A0A060D9I0_MAIZE Loading...

HB transcription factor

AlphaFold DB (G2J5S7), UniProt , Accession A0A060D9I0, Species MAIZE (Zea mays, Maize), Gene HB83, Length 698 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	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 145.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).