A0A087WZX9_HUMAN Loading...

Cytochrome P450 family 4 subfamily A member 22

AlphaFold DB , UniProt , Accession A0A087WZX9, Species HUMAN (Homo sapiens, Human), Gene CYP4A22, Length 357 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.2	Very low	44.9	Very low	244 Å²	244	154.4 Å²	154.4	100%	1.202	84%	0.84	S	S	*	*				0	103.5	0	-70.9	-178	175.1	0	0	106.8
2	S	37	Very low	45.5	Very low	124 Å²	124	155.2 Å²	155.2	87%	0.867	84%	0.842	S	S	*	*			trans	-77.7	135.9	-167.7	-73.3	0	0	0	0	112.4	S4	S2-S4 PolarHBondContact O-N 3.23Å
3	V	47.4	Very low	45.9	Very low	131 Å²	131	148.8 Å²	148.8	79%	0.794	84%	0.835	S	S	*	*			trans	-78.1	112	174.2	-176.5	0	0	0	0	108.2	V5	V3-V5 PolarHBondContact O-N 3.37Å
4	S	38.6	Very low	47.3	Very low	118 Å²	118	140.4 Å²	140.4	83%	0.825	80%	0.797	S	S	*	*			trans	-81.5	103.5	171.8	-70.8	0	0	0	0	109.7	S2 L6	S2-S4 PolarHBondContact O-N 3.23Å; S4-L6 PolarHBondContact O-N 3.11Å
5	V	44.5	Very low	49	Very low	113 Å²	113	138.7 Å²	138.7	69%	0.685	79%	0.791	S	S	*	*			trans	-64.7	118.3	175.6	174.2	0	0	0	0	110.1	V3 S7	V3-V5 PolarHBondContact O-N 3.37Å; V5-S7 PolarHBondContact O-N 3.25Å; V5-S7 PolarHBondContact O-OG 2.79Å
6	L	47.6	Very low	50.8	Low	170 Å²	170	134.9 Å²	134.9	89%	0.89	78%	0.776	S	S	*	*			trans	-56.6	108.1	163	-80.7	159.6	0	0	0	108.7	S4 P8	S4-L6 PolarHBondContact O-N 3.11Å; L6-P8 WeakPolarHBondContact O-CD 3.48Å
7	S	42.3	Very low	52.6	Low	91 Å²	91	128.1 Å²	128.1	64%	0.636	74%	0.742	S	S	*	*			trans	-95.9	113.4	176.2	-56.3	0	0	0	0	109.3	V5 S9	V5-S7 PolarHBondContact O-N 3.25Å; V5-S7 PolarHBondContact O-OG 2.79Å; S7-S9 PolarHBondContact O-N 3.33Å
8	P	48.3	Very low	54.4	Low	132 Å²	132	127 Å²	127	86%	0.857	73%	0.731	S	S	*	*			trans	-86.8	86.7	170.3	33.2	-27.3	0	0	0	108.5	L6	L6-P8 WeakPolarHBondContact O-CD 3.48Å
9	S	47.4	Very low	56.2	Low	98 Å²	98	125.9 Å²	125.9	69%	0.685	72%	0.722	S	S	*	*			trans	-126.4	57.9	170.3	49.3	0	0	0	0	110.6	S7 R11	S7-S9 PolarHBondContact O-N 3.33Å; S9-R11 VanDerWaalsContact C-N 3.33Å; S9-R11 PolarHBondContact O-N 3.01Å
10	R	51.3	Low	57.9	Low	249 Å²	249	125.8 Å²	125.8	94%	0.94	72%	0.715	S	S	*	*			trans	-71	98.6	156.6	-89	-171	-170.2	-165.3	3.9	107.9	L12	R10-L12 PolarHBondContact O-N 3.14Å; R10-L12 VanDerWaalsContact O-N 3.12Å
11	R	46.6	Very low	59.6	Low	228 Å²	228	124.4 Å²	124.4	86%	0.86	71%	0.709	S	S	*	*			trans	-34.1	109.2	174.5	-66.6	178.9	179.6	-174.6	-0.7	112.2	S9 G13	S9-R11 VanDerWaalsContact C-N 3.33Å; S9-R11 PolarHBondContact O-N 3.01Å; R11-G13 PolarHBondContact O-N 3.2Å
12	L	52.1	Low	62	Low	164 Å²	164	115.8 Å²	115.8	86%	0.859	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	1.1	161.7	-134.2	86.2	0	0	0	112.5	R10	R10-L12 PolarHBondContact O-N 3.14Å; R10-L12 VanDerWaalsContact O-N 3.12Å
13	G	50.3	Low	64.8	Low	73 Å²	73	113.4 Å²	113.4	75%	0.753	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	14	-173.6	0	0	0	0	0	115.9	R11	R11-G13 PolarHBondContact O-N 3.2Å
14	G	66	Low	67.1	Low	30 Å²	30	112.7 Å²	112.7	31%	0.309	64%	0.644	S	S	.	*	S	Bend	trans	-93.4	149.7	174.7	0	0	0	0	0	112	S16 G17 I18	G14-S16 PolarHBondContact O-N 3.01Å; G14-G17 PolarHBondContact O-N 3.24Å; G14-I18 PolarHBondContact O-N 2.99Å
15	V	72.1	Confident	69.8	Low	115 Å²	115	111.6 Å²	111.6	70%	0.697	63%	0.629	S	S	*	*	H	α-helix	trans	-48.3	-34.2	174.8	-177.5	0	0	0	0	112	I18 L19	V15-I18 PolarHBondContact O-N 3.16Å; V15-L19 HydrophobicContact CG1-CD1 3.99Å; V15-L19 WeakPolarHBondContact O-CD1 3.2Å; V15-L19 WeakPolarHBondContact O-CG 3.27Å; V15-L19 PolarHBondContact O-N 3.07Å
16	S	77.6	Confident	72.3	Confident	79 Å²	79	111 Å²	111	55%	0.552	62%	0.621	S	S	*	*	H	α-helix	trans	-64.1	-37.5	175.1	178.6	0	0	0	0	114.3	G14 L19 Q20	G14-S16 PolarHBondContact O-N 3.01Å; S16-L19 PolarHBondContact O-N 3.07Å; S16-Q20 WeakPolarHBondContact O-CG 3.1Å; S16-Q20 PolarHBondContact O-N 3.13Å; S16-Q20 VanDerWaalsContact O-N 3.08Å
17	G	81.6	Confident	74.6	Confident	19 Å²	19	107.4 Å²	107.4	20%	0.196	60%	0.602	C	S	.	*	H	α-helix	trans	-70.2	-37.9	176.4	0	0	0	0	0	112.1	G14 Q20 V21	G14-G17 PolarHBondContact O-N 3.24Å; G17-Q20 PolarHBondContact O-N 3.17Å; G17-V21 WeakPolarHBondContact O-CG2 3.37Å; G17-V21 PolarHBondContact O-N 3.13Å
18	I	85.9	Confident	77.2	Confident	108 Å²	108	107.6 Å²	107.6	55%	0.554	60%	0.595	S	S	*	*	H	α-helix	trans	-64.4	-44.7	174.5	-61	173.7	0	0	0	110.3	G14 V15 Q20 V21 T22	G14-I18 PolarHBondContact O-N 2.99Å; V15-I18 PolarHBondContact O-N 3.16Å; I18-Q20 VanDerWaalsContact C-N 3.33Å; I18-Q20 PolarHBondContact O-N 3.41Å; I18-V21 PolarHBondContact O-N 2.95Å; I18-T22 HydrophobicContact CG2-CG2 4.39Å; I18-T22 WeakPolarHBondContact O-CG2 3.17Å; I18-T22 PolarHBondContact O-N 3.19Å; I18-T22 PolarHBondContact O-OG1 3.03Å
19	L	88.8	Confident	79.6	Confident	106 Å²	106	105.9 Å²	105.9	56%	0.555	58%	0.578	S	S	*	*	H	α-helix	trans	-60.1	-37.7	175.6	-82.3	156.2	0	0	0	113.3	V15 S16 T22 S23	V15-L19 HydrophobicContact CG1-CD1 3.99Å; V15-L19 WeakPolarHBondContact O-CD1 3.2Å; V15-L19 WeakPolarHBondContact O-CG 3.27Å; V15-L19 PolarHBondContact O-N 3.07Å; S16-L19 PolarHBondContact O-N 3.07Å; L19-T22 WeakPolarHBondContact CA-OG1 3.4Å; L19-T22 PolarHBondContact O-OG1 3.37Å; L19-S23 VanDerWaalsContact O-CB 3.26Å; L19-S23 WeakPolarHBondContact O-CB 3.26Å; L19-S23 PolarHBondContact O-N 3.08Å
20	Q	90	Very high	81.9	Confident	123 Å²	123	106.4 Å²	106.4	58%	0.575	57%	0.573	S	S	*	*	H	α-helix	trans	-69.2	-43.9	176.9	-75.4	175.4	-12.8	0	0	111.9	S16 G17 I18 S23 L24	S16-Q20 WeakPolarHBondContact O-CG 3.1Å; S16-Q20 PolarHBondContact O-N 3.13Å; S16-Q20 VanDerWaalsContact O-N 3.08Å; G17-Q20 PolarHBondContact O-N 3.17Å; I18-Q20 VanDerWaalsContact C-N 3.33Å; I18-Q20 PolarHBondContact O-N 3.41Å; Q20-S23 PolarHBondContact O-N 2.61Å; Q20-L24 WeakPolarHBondContact O-CG 3.22Å; Q20-L24 PolarHBondContact O-N 3.34Å
