E687-A691 VanDerWaalsContact O-CB 3.32Å; E687-A691 WeakPolarHBondContact O-CB 2.93Å; E687-A691 PolarHBondContact O-N 3.15Å
688	Q	91.9	Very high	87.3	Confident	63 Å²	63	45.2 Å²	45.2	29%	0.294	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-44.2	176.3	-81.3	-176.5	-1.6	0	0	112.5	Q540 W541 T684 T685 V686 A691 A692	Q540-Q688 WeakPolarHBondContact O-CB 3.44Å; Q540-Q688 PolarHBondContact O-OE1 3.19Å; W541-Q688 VanDerWaalsContact CA-OE1 3.31Å; W541-Q688 PolarHBondContact O-OE1 3.25Å; T684-Q688 HydrophobicContact CG2-CG 4.47Å; T684-Q688 WeakPolarHBondContact O-CB 3.5Å; T684-Q688 WeakPolarHBondContact O-CG 3.35Å; T684-Q688 PolarHBondContact O-N 3.31Å; T685-Q688 PolarHBondContact O-N 2.74Å; V686-Q688 VanDerWaalsContact C-N 3.33Å; V686-Q688 PolarHBondContact O-N 3.36Å; Q688-A691 PolarHBondContact O-N 3.32Å; Q688-A692 VanDerWaalsContact O-CB 3.29Å; Q688-A692 WeakPolarHBondContact O-CB 3.32Å; Q688-A692 PolarHBondContact O-N 3.23Å
689	I	93.6	Very high	87.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-46.7	174.6	-68.6	167.9	0	0	0	110.2	L521 F531 W541 F623 T685 V686 A691 A692 L693	L521-I689 HydrophobicContact CD1-CG2 4.17Å; F531-I689 HydrophobicContact CE1-CG1 4.29Å; F531-I689 HydrophobicContact CE1-CG2 4.37Å; W541-I689 HydrophobicContact CB-CD1 4.47Å; W541-I689 HydrophobicContact CB-CG1 3.67Å; W541-I689 HydrophobicContact CG-CG1 4.33Å; F623-I689 HydrophobicContact CD1-CD1 4.31Å; F623-I689 HydrophobicContact CE1-CD1 3.54Å; F623-I689 HydrophobicContact CZ-CD1 4.13Å; T685-I689 HydrophobicContact CG2-CD1 3.96Å; T685-I689 VanDerWaalsContact O-CG1 3.27Å; T685-I689 WeakPolarHBondContact O-CG1 3.42Å; T685-I689 PolarHBondContact O-N 3.08Å; V686-I689 PolarHBondContact O-N 3.3Å; I689-A691 PolarHBondContact O-N 3.31Å; I689-A692 PolarHBondContact O-N 2.7Å; I689-L693 HydrophobicContact CG2-CD1 3.8Å; I689-L693 HydrophobicContact CG2-CG 4.49Å; I689-L693 WeakPolarHBondContact O-CB 3.33Å; I689-L693 WeakPolarHBondContact O-CG 3.18Å; I689-L693 PolarHBondContact O-N 2.94Å
690	K	93	Very high	87.4	Confident	27 Å²	27	48.4 Å²	48.4	12%	0.117	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-45.2	177	-74.9	177.7	176	-168.2	0	111.3	L521 V686 E687 L693 N694 C695 A696 H698	L521-K690 HydrophobicContact CD2-CG 3.92Å; V686-K690 HydrophobicContact CG1-CD 4.1Å; V686-K690 WeakPolarHBondContact O-CB 3.32Å; V686-K690 WeakPolarHBondContact O-CG 3.42Å; V686-K690 PolarHBondContact O-N 3.15Å; E687-K690 PolarHBondContact O-N 2.95Å; K690-L693 PolarHBondContact O-N 2.82Å; K690-N694 PolarHBondContact O-N 3.45Å; K690-C695 CarbonylContact O-C 3.59Å; K690-C695 WeakPolarHBondContact O-CA 3.33Å; K690-C695 PolarHBondContact O-N 2.96Å; K690-A696 PolarHBondContact O-N 3.26Å; K690-H698 VanDerWaalsContact CD-O 3.26Å; K690-H698 WeakPolarHBondContact CD-O 3.39Å; K690-H698 WeakPolarHBondContact CE-O 3.31Å; K690-H698 PolarHBondContact NZ-O 3.49Å
691	A	92.5	Very high	87.3	Confident	56 Å²	56	47.3 Å²	47.3	46%	0.463	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-49.1	178.5	0	0	0	0	0	111.9	E687 Q688 I689 L693 N694	E687-A691 VanDerWaalsContact O-CB 3.32Å; E687-A691 WeakPolarHBondContact O-CB 2.93Å; E687-A691 PolarHBondContact O-N 3.15Å; Q688-A691 PolarHBondContact O-N 3.32Å; I689-A691 PolarHBondContact O-N 3.31Å; A691-L693 VanDerWaalsContact C-N 3.29Å; A691-L693 PolarHBondContact O-N 2.97Å; A691-N694 PolarHBondContact O-N 2.89Å