21	V	92.8	Very high	84	Confident	97 Å²	97	99.8 Å²	99.8	59%	0.588	56%	0.555	S	S	*	*	H	α-helix	trans	-64.9	-41.7	177.4	174.6	0	0	0	0	111.1	G17 I18 L24 L25	G17-V21 WeakPolarHBondContact O-CG2 3.37Å; G17-V21 PolarHBondContact O-N 3.13Å; I18-V21 PolarHBondContact O-N 2.95Å; V21-L24 PolarHBondContact O-N 3.37Å; V21-L25 WeakPolarHBondContact O-CB 3.38Å; V21-L25 PolarHBondContact O-N 3.38Å
22	T	94	Very high	86.4	Confident	63 Å²	63	92.5 Å²	92.5	39%	0.387	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-40.3	176.2	56.4	0	0	0	0	111.9	I18 L19 L25 I26	I18-T22 HydrophobicContact CG2-CG2 4.39Å; I18-T22 WeakPolarHBondContact O-CG2 3.17Å; I18-T22 PolarHBondContact O-N 3.19Å; I18-T22 PolarHBondContact O-OG1 3.03Å; L19-T22 WeakPolarHBondContact CA-OG1 3.4Å; L19-T22 PolarHBondContact O-OG1 3.37Å; T22-L25 PolarHBondContact O-N 2.95Å; T22-I26 VanDerWaalsContact O-CG1 3.25Å; T22-I26 WeakPolarHBondContact O-CG1 3.46Å; T22-I26 PolarHBondContact O-N 3.32Å
23	S	94.9	Very high	88.3	Confident	74 Å²	74	90.7 Å²	90.7	52%	0.517	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-45.2	175.1	-177.8	0	0	0	0	112.2	L19 Q20 I26 L27	L19-S23 VanDerWaalsContact O-CB 3.26Å; L19-S23 WeakPolarHBondContact O-CB 3.26Å; L19-S23 PolarHBondContact O-N 3.08Å; Q20-S23 PolarHBondContact O-N 2.61Å; S23-I26 PolarHBondContact O-N 2.79Å; S23-L27 WeakPolarHBondContact O-CB 3.45Å; S23-L27 PolarHBondContact O-N 2.93Å
24	L	95.9	Very high	90.3	Very high	116 Å²	116	89.9 Å²	89.9	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-64.7	-39.4	176.2	-71.1	172.9	0	0	0	112.2	Q20 V21 L27 L28	Q20-L24 WeakPolarHBondContact O-CG 3.22Å; Q20-L24 PolarHBondContact O-N 3.34Å; V21-L24 PolarHBondContact O-N 3.37Å; L24-L27 PolarHBondContact O-N 2.91Å; L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 PolarHBondContact O-N 2.8Å
25	L	96.2	Very high	91.6	Very high	96 Å²	96	91 Å²	91	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-44.2	175.3	-177.6	64.3	0	0	0	111.4	V21 T22 L28 L29	V21-L25 WeakPolarHBondContact O-CB 3.38Å; V21-L25 PolarHBondContact O-N 3.38Å; T22-L25 PolarHBondContact O-N 2.95Å; L25-L28 PolarHBondContact O-N 2.99Å; L25-L29 HydrophobicContact CG-CD1 4.31Å; L25-L29 VanDerWaalsContact O-CG 3.29Å; L25-L29 WeakPolarHBondContact O-CG 3.29Å; L25-L29 PolarHBondContact O-N 3.37Å
26	I	96.5	Very high	92.6	Very high	101 Å²	101	90.4 Å²	90.4	52%	0.518	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-46.3	175.8	-69.5	164.6	0	0	0	110.2	T22 S23 L28 L29 L30	T22-I26 VanDerWaalsContact O-CG1 3.25Å; T22-I26 WeakPolarHBondContact O-CG1 3.46Å; T22-I26 PolarHBondContact O-N 3.32Å; S23-I26 PolarHBondContact O-N 2.79Å; I26-L28 VanDerWaalsContact C-N 3.35Å; I26-L28 PolarHBondContact O-N 2.82Å; I26-L29 PolarHBondContact O-N 3.03Å; I26-L30 HydrophobicContact CG2-CD1 4.02Å; I26-L30 HydrophobicContact CG2-CG 4.37Å; I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.35Å; I26-L30 PolarHBondContact O-N 3.14Å
27	L	96.8	Very high	93.2	Very high	93 Å²	93	90.8 Å²	90.8	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-60.6	-43.5	177.9	-176.9	65	0	0	0	111.8	S23 L24 L30 L31	S23-L27 WeakPolarHBondContact O-CB 3.45Å; S23-L27 PolarHBondContact O-N 2.93Å; L24-L27 PolarHBondContact O-N 2.91Å; L27-L30 PolarHBondContact O-N 3.14Å; L27-L31 HydrophobicContact CG-CD1 4.37Å; L27-L31 WeakPolarHBondContact O-CG 3.35Å; L27-L31 PolarHBondContact O-N 3.5Å
28	L	96.9	Very high	93.6	Very high	95 Å²	95	96.6 Å²	96.6	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-61.3	-45.2	176	179.6	63.7	0	0	0	111.5	L24 L25 I26 L30 L31 I32	L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 PolarHBondContact O-N 2.8Å; L25-L28 PolarHBondContact O-N 2.99Å; I26-L28 VanDerWaalsContact C-N 3.35Å; I26-L28 PolarHBondContact O-N 2.82Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L28-L30 PolarHBondContact O-N 3.2Å; L28-L31 PolarHBondContact O-N 3.46Å; L28-I32 HydrophobicContact CD1-CD1 4.26Å; L28-I32 HydrophobicContact CD1-CG1 4.5Å; L28-I32 HydrophobicContact CG-CD1 4.06Å; L28-I32 VanDerWaalsContact O-CG1 3.32Å; L28-I32 WeakPolarHBondContact O-CG1 3.47Å; L28-I32 PolarHBondContact O-N 2.79Å
29	L	96.9	Very high	93.9	Very high	97 Å²	97	97 Å²	97	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-63	-39.3	176.7	-70.5	174.1	0	0	0	111.8	L25 I26 I32 K33	L25-L29 HydrophobicContact CG-CD1 4.31Å; L25-L29 VanDerWaalsContact O-CG 3.29Å; L25-L29 WeakPolarHBondContact O-CG 3.29Å; L25-L29 PolarHBondContact O-N 3.37Å; I26-L29 PolarHBondContact O-N 3.03Å; L29-I32 PolarHBondContact O-N 3.46Å; L29-K33 WeakPolarHBondContact O-CB 3.44Å; L29-K33 VanDerWaalsContact O-CG 3.27Å; L29-K33 WeakPolarHBondContact O-CG 3.37Å; L29-K33 PolarHBondContact O-N 3.23Å
30	L	96.1	Very high	94	Very high	109 Å²	109	96 Å²	96	57%	0.571	51%	0.507	S	S	*	.	H	α-helix	trans	-64.2	-42.8	174.8	-72	173.8	0	0	0	111.9	I26 L27 L28 K33 A34	I26-L30 HydrophobicContact CG2-CD1 4.02Å; I26-L30 HydrophobicContact CG2-CG 4.37Å; I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.35Å; I26-L30 PolarHBondContact O-N 3.14Å; L27-L30 PolarHBondContact O-N 3.14Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L28-L30 PolarHBondContact O-N 3.2Å; L30-K33 PolarHBondContact O-N 3.14Å; L30-A34 WeakPolarHBondContact O-CB 3.38Å; L30-A34 PolarHBondContact O-N 2.82Å
31	L	96.1	Very high	93.9	Very high	109 Å²	109	91.9 Å²	91.9	57%	0.571	49%	0.486	S	S	*	.	H	α-helix	trans	-64.2	-43.2	176.2	-74.3	172	0	0	0	112	L27 L28 K33 A34 A35	L27-L31 HydrophobicContact CG-CD1 4.37Å; L27-L31 WeakPolarHBondContact O-CG 3.35Å; L27-L31 PolarHBondContact O-N 3.5Å; L28-L31 PolarHBondContact O-N 3.46Å; L31-K33 VanDerWaalsContact C-N 3.32Å; L31-K33 PolarHBondContact O-N 3.15Å; L31-A34 PolarHBondContact O-N 3.47Å; L31-A35 WeakPolarHBondContact O-CB 3.33Å; L31-A35 PolarHBondContact O-N 3.31Å
32	I	96.1	Very high	93.8	Very high	76 Å²	76	91.1 Å²	91.1	39%	0.39	48%	0.477	S	S	.	.	H	α-helix	trans	-60.8	-44.1	174.5	-68.6	167.5	0	0	0	110.2	L28 L29 A35 Q36	L28-I32 HydrophobicContact CD1-CD1 4.26Å; L28-I32 HydrophobicContact CD1-CG1 4.5Å; L28-I32 HydrophobicContact CG-CD1 4.06Å; L28-I32 VanDerWaalsContact O-CG1 3.32Å; L28-I32 WeakPolarHBondContact O-CG1 3.47Å; L28-I32 PolarHBondContact O-N 2.79Å; L29-I32 PolarHBondContact O-N 3.46Å; I32-A35 PolarHBondContact O-N 3.18Å; I32-Q36 HydrophobicContact CG2-CG 4.43Å; I32-Q36 WeakPolarHBondContact O-CB 3.06Å; I32-Q36 VanDerWaalsContact O-CG 3.29Å; I32-Q36 WeakPolarHBondContact O-CG 3.45Å; I32-Q36 PolarHBondContact O-N 2.88Å
33	K	93.8	Very high	93.8	Very high	126 Å²	126	94 Å²	94	55%	0.548	48%	0.481	S	S	.	.	H	α-helix	trans	-64.1	-41.2	176.8	-73.9	-70.3	174.5	-164.8	0	112.3	L29 L30 L31 Q36 L37	L29-K33 WeakPolarHBondContact O-CB 3.44Å; L29-K33 VanDerWaalsContact O-CG 3.27Å; L29-K33 WeakPolarHBondContact O-CG 3.37Å; L29-K33 PolarHBondContact O-N 3.23Å; L30-K33 PolarHBondContact O-N 3.14Å; L31-K33 VanDerWaalsContact C-N 3.32Å; L31-K33 PolarHBondContact O-N 3.15Å; K33-Q36 PolarHBondContact O-N 3.28Å; K33-L37 WeakPolarHBondContact O-CB 3.42Å; K33-L37 VanDerWaalsContact O-CG 3.25Å; K33-L37 WeakPolarHBondContact O-CG 3.42Å; K33-L37 PolarHBondContact O-N 3.15Å
34	A	91.3	Very high	93.7	Very high	56 Å²	56	90.7 Å²	90.7	46%	0.463	46%	0.457	S	S	.	.	H	α-helix	trans	-62.4	-44.2	175.4	0	0	0	0	0	111.6	L30 L31 L37 Y38	L30-A34 WeakPolarHBondContact O-CB 3.38Å; L30-A34 PolarHBondContact O-N 2.82Å; L31-A34 PolarHBondContact O-N 3.47Å; A34-L37 PolarHBondContact O-N 3.01Å; A34-Y38 WeakPolarHBondContact O-CB 3.33Å; A34-Y38 PolarHBondContact O-N 3.27Å
35	A	93.9	Very high	93.4	Very high	52 Å²	52	88.4 Å²	88.4	43%	0.43	45%	0.445	S	S	.	.	H	α-helix	trans	-63.2	-44.4	175.6	0	0	0	0	0	112	L31 I32 L37 Y38 L39	L31-A35 WeakPolarHBondContact O-CB 3.33Å; L31-A35 PolarHBondContact O-N 3.31Å; I32-A35 PolarHBondContact O-N 3.18Å; A35-L37 PolarHBondContact O-N 3.08Å; A35-Y38 PolarHBondContact O-N 3.35Å; A35-L39 WeakPolarHBondContact O-CB 3.36Å; A35-L39 VanDerWaalsContact O-CG 3.31Å; A35-L39 WeakPolarHBondContact O-CG 3.16Å; A35-L39 PolarHBondContact O-N 3.34Å
36	Q	92.5	Very high	93.2	Very high	103 Å²	103	91 Å²	91	48%	0.481	45%	0.452	S	S	.	.	H	α-helix	trans	-58.8	-45.9	174.7	-75.6	177.1	-9.8	0	0	111.7	I32 K33 H40	I32-Q36 HydrophobicContact CG2-CG 4.43Å; I32-Q36 WeakPolarHBondContact O-CB 3.06Å; I32-Q36 VanDerWaalsContact O-CG 3.29Å; I32-Q36 WeakPolarHBondContact O-CG 3.45Å; I32-Q36 PolarHBondContact O-N 2.88Å; K33-Q36 PolarHBondContact O-N 3.28Å; Q36-H40 VanDerWaalsContact O-CB 3.24Å; Q36-H40 WeakPolarHBondContact O-CB 3.41Å; Q36-H40 PolarHBondContact O-N 2.89Å
37	L	89.5	Confident	93	Very high	88 Å²	88	87.2 Å²	87.2	46%	0.461	44%	0.436	S	S	.	.	H	α-helix	trans	-64	-42	177.9	-74	169.5	0	0	0	111.9	K33 A34 A35 H40 R41	K33-L37 WeakPolarHBondContact O-CB 3.42Å; K33-L37 VanDerWaalsContact O-CG 3.25Å; K33-L37 WeakPolarHBondContact O-CG 3.42Å; K33-L37 PolarHBondContact O-N 3.15Å; A34-L37 PolarHBondContact O-N 3.01Å; A35-L37 PolarHBondContact O-N 3.08Å; L37-H40 PolarHBondContact O-N 2.96Å; L37-R41 WeakPolarHBondContact O-CB 3.12Å; L37-R41 PolarHBondContact O-N 2.98Å
38	Y	90.4	Very high	92.8	Very high	141 Å²	141	83.2 Å²	83.2	55%	0.553	42%	0.415	S	S	*	.	H	α-helix	trans	-62.9	-50.8	177.1	177.4	-98.6	0	0	0	111.7	A34 A35 H40 R41 Q42	A34-Y38 WeakPolarHBondContact O-CB 3.33Å; A34-Y38 PolarHBondContact O-N 3.27Å; A35-Y38 PolarHBondContact O-N 3.35Å; Y38-H40 VanDerWaalsContact C-N 3.31Å; Y38-H40 PolarHBondContact O-N 3.48Å; Y38-R41 PolarHBondContact O-N 3.45Å; Y38-Q42 HydrophobicContact CD1-CG 4.27Å; Y38-Q42 HydrophobicContact CE1-CG 3.85Å; Y38-Q42 HydrophobicContact CE2-CG 4.25Å; Y38-Q42 WeakPolarHBondContact O-CG 3.26Å; Y38-Q42 PolarHBondContact O-N 3.13Å; Y38-Q42 PolarHBondContact OH-NE2 3.07Å
39	L	92.6	Very high	92.5	Very high	116 Å²	116	85.1 Å²	85.1	61%	0.607	42%	0.421	S	S	*	.	H	α-helix	trans	-61.3	-40.9	178	-69.1	174.8	0	0	0	111.6	A35 Q42 W43	A35-L39 WeakPolarHBondContact O-CB 3.36Å; A35-L39 VanDerWaalsContact O-CG 3.31Å; A35-L39 WeakPolarHBondContact O-CG 3.16Å; A35-L39 PolarHBondContact O-N 3.34Å; L39-Q42 PolarHBondContact O-N 3.06Å; L39-W43 WeakPolarHBondContact O-CB 3.37Å; L39-W43 PolarHBondContact O-N 3.36Å
40	H	90.4	Very high	92.3	Very high	85 Å²	85	84.5 Å²	84.5	39%	0.394	42%	0.416	S	S	.	.	H	α-helix	trans	-62.9	-43.2	175.4	-174.6	63.8	0	0	0	112	Q36 L37 Y38 W43 L44	Q36-H40 VanDerWaalsContact O-CB 3.24Å; Q36-H40 WeakPolarHBondContact O-CB 3.41Å; Q36-H40 PolarHBondContact O-N 2.89Å; L37-H40 PolarHBondContact O-N 2.96Å; Y38-H40 VanDerWaalsContact C-N 3.31Å; Y38-H40 PolarHBondContact O-N 3.48Å; H40-W43 WeakPolarHBondContact O-CB 3.36Å; H40-W43 PolarHBondContact O-N 2.88Å; H40-L44 WeakPolarHBondContact O-CG 3.5Å; H40-L44 PolarHBondContact O-N 3.14Å