692	A	92	Very high	87.2	Confident	31 Å²	31	48.8 Å²	48.8	26%	0.256	29%	0.29	S	S	.	.	H	α-helix	trans	-63.4	-34	-179.5	0	0	0	0	0	112.9	F531 Q540 Q688 I689 N694	F531-A692 HydrophobicContact CE1-CB 4.28Å; F531-A692 HydrophobicContact CE2-CB 3.69Å; F531-A692 HydrophobicContact CZ-CB 3.34Å; Q540-A692 HydrophobicContact CB-CB 4.29Å; Q688-A692 VanDerWaalsContact O-CB 3.29Å; Q688-A692 WeakPolarHBondContact O-CB 3.32Å; Q688-A692 PolarHBondContact O-N 3.23Å; I689-A692 PolarHBondContact O-N 2.7Å; A692-N694 VanDerWaalsContact C-N 3.29Å
693	L	92.8	Very high	87	Confident	18 Å²	18	51.9 Å²	51.9	9%	0.094	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	7.8	175.3	-64.8	178	0	0	0	113.7	L521 V523 V528 F531 I689 K690 A691 C695	L521-L693 HydrophobicContact CD1-CD1 3.88Å; V523-L693 HydrophobicContact CG2-CB 4.36Å; V528-L693 HydrophobicContact CG2-CD1 4.16Å; F531-L693 HydrophobicContact CB-CD2 4.01Å; F531-L693 HydrophobicContact CD1-CD1 4.27Å; F531-L693 HydrophobicContact CD1-CD2 4.04Å; F531-L693 HydrophobicContact CD1-CG 4.15Å; F531-L693 HydrophobicContact CD2-CD2 4.1Å; F531-L693 HydrophobicContact CE1-CG 4.38Å; F531-L693 HydrophobicContact CG-CD2 3.77Å; F531-L693 HydrophobicContact CG-CG 4.37Å; I689-L693 HydrophobicContact CG2-CD1 3.8Å; I689-L693 HydrophobicContact CG2-CG 4.49Å; I689-L693 WeakPolarHBondContact O-CB 3.33Å; I689-L693 WeakPolarHBondContact O-CG 3.18Å; I689-L693 PolarHBondContact O-N 2.94Å; K690-L693 PolarHBondContact O-N 2.82Å; A691-L693 VanDerWaalsContact C-N 3.29Å; A691-L693 PolarHBondContact O-N 2.97Å; L693-C695 VanDerWaalsContact C-N 3.26Å; L693-C695 PolarHBondContact O-N 3.35Å; L693-C695 PolarHBondContact O-SG 2.81Å
694	N	88.2	Confident	86.8	Confident	149 Å²	149	54.5 Å²	54.5	80%	0.797	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	34.9	-177.7	-57.7	-61.7	0	0	0	114.2	K690 A691 A692	K690-N694 PolarHBondContact O-N 3.45Å; A691-N694 PolarHBondContact O-N 2.89Å; A692-N694 VanDerWaalsContact C-N 3.29Å
695	C	84.8	Confident	86.5	Confident	6 Å²	6	55.4 Å²	55.4	4%	0.041	33%	0.328	C	S	.	.			trans	-115.4	23.2	-178.2	-62.2	0	0	0	0	112.7	L521 P522 V523 K690 L693 S697 H698	L521-C695 HydrophobicContact CD2-CB 4.43Å; P522-C695 HydrophobicContact CG-CB 4.42Å; V523-C695 WeakPolarHBondContact CG2-SG 3.45Å; K690-C695 CarbonylContact O-C 3.59Å; K690-C695 WeakPolarHBondContact O-CA 3.33Å; K690-C695 PolarHBondContact O-N 2.96Å; L693-C695 VanDerWaalsContact C-N 3.26Å; L693-C695 PolarHBondContact O-N 3.35Å; L693-C695 PolarHBondContact O-SG 2.81Å; C695-S697 PolarHBondContact O-N 3.1Å; C695-H698 PolarHBondContact O-N 2.95Å
696	A	75	Confident	86.1	Confident	82 Å²	82	59.5 Å²	59.5	68%	0.678	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.2	-174.1	0	0	0	0	0	114.6	K690	K690-A696 PolarHBondContact O-N 3.26Å
697	S	71.1	Confident	85.5	Confident	107 Å²	107	64.4 Å²	64.4	75%	0.748	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.2	177.7	58.7	0	0	0	0	115	C695	C695-S697 PolarHBondContact O-N 3.1Å
698	H	59.5	Low	84.9	Confident	120 Å²	120	59.9 Å²	59.9	56%	0.556	37%	0.368	S	S	*	.			trans	-112.7	0	-175.2	-71.1	-73.4	0	0	0	112.1	W520 K690 C695	W520-H698 AromaticContact CZ3-ND1 3.98Å; K690-H698 VanDerWaalsContact CD-O 3.26Å; K690-H698 WeakPolarHBondContact CD-O 3.39Å; K690-H698 WeakPolarHBondContact CE-O 3.31Å; K690-H698 PolarHBondContact NZ-O 3.49Å; C695-H698 PolarHBondContact O-N 2.95Å

Retrieved 698 of 698 residues in 146.9 ms (Link to these results)

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