41	R	89.4	Confident	92.1	Very high	36 Å²	36	79.6 Å²	79.6	14%	0.136	39%	0.39	C	S	.	.	H	α-helix	trans	-62.2	-44.3	175.6	-175.8	-179.8	175.3	106.7	-3	111.8	L37 Y38 W43 L44 L45 W58 W89 G92	L37-R41 WeakPolarHBondContact O-CB 3.12Å; L37-R41 PolarHBondContact O-N 2.98Å; Y38-R41 PolarHBondContact O-N 3.45Å; R41-W43 VanDerWaalsContact C-N 3.31Å; R41-W43 PolarHBondContact O-N 3.06Å; R41-L44 PolarHBondContact O-N 3.06Å; R41-L45 HydrophobicContact CG-CD1 4.24Å; R41-L45 WeakPolarHBondContact O-CG 3.32Å; R41-L45 PolarHBondContact O-N 2.78Å; R41-W58 PolarHBondContact NH1-O 3.14Å; R41-W58 PolarHBondContact NH2-O 3.46Å; R41-W89 HydrophobicContact CG-CZ3 4.42Å; R41-G92 PolarHBondContact NH1-O 3.09Å
42	Q	90.8	Very high	91.9	Very high	82 Å²	82	76.8 Å²	76.8	38%	0.383	38%	0.378	S	S	.	.	H	α-helix	trans	-60.6	-41.7	176.3	-70.2	-61.9	-25	0	0	111.7	Y38 L39 L45 K46	Y38-Q42 HydrophobicContact CD1-CG 4.27Å; Y38-Q42 HydrophobicContact CE1-CG 3.85Å; Y38-Q42 HydrophobicContact CE2-CG 4.25Å; Y38-Q42 WeakPolarHBondContact O-CG 3.26Å; Y38-Q42 PolarHBondContact O-N 3.13Å; Y38-Q42 PolarHBondContact OH-NE2 3.07Å; L39-Q42 PolarHBondContact O-N 3.06Å; Q42-L45 PolarHBondContact O-N 3.1Å; Q42-K46 PolarHBondContact O-N 2.79Å; Q42-K46 VanDerWaalsContact O-N 3.09Å
43	W	93	Very high	91.4	Very high	124 Å²	124	75.2 Å²	75.2	47%	0.47	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-45.3	173.8	175.6	81.9	0	0	0	112.2	L39 H40 R41 L45 K46 A47 P308	L39-W43 WeakPolarHBondContact O-CB 3.37Å; L39-W43 PolarHBondContact O-N 3.36Å; H40-W43 WeakPolarHBondContact O-CB 3.36Å; H40-W43 PolarHBondContact O-N 2.88Å; R41-W43 VanDerWaalsContact C-N 3.31Å; R41-W43 PolarHBondContact O-N 3.06Å; W43-L45 PolarHBondContact O-N 3.34Å; W43-K46 PolarHBondContact O-N 3.22Å; W43-A47 WeakPolarHBondContact O-CB 3.5Å; W43-A47 PolarHBondContact O-N 3.32Å; W43-P308 HydrophobicContact CH2-CB 4.12Å; W43-P308 HydrophobicContact CH2-CG 3.78Å; W43-P308 HydrophobicContact CZ2-CB 4.04Å; W43-P308 HydrophobicContact CZ2-CG 3.97Å
44	L	92	Very high	90.8	Very high	4 Å²	4	70.3 Å²	70.3	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-42.4	177.4	-73.4	172.4	0	0	0	112.6	H40 R41 K46 A47 L48 W89 G93 V95 I311	H40-L44 WeakPolarHBondContact O-CG 3.5Å; H40-L44 PolarHBondContact O-N 3.14Å; R41-L44 PolarHBondContact O-N 3.06Å; L44-K46 VanDerWaalsContact C-N 3.33Å; L44-K46 PolarHBondContact O-N 2.88Å; L44-A47 PolarHBondContact O-N 2.93Å; L44-L48 WeakPolarHBondContact O-CB 3.18Å; L44-L48 WeakPolarHBondContact O-CG 3.26Å; L44-L48 PolarHBondContact O-N 3.45Å; L44-W89 HydrophobicContact CB-CH2 3.65Å; L44-W89 HydrophobicContact CB-CZ3 4.18Å; L44-W89 HydrophobicContact CD1-CH2 4.33Å; L44-W89 HydrophobicContact CD1-CZ3 4.01Å; L44-G93 WeakPolarHBondContact CD1-O 3.32Å; L44-V95 HydrophobicContact CD1-CG1 4.08Å; L44-V95 HydrophobicContact CD2-CG1 3.82Å; L44-V95 HydrophobicContact CG-CG1 4.42Å; L44-I311 HydrophobicContact CD2-CD1 3.65Å
45	L	90.3	Very high	90.4	Very high	68 Å²	68	73.9 Å²	73.9	36%	0.356	37%	0.373	S	S	.	.	H	α-helix	trans	-59.7	-44.7	176.4	-72.9	167.4	0	0	0	111.1	R41 Q42 W43 L48 Q49 W89	R41-L45 HydrophobicContact CG-CD1 4.24Å; R41-L45 WeakPolarHBondContact O-CG 3.32Å; R41-L45 PolarHBondContact O-N 2.78Å; Q42-L45 PolarHBondContact O-N 3.1Å; W43-L45 PolarHBondContact O-N 3.34Å; L45-L48 PolarHBondContact O-N 3.26Å; L45-Q49 PolarHBondContact O-N 3.27Å; L45-W89 HydrophobicContact CD2-CH2 4.03Å; L45-W89 HydrophobicContact CD2-CZ2 3.55Å; L45-W89 HydrophobicContact CG-CH2 4.12Å; L45-W89 HydrophobicContact CG-CZ2 4.13Å
46	K	92.2	Very high	90	Very high	151 Å²	151	73.3 Å²	73.3	66%	0.657	37%	0.366	S	S	*	.	H	α-helix	trans	-65.5	-40.5	176.1	-171.6	174.8	-177.9	176.6	0	112.4	Q42 W43 L44 L48 Q49	Q42-K46 PolarHBondContact O-N 2.79Å; Q42-K46 VanDerWaalsContact O-N 3.09Å; W43-K46 PolarHBondContact O-N 3.22Å; L44-K46 VanDerWaalsContact C-N 3.33Å; L44-K46 PolarHBondContact O-N 2.88Å; K46-L48 VanDerWaalsContact C-N 3.28Å; K46-L48 PolarHBondContact O-N 3.38Å; K46-Q49 WeakPolarHBondContact O-CG 3.42Å
47	A	91.4	Very high	89.6	Confident	21 Å²	21	72.6 Å²	72.6	17%	0.174	36%	0.362	C	S	.	.	H	α-helix	trans	-65.8	-31.3	178.6	0	0	0	0	0	112.8	W43 L44 P308	W43-A47 WeakPolarHBondContact O-CB 3.5Å; W43-A47 PolarHBondContact O-N 3.32Å; L44-A47 PolarHBondContact O-N 2.93Å; A47-P308 HydrophobicContact CB-CG 3.94Å
48	L	92.4	Very high	89.1	Confident	8 Å²	8	76.8 Å²	76.8	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-102.5	5.6	-176.2	-62.7	174.5	0	0	0	113.7	L44 L45 K46 Q50 F51 P87 V95 V97 L307	L44-L48 WeakPolarHBondContact O-CB 3.18Å; L44-L48 WeakPolarHBondContact O-CG 3.26Å; L44-L48 PolarHBondContact O-N 3.45Å; L45-L48 PolarHBondContact O-N 3.26Å; K46-L48 VanDerWaalsContact C-N 3.28Å; K46-L48 PolarHBondContact O-N 3.38Å; L48-Q50 PolarHBondContact O-N 2.91Å; L48-F51 HydrophobicContact CD2-CD2 4.25Å; L48-F51 PolarHBondContact O-N 3.31Å; L48-P87 HydrophobicContact CB-CG 4.34Å; L48-P87 HydrophobicContact CD1-CB 4.22Å; L48-V95 HydrophobicContact CD1-CB 4.1Å; L48-V95 HydrophobicContact CD1-CG1 3.62Å; L48-V95 HydrophobicContact CD1-CG2 3.45Å; L48-V95 VanDerWaalsContact CD1-CG2 3.45Å; L48-V97 HydrophobicContact CD1-CG2 4.48Å; L48-V97 HydrophobicContact CD2-CG2 3.73Å; L48-L307 HydrophobicContact CD2-CD2 3.35Å
49	Q	91.4	Very high	88.7	Confident	135 Å²	135	72.6 Å²	72.6	63%	0.631	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.2	-178.3	74	-174.3	3.8	0	0	113.9	L45 K46 F51	L45-Q49 PolarHBondContact O-N 3.27Å; K46-Q49 WeakPolarHBondContact O-CG 3.42Å; Q49-F51 PolarHBondContact O-N 2.81Å
50	Q	92.4	Very high	88.1	Confident	84 Å²	84	71.5 Å²	71.5	39%	0.393	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.5	179.7	-60.4	176.4	9.5	0	0	112.8	L48 R305	L48-Q50 PolarHBondContact O-N 2.91Å; Q50-R305 HydrophobicContact CB-CG 4.16Å; Q50-R305 WeakPolarHBondContact O-CD 3.21Å; Q50-R305 VanDerWaalsContact OE1-CA 3.23Å
51	F	93.3	Very high	87.9	Confident	7 Å²	7	67.9 Å²	67.9	3%	0.031	34%	0.335	C	S	.	.	S	Bend	trans	-111.2	125.1	-178.1	-61.6	-82.4	0	0	0	110.1	L48 Q49 A85 P87 Y104 F301 R305 S306 L307	L48-F51 HydrophobicContact CD2-CD2 4.25Å; L48-F51 PolarHBondContact O-N 3.31Å; Q49-F51 PolarHBondContact O-N 2.81Å; F51-A85 HydrophobicContact CD1-CB 3.78Å; F51-A85 HydrophobicContact CE1-CB 3.89Å; F51-P87 HydrophobicContact CB-CG 3.49Å; F51-P87 VanDerWaalsContact CB-CG 3.49Å; F51-P87 HydrophobicContact CG-CG 4.4Å; F51-Y104 AromaticContact CE1-CE1 3.92Å; F51-Y104 HydrophobicContact CE1-CE1 3.92Å; F51-F301 HydrophobicContact CZ-CD2 4.24Å; F51-F301 HydrophobicContact CZ-CE2 4.11Å; F51-R305 HydrophobicContact CE1-CB 4.05Å; F51-R305 HydrophobicContact CE2-CB 4.48Å; F51-R305 HydrophobicContact CZ-CB 3.78Å; F51-S306 WeakPolarHBondContact CE2-O 3.29Å; F51-L307 HydrophobicContact CD2-CD2 4.1Å; F51-L307 HydrophobicContact CE2-CD2 3.43Å; F51-L307 VanDerWaalsContact CE2-CD2 3.43Å; F51-L307 HydrophobicContact CE2-CG 3.93Å; F51-L307 HydrophobicContact CZ-CD2 3.99Å; F51-L307 HydrophobicContact CZ-CG 4.01Å
52	P	90.6	Very high	87.6	Confident	49 Å²	49	66.4 Å²	66.4	32%	0.318	33%	0.33	S	S	.	.			trans	-68.3	143.6	176.2	32.9	-35.3	0	0	0	109.3	F82 P87	P52-F82 HydrophobicContact CB-CD1 3.6Å; P52-F82 HydrophobicContact CB-CE1 4.07Å; P52-F82 HydrophobicContact CG-CB 4.2Å; P52-F82 HydrophobicContact CG-CD1 3.79Å; P52-F82 HydrophobicContact CG-CG 4.41Å; P52-P87 WeakPolarHBondContact O-CD 3.11Å
53	C	85.6	Confident	86.9	Confident	44 Å²	44	65.9 Å²	65.9	30%	0.297	33%	0.329	S	S	.	.			trans	-143.4	141.1	-170.4	-175	0	0	0	0	109.1	P87	C53-P87 HydrophobicContact CB-CB 4.38Å; C53-P87 HydrophobicContact CB-CG 4.23Å; C53-P87 PolarHBondContact SG-O 3.4Å
54	P	82.5	Confident	85.8	Confident	22 Å²	22	66.4 Å²	66.4	14%	0.143	34%	0.336	C	S	.	.			trans	-62.1	156.6	171.3	22.9	-29.1	0	0	0	111.4	S56 H62 F82 C86	P54-S56 PolarHBondContact O-N 3.36Å; P54-H62 PolarHBondContact O-NE2 2.9Å; P54-F82 HydrophobicContact CB-CE2 4.21Å; P54-F82 HydrophobicContact CB-CZ 4.2Å; P54-F82 HydrophobicContact CG-CE2 4.2Å; P54-C86 WeakPolarHBondContact CD-SG 3.01Å
55	P	82.8	Confident	84.7	Confident	132 Å²	132	68.6 Å²	68.6	86%	0.857	35%	0.347	S	S	*	.			trans	-62.8	119.4	176.7	26	-32.8	0	0	0	110
56	S	84.1	Confident	83.5	Confident	39 Å²	39	69.1 Å²	69.1	27%	0.273	35%	0.346	S	S	.	.			trans	-105.6	140.3	-177	75.4	0	0	0	0	111.7	P54 H62	P54-S56 PolarHBondContact O-N 3.36Å; S56-H62 WeakPolarHBondContact CA-NE2 3.44Å; S56-H62 WeakPolarHBondContact CB-NE2 3.31Å
57	H	84.8	Confident	82.1	Confident	89 Å²	89	68.9 Å²	68.9	41%	0.412	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-64	141.6	170.1	-175.2	-81.1	0	0	0	110.6	L59 F60 G61	H57-L59 VanDerWaalsContact C-N 3.34Å; H57-L59 PolarHBondContact ND1-N 3.17Å; H57-L59 PolarHBondContact O-N 3.19Å; H57-F60 AromaticContact CE1-CD2 3.78Å; H57-F60 AromaticContact ND1-CD2 3.74Å; H57-F60 PolarHBondContact ND1-N 2.99Å; H57-G61 PolarHBondContact N-O 3.37Å; H57-G61 VanDerWaalsContact N-O 3.12Å; H57-G61 VanDerWaalsContact O-CA 3.27Å; H57-G61 WeakPolarHBondContact O-CA 3.37Å; H57-G61 PolarHBondContact O-N 3.37Å
58	W	79.4	Confident	80.6	Confident	175 Å²	175	73.2 Å²	73.2	66%	0.663	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-38.2	-173	73.8	-88.7	0	0	0	113.3	R41	R41-W58 PolarHBondContact NH1-O 3.14Å; R41-W58 PolarHBondContact NH2-O 3.46Å
59	L	80.6	Confident	79.5	Confident	53 Å²	53	79.2 Å²	79.2	28%	0.277	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-57	178.6	-170.9	59.9	0	0	0	113.1	H57 G92	H57-L59 VanDerWaalsContact C-N 3.34Å; H57-L59 PolarHBondContact ND1-N 3.17Å; H57-L59 PolarHBondContact O-N 3.19Å; L59-G92 PolarHBondContact O-N 3.1Å
60	F	80.5	Confident	78.9	Confident	94 Å²	94	77.1 Å²	77.1	41%	0.412	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-4	-173.5	-57.5	-68.7	0	0	0	115.5	H57 H62 I63 I90	H57-F60 AromaticContact CE1-CD2 3.78Å; H57-F60 AromaticContact ND1-CD2 3.74Å; H57-F60 PolarHBondContact ND1-N 2.99Å; F60-H62 PolarHBondContact O-N 3.22Å; F60-H62 VanDerWaalsContact O-N 3.14Å; F60-I63 HydrophobicContact CB-CG2 3.95Å; F60-I63 WeakPolarHBondContact O-CB 3.48Å; F60-I63 WeakPolarHBondContact O-CG2 3.3Å; F60-I63 PolarHBondContact O-N 2.89Å; F60-I90 VanDerWaalsContact O-O 3.07Å
61	G	85.6	Confident	78.4	Confident	9 Å²	9	77.4 Å²	77.4	9%	0.093	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	56.1	-120.7	-179	0	0	0	0	0	111.7	H57	H57-G61 PolarHBondContact N-O 3.37Å; H57-G61 VanDerWaalsContact N-O 3.12Å; H57-G61 VanDerWaalsContact O-CA 3.27Å; H57-G61 WeakPolarHBondContact O-CA 3.37Å; H57-G61 PolarHBondContact O-N 3.37Å
62	H	84.3	Confident	78	Confident	5 Å²	5	80.4 Å²	80.4	2%	0.023	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	20.5	178.2	-51.9	118	0	0	0	112.3	P54 S56 F60 Q64 E65 W89	P54-H62 PolarHBondContact O-NE2 2.9Å; S56-H62 WeakPolarHBondContact CA-NE2 3.44Å; S56-H62 WeakPolarHBondContact CB-NE2 3.31Å; F60-H62 PolarHBondContact O-N 3.22Å; F60-H62 VanDerWaalsContact O-N 3.14Å; H62-Q64 PolarHBondContact O-N 3.17Å; H62-E65 HydrophobicContact CB-CG 4.3Å; H62-E65 IonicContact CD2-OE1 3.08Å; H62-E65 PolarHBondContact CD2-OE1 2.94Å; H62-E65 IonicContact CG-OE1 3.24Å; H62-E65 VanDerWaalsContact O-CB 3.27Å; H62-E65 WeakPolarHBondContact O-CB 3.49Å; H62-E65 PolarHBondContact O-N 2.97Å; H62-W89 AromaticContact CE1-CD1 3.79Å; H62-W89 PolarHBondContact N-O 2.92Å; H62-W89 PolarHBondContact ND1-N 3.33Å
63	I	75.9	Confident	77.9	Confident	70 Å²	70	83.4 Å²	83.4	36%	0.359	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-63.3	-29.8	-172.7	-154	167	0	0	0	113.1	F60 E65 F66 I90	F60-I63 HydrophobicContact CB-CG2 3.95Å; F60-I63 WeakPolarHBondContact O-CB 3.48Å; F60-I63 WeakPolarHBondContact O-CG2 3.3Å; F60-I63 PolarHBondContact O-N 2.89Å; I63-E65 PolarHBondContact O-N 2.97Å; I63-F66 PolarHBondContact O-N 3.3Å; I63-F66 VanDerWaalsContact O-N 3.12Å; I63-I90 HydrophobicContact CD1-CG2 4.15Å; I63-I90 HydrophobicContact CG1-CG2 4.45Å
64	Q	69.2	Low	77.9	Confident	135 Å²	135	83.9 Å²	83.9	63%	0.631	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-64.4	-21.1	175.9	-69.8	176.5	-16.5	0	0	112	H62 F66 Q67	H62-Q64 PolarHBondContact O-N 3.17Å; Q64-F66 PolarHBondContact O-N 3.25Å; Q64-Q67 PolarHBondContact O-N 3.07Å
65	E	69.8	Low	78.2	Confident	51 Å²	51	83.4 Å²	83.4	24%	0.238	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-74.5	-4.2	176	-61	177.4	-147.7	0	0	113.5	H62 I63 R74 R78	H62-E65 HydrophobicContact CB-CG 4.3Å; H62-E65 IonicContact CD2-OE1 3.08Å; H62-E65 PolarHBondContact CD2-OE1 2.94Å; H62-E65 IonicContact CG-OE1 3.24Å; H62-E65 VanDerWaalsContact O-CB 3.27Å; H62-E65 WeakPolarHBondContact O-CB 3.49Å; H62-E65 PolarHBondContact O-N 2.97Å; I63-E65 PolarHBondContact O-N 2.97Å; E65-R74 PolarHBondContact O-NH1 3.19Å; E65-R78 IonicContact OE2-CZ 3.08Å; E65-R78 IonicContact OE2-NE 2.65Å; E65-R78 IonicContact OE2-NH2 2.71Å; E65-R78 PolarHBondContact OE2-NH2 3.29Å
66	F	65.8	Low	78.5	Confident	79 Å²	79	78.7 Å²	78.7	35%	0.346	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-97.6	-6.7	177.1	-74.1	-86.3	0	0	0	114.1	I63 Q64 E71 Y88	I63-F66 PolarHBondContact O-N 3.3Å; I63-F66 VanDerWaalsContact O-N 3.12Å; Q64-F66 PolarHBondContact O-N 3.25Å; F66-E71 HydrophobicContact CE1-CG 4.46Å; F66-E71 WeakPolarHBondContact CE1-OE1 3.46Å; F66-Y88 HydrophobicContact CE2-CD2 4.5Å; F66-Y88 HydrophobicContact CE2-CE2 4.45Å; F66-Y88 HydrophobicContact CZ-CD2 4.36Å; F66-Y88 AromaticContact CZ-CE2 3.97Å; F66-Y88 HydrophobicContact CZ-CE2 3.97Å
67	Q	62.7	Low	78.8	Confident	146 Å²	146	82.4 Å²	82.4	68%	0.682	38%	0.384	S	S	*	.	S	Bend	trans	-90.9	-1.1	-168.8	-71.9	-174.9	-43.9	0	0	115.6	Q64	Q64-Q67 PolarHBondContact O-N 3.07Å
68	H	59.8	Low	79	Confident	112 Å²	112	79.3 Å²	79.3	52%	0.519	37%	0.369	S	S	.	.	S	Bend	trans	-123.6	22.5	-159.9	-76.2	80.6	0	0	0	114.9	Q70	H68-Q70 VanDerWaalsContact O-CG 3.32Å; H68-Q70 WeakPolarHBondContact O-CG 3.28Å; H68-Q70 PolarHBondContact O-N 3.38Å
69	D	69.4	Low	79.6	Confident	133 Å²	133	71.4 Å²	71.4	71%	0.711	34%	0.34	S	S	*	.	S	Bend	trans	53.9	4.4	179.4	-52.5	-43.2	0	0	0	116.4
70	Q	77.9	Confident	80	Confident	91 Å²	91	74.7 Å²	74.7	43%	0.425	35%	0.352	S	S	.	.			trans	-100.8	22.2	-179.9	-69.9	174.6	-1.9	0	0	112.3	H68 L72 Q73 R74	H68-Q70 VanDerWaalsContact O-CG 3.32Å; H68-Q70 WeakPolarHBondContact O-CG 3.28Å; H68-Q70 PolarHBondContact O-N 3.38Å; Q70-L72 VanDerWaalsContact C-N 3.32Å; Q70-L72 PolarHBondContact O-N 3.03Å; Q70-Q73 PolarHBondContact O-N 3.43Å; Q70-R74 WeakPolarHBondContact O-CG 3.34Å; Q70-R74 PolarHBondContact O-N 3.09Å
71	E	82.3	Confident	80.5	Confident	90 Å²	90	74.7 Å²	74.7	42%	0.421	36%	0.36	S	S	.	.	H	α-helix	trans	-58.2	-45	-176.2	-172.7	-179.8	174	0	0	111.2	F66 R74 I75	F66-E71 HydrophobicContact CE1-CG 4.46Å; F66-E71 WeakPolarHBondContact CE1-OE1 3.46Å; E71-R74 PolarHBondContact O-N 3.33Å; E71-I75 HydrophobicContact CG-CD1 4.33Å; E71-I75 WeakPolarHBondContact O-CG1 3.48Å; E71-I75 PolarHBondContact O-N 3.34Å
72	L	85.6	Confident	80.8	Confident	70 Å²	70	75.9 Å²	75.9	37%	0.366	36%	0.363	S	S	.	.	H	α-helix	trans	-65	-42.7	-179.3	-62.7	-175.3	0	0	0	112.3	Q70 R74 I75 Q76 P289 Y318	Q70-L72 VanDerWaalsContact C-N 3.32Å; Q70-L72 PolarHBondContact O-N 3.03Å; L72-R74 VanDerWaalsContact C-N 3.34Å; L72-R74 PolarHBondContact O-N 3.14Å; L72-I75 HydrophobicContact CD2-CD1 4.33Å; L72-I75 WeakPolarHBondContact O-CB 3.26Å; L72-I75 PolarHBondContact O-N 2.89Å; L72-I75 VanDerWaalsContact O-N 3.14Å; L72-Q76 PolarHBondContact O-N 2.92Å; L72-Q76 VanDerWaalsContact O-N 3.07Å; L72-P289 HydrophobicContact CD2-CB 4.31Å; L72-Y318 HydrophobicContact CB-CD1 4.37Å; L72-Y318 HydrophobicContact CB-CE1 3.77Å; L72-Y318 HydrophobicContact CD1-CE2 4.16Å; L72-Y318 HydrophobicContact CD2-CD1 3.93Å; L72-Y318 HydrophobicContact CD2-CD2 4.16Å; L72-Y318 HydrophobicContact CD2-CE1 4.16Å; L72-Y318 HydrophobicContact CD2-CE2 4.39Å; L72-Y318 HydrophobicContact CD2-CG 3.93Å; L72-Y318 HydrophobicContact CG-CE1 4.44Å; L72-Y318 WeakPolarHBondContact O-CE1 3.45Å
73	Q	86.7	Confident	81	Confident	113 Å²	113	78.5 Å²	78.5	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-44.4	176.8	-67.2	178.3	-9.5	0	0	111	Q70 I75 Q76 E77	Q70-Q73 PolarHBondContact O-N 3.43Å; Q73-I75 VanDerWaalsContact C-N 3.3Å; Q73-I75 PolarHBondContact O-N 3.31Å; Q73-Q76 WeakPolarHBondContact O-CB 3.38Å; Q73-Q76 PolarHBondContact O-N 3.43Å; Q73-E77 PolarHBondContact O-N 2.91Å
74	R	86.7	Confident	81.8	Confident	54 Å²	54	75.7 Å²	75.7	20%	0.204	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-35.7	175.2	-71.9	-176.3	174.7	134.3	5.6	112.7	E65 Q70 E71 L72 Q76 E77 R78	E65-R74 PolarHBondContact O-NH1 3.19Å; Q70-R74 WeakPolarHBondContact O-CG 3.34Å; Q70-R74 PolarHBondContact O-N 3.09Å; E71-R74 PolarHBondContact O-N 3.33Å; L72-R74 VanDerWaalsContact C-N 3.34Å; L72-R74 PolarHBondContact O-N 3.14Å; R74-Q76 VanDerWaalsContact C-N 3.33Å; R74-E77 PolarHBondContact O-N 3Å; R74-R78 VanDerWaalsContact O-CG 3.32Å; R74-R78 WeakPolarHBondContact O-CG 3.41Å; R74-R78 PolarHBondContact O-N 3.43Å
75	I	88.9	Confident	83	Confident	11 Å²	11	69.3 Å²	69.3	6%	0.056	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-44.9	172.8	-68	169.2	0	0	0	110	E71 L72 Q73 E77 R78 V79 Y318	E71-I75 HydrophobicContact CG-CD1 4.33Å; E71-I75 WeakPolarHBondContact O-CG1 3.48Å; E71-I75 PolarHBondContact O-N 3.34Å; L72-I75 HydrophobicContact CD2-CD1 4.33Å; L72-I75 WeakPolarHBondContact O-CB 3.26Å; L72-I75 PolarHBondContact O-N 2.89Å; L72-I75 VanDerWaalsContact O-N 3.14Å; Q73-I75 VanDerWaalsContact C-N 3.3Å; Q73-I75 PolarHBondContact O-N 3.31Å; I75-E77 PolarHBondContact O-N 3.3Å; I75-R78 PolarHBondContact O-N 3.31Å; I75-V79 HydrophobicContact CG2-CG2 4.2Å; I75-V79 WeakPolarHBondContact O-CB 3.4Å; I75-V79 WeakPolarHBondContact O-CG2 3.44Å; I75-V79 PolarHBondContact O-N 3.47Å; I75-Y318 HydrophobicContact CB-CD1 4.25Å; I75-Y318 HydrophobicContact CG2-CD1 3.97Å
76	Q	89.5	Confident	84.1	Confident	33 Å²	33	66.9 Å²	66.9	15%	0.154	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-43.1	177.5	-60.4	-172.4	-16.8	0	0	112.2	L72 Q73 R74 R78 V79 K80 Y318 H322	L72-Q76 PolarHBondContact O-N 2.92Å; L72-Q76 VanDerWaalsContact O-N 3.07Å; Q73-Q76 WeakPolarHBondContact O-CB 3.38Å; Q73-Q76 PolarHBondContact O-N 3.43Å; R74-Q76 VanDerWaalsContact C-N 3.33Å; Q76-R78 VanDerWaalsContact C-N 3.35Å; Q76-R78 PolarHBondContact O-N 2.9Å; Q76-V79 PolarHBondContact O-N 2.74Å; Q76-K80 WeakPolarHBondContact O-CG 3.31Å; Q76-K80 PolarHBondContact O-N 3.27Å; Q76-Y318 HydrophobicContact CG-CE1 3.72Å; Q76-Y318 PolarHBondContact NE2-OH 3.27Å; Q76-H322 HydrophobicContact CG-CB 4.38Å; Q76-H322 PolarHBondContact NE2-CD2 3.47Å; Q76-H322 VanDerWaalsContact NE2-CD2 3.35Å
77	E	89.2	Confident	85.4	Confident	118 Å²	118	63.2 Å²	63.2	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-60.3	-43.8	176.6	-70	177	170.8	0	0	112.1	Q73 R74 I75 K80 T81	Q73-E77 PolarHBondContact O-N 2.91Å; R74-E77 PolarHBondContact O-N 3Å; I75-E77 PolarHBondContact O-N 3.3Å; E77-K80 PolarHBondContact O-N 3.35Å; E77-T81 WeakPolarHBondContact O-CB 3.44Å; E77-T81 PolarHBondContact O-N 3.27Å; E77-T81 PolarHBondContact O-OG1 3.06Å
78	R	88.9	Confident	86.6	Confident	23 Å²	23	56.4 Å²	56.4	9%	0.087	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-41.5	176.5	-73.1	176.1	-178.8	-170.4	3	112.1	E65 R74 I75 Q76 K80 T81 F82 Y100	E65-R78 IonicContact OE2-CZ 3.08Å; E65-R78 IonicContact OE2-NE 2.65Å; E65-R78 IonicContact OE2-NH2 2.71Å; E65-R78 PolarHBondContact OE2-NH2 3.29Å; R74-R78 VanDerWaalsContact O-CG 3.32Å; R74-R78 WeakPolarHBondContact O-CG 3.41Å; R74-R78 PolarHBondContact O-N 3.43Å; I75-R78 PolarHBondContact O-N 3.31Å; Q76-R78 VanDerWaalsContact C-N 3.35Å; Q76-R78 PolarHBondContact O-N 2.9Å; R78-K80 VanDerWaalsContact C-N 3.28Å; R78-K80 PolarHBondContact O-N 2.79Å; R78-T81 PolarHBondContact O-N 2.87Å; R78-F82 HydrophobicContact CB-CD2 4.32Å; R78-F82 HydrophobicContact CG-CD2 4.37Å; R78-F82 WeakPolarHBondContact O-CB 3.24Å; R78-F82 PolarHBondContact O-N 3.25Å; R78-Y100 PolarHBondContact O-OH 2.64Å
79	V	91.8	Very high	87.9	Confident	9 Å²	9	51.5 Å²	51.5	6%	0.055	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-38.8	177.3	171.2	0	0	0	0	111.1	I75 Q76 Y100 N323	I75-V79 HydrophobicContact CG2-CG2 4.2Å; I75-V79 WeakPolarHBondContact O-CB 3.4Å; I75-V79 WeakPolarHBondContact O-CG2 3.44Å; I75-V79 PolarHBondContact O-N 3.47Å; Q76-V79 PolarHBondContact O-N 2.74Å; V79-Y100 HydrophobicContact CB-CD2 4.2Å; V79-Y100 HydrophobicContact CB-CE2 4.27Å; V79-Y100 HydrophobicContact CG1-CD2 4.06Å; V79-Y100 HydrophobicContact CG1-CE2 4.37Å; V79-Y100 HydrophobicContact CG2-CD1 3.89Å; V79-Y100 HydrophobicContact CG2-CD2 3.74Å; V79-Y100 HydrophobicContact CG2-CE1 4.25Å; V79-Y100 HydrophobicContact CG2-CE2 4.09Å; V79-Y100 HydrophobicContact CG2-CG 3.62Å; V79-N323 HydrophobicContact CG1-CB 4.03Å
80	K	90.1	Very high	88.5	Confident	122 Å²	122	46.8 Å²	46.8	53%	0.53	23%	0.229	S	C	.	.	H	α-helix	trans	-69.5	-40.8	175.3	-70	171.7	-176.3	174.9	0	112.2	Q76 E77 R78 P324	Q76-K80 WeakPolarHBondContact O-CG 3.31Å; Q76-K80 PolarHBondContact O-N 3.27Å; E77-K80 PolarHBondContact O-N 3.35Å; R78-K80 VanDerWaalsContact C-N 3.28Å; R78-K80 PolarHBondContact O-N 2.79Å; K80-P324 HydrophobicContact CG-CG 4.49Å
81	T	91	Very high	88.4	Confident	95 Å²	95	48.4 Å²	48.4	58%	0.583	23%	0.232	S	C	*	.	H	α-helix	trans	-84.8	-41.7	-170.9	-53.2	0	0	0	0	113.2	E77 R78	E77-T81 WeakPolarHBondContact O-CB 3.44Å; E77-T81 PolarHBondContact O-N 3.27Å; E77-T81 PolarHBondContact O-OG1 3.06Å; R78-T81 PolarHBondContact O-N 2.87Å
82	F	91.8	Very high	87.8	Confident	34 Å²	34	44.9 Å²	44.9	15%	0.149	22%	0.219	C	C	.	.	S	Bend	trans	-111.6	120	-171.2	-60.7	-62	0	0	0	110.5	P52 P54 R78 S84 C86 Y100	P52-F82 HydrophobicContact CB-CD1 3.6Å; P52-F82 HydrophobicContact CB-CE1 4.07Å; P52-F82 HydrophobicContact CG-CB 4.2Å; P52-F82 HydrophobicContact CG-CD1 3.79Å; P52-F82 HydrophobicContact CG-CG 4.41Å; P54-F82 HydrophobicContact CB-CE2 4.21Å; P54-F82 HydrophobicContact CB-CZ 4.2Å; P54-F82 HydrophobicContact CG-CE2 4.2Å; R78-F82 HydrophobicContact CB-CD2 4.32Å; R78-F82 HydrophobicContact CG-CD2 4.37Å; R78-F82 WeakPolarHBondContact O-CB 3.24Å; R78-F82 PolarHBondContact O-N 3.25Å; F82-S84 PolarHBondContact O-N 3.47Å; F82-C86 HydrophobicContact CB-CB 4.21Å; F82-C86 HydrophobicContact CD2-CB 4.34Å; F82-C86 HydrophobicContact CG-CB 4.5Å; F82-Y100 WeakPolarHBondContact CB-OH 3.47Å; F82-Y100 VanDerWaalsContact O-CE2 3.29Å; F82-Y100 WeakPolarHBondContact O-CE2 3.42Å; F82-Y100 PolarHBondContact O-OH 3.16Å
83	P	89	Confident	87.3	Confident	60 Å²	60	42.1 Å²	42.1	39%	0.39	21%	0.207	S	C	.	.	S	Bend	trans	-70.4	123.8	-178.4	26.4	-34	0	0	0	112.2	A85 R305	P83-A85 PolarHBondContact O-N 2.95Å; P83-R305 PolarHBondContact O-NH1 2.92Å; P83-R305 PolarHBondContact O-NH2 3.19Å
84	S	91.6	Very high	87.1	Confident	11 Å²	11	43.7 Å²	43.7	8%	0.077	21%	0.212	C	C	.	.	S	Bend	trans	71.4	-41.5	166.6	-48.6	0	0	0	0	117.7	F82 Y100 D101	F82-S84 PolarHBondContact O-N 3.47Å; S84-Y100 PolarHBondContact O-N 2.91Å; S84-D101 WeakPolarHBondContact CB-OD2 3.45Å; S84-D101 PolarHBondContact OG-OD2 3.27Å
85	A	94	Very high	87.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143.3	-178.1	0	0	0	0	0	111.5	F51 P83 V97 Q98 L99 Y104	F51-A85 HydrophobicContact CD1-CB 3.78Å; F51-A85 HydrophobicContact CE1-CB 3.89Å; P83-A85 PolarHBondContact O-N 2.95Å; A85-V97 HydrophobicContact CB-CG1 4.3Å; A85-Q98 CarbonylContact C-O 3.58Å; A85-Q98 VanDerWaalsContact CA-O 3.23Å; A85-Q98 WeakPolarHBondContact CA-O 3.16Å; A85-L99 HydrophobicContact CB-CD2 3.44Å; A85-L99 VanDerWaalsContact CB-CD2 3.44Å; A85-Y104 HydrophobicContact CB-CD1 4.25Å; A85-Y104 HydrophobicContact CB-CE1 4.03Å
86	C	93.9	Very high	87.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	121.8	179.6	-175.3	0	0	0	0	110.1	P54 F82 Q98 Y100	P54-C86 WeakPolarHBondContact CD-SG 3.01Å; F82-C86 HydrophobicContact CB-CB 4.21Å; F82-C86 HydrophobicContact CD2-CB 4.34Å; F82-C86 HydrophobicContact CG-CB 4.5Å; C86-Q98 PolarHBondContact N-O 3.38Å; C86-Q98 PolarHBondContact O-N 3.41Å; C86-Y100 HydrophobicContact CB-CE1 4.23Å
87	P	92.5	Very high	87.6	Confident	2 Å²	2	43 Å²	43	1%	0.013	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	147	167.5	-16	32.3	0	0	0	109.9	L48 F51 P52 C53 V95 R96	L48-P87 HydrophobicContact CB-CG 4.34Å; L48-P87 HydrophobicContact CD1-CB 4.22Å; F51-P87 HydrophobicContact CB-CG 3.49Å; F51-P87 VanDerWaalsContact CB-CG 3.49Å; F51-P87 HydrophobicContact CG-CG 4.4Å; P52-P87 WeakPolarHBondContact O-CD 3.11Å; C53-P87 HydrophobicContact CB-CB 4.38Å; C53-P87 HydrophobicContact CB-CG 4.23Å; C53-P87 PolarHBondContact SG-O 3.4Å; P87-V95 HydrophobicContact CB-CG2 4.18Å; P87-R96 CarbonylContact C-O 3.58Å; P87-R96 WeakPolarHBondContact CA-O 3.49Å
88	Y	87.6	Confident	87.8	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	128.9	171	72.4	-84.7	0	0	0	110.5	F66 I90 R96 Q98 L314	F66-Y88 HydrophobicContact CE2-CD2 4.5Å; F66-Y88 HydrophobicContact CE2-CE2 4.45Å; F66-Y88 HydrophobicContact CZ-CD2 4.36Å; F66-Y88 AromaticContact CZ-CE2 3.97Å; F66-Y88 HydrophobicContact CZ-CE2 3.97Å; Y88-I90 HydrophobicContact CD2-CG1 4.11Å; Y88-I90 HydrophobicContact CE2-CD1 3.95Å; Y88-I90 HydrophobicContact CE2-CG1 3.96Å; Y88-R96 HydrophobicContact CD1-CB 3.85Å; Y88-R96 WeakPolarHBondContact CD1-O 3.44Å; Y88-R96 HydrophobicContact CD2-CB 4.37Å; Y88-R96 HydrophobicContact CE1-CB 3.23Å; Y88-R96 HydrophobicContact CE1-CG 4.38Å; Y88-R96 HydrophobicContact CE2-CB 3.86Å; Y88-R96 HydrophobicContact CE2-CG 4.36Å; Y88-R96 HydrophobicContact CG-CB 4.39Å; Y88-R96 VanDerWaalsContact CZ-CD 3.43Å; Y88-R96 PolarHBondContact N-O 3.14Å; Y88-R96 PolarHBondContact O-N 3.21Å; Y88-R96 WeakPolarHBondContact OH-CD 3.43Å; Y88-R96 PolarHBondContact OH-NH1 3.39Å; Y88-Q98 HydrophobicContact CD1-CB 4.03Å; Y88-Q98 HydrophobicContact CE1-CB 4.04Å; Y88-L314 HydrophobicContact CE1-CB 4.29Å; Y88-L314 HydrophobicContact CE1-CD2 4.25Å; Y88-L314 VanDerWaalsContact OH-CD2 3.31Å; Y88-L314 WeakPolarHBondContact OH-CD2 3.3Å
89	W	87.7	Confident	88.2	Confident	8 Å²	8	36.5 Å²	36.5	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.4	-178.8	-60.4	91.1	0	0	0	110.4	R41 L44 L45 H62 V95	R41-W89 HydrophobicContact CG-CZ3 4.42Å; L44-W89 HydrophobicContact CB-CH2 3.65Å; L44-W89 HydrophobicContact CB-CZ3 4.18Å; L44-W89 HydrophobicContact CD1-CH2 4.33Å; L44-W89 HydrophobicContact CD1-CZ3 4.01Å; L45-W89 HydrophobicContact CD2-CH2 4.03Å; L45-W89 HydrophobicContact CD2-CZ2 3.55Å; L45-W89 HydrophobicContact CG-CH2 4.12Å; L45-W89 HydrophobicContact CG-CZ2 4.13Å; H62-W89 AromaticContact CE1-CD1 3.79Å; H62-W89 PolarHBondContact N-O 2.92Å; H62-W89 PolarHBondContact ND1-N 3.33Å; W89-V95 HydrophobicContact CD2-CB 4.13Å; W89-V95 HydrophobicContact CD2-CG2 4.02Å; W89-V95 HydrophobicContact CE3-CB 3.84Å; W89-V95 HydrophobicContact CE3-CG2 4.25Å; W89-V95 HydrophobicContact CG-CG2 4.49Å; W89-V95 HydrophobicContact CH2-CB 4.28Å; W89-V95 HydrophobicContact CZ2-CG2 4.27Å; W89-V95 HydrophobicContact CZ3-CB 3.94Å
90	I	81.3	Confident	88.3	Confident	34 Å²	34	36.1 Å²	36.1	17%	0.174	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-45.5	177.4	-62.4	173.9	0	0	0	110.5	F60 I63 Y88 K94 R96	F60-I90 VanDerWaalsContact O-O 3.07Å; I63-I90 HydrophobicContact CD1-CG2 4.15Å; I63-I90 HydrophobicContact CG1-CG2 4.45Å; Y88-I90 HydrophobicContact CD2-CG1 4.11Å; Y88-I90 HydrophobicContact CE2-CD1 3.95Å; Y88-I90 HydrophobicContact CE2-CG1 3.96Å; I90-K94 PolarHBondContact N-O 3.45Å; I90-R96 HydrophobicContact CD1-CG 4.11Å; I90-R96 VanDerWaalsContact CD1-CZ 3.48Å; I90-R96 VanDerWaalsContact CD1-NE 3.28Å
91	W	76.1	Confident	88.6	Confident	126 Å²	126	31.1 Å²	31.1	48%	0.477	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	122.7	-176.6	-174.8	82.5	0	0	0	110.8	G93 K94	W91-G93 VanDerWaalsContact C-N 3.33Å; W91-G93 PolarHBondContact O-N 3.02Å; W91-K94 PolarHBondContact O-N 3.16Å
92	G	70.9	Confident	88.8	Confident	16 Å²	16	27 Å²	27	17%	0.165	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	-81.2	169.4	0	0	0	0	0	115.4	R41 L59	R41-G92 PolarHBondContact NH1-O 3.09Å; L59-G92 PolarHBondContact O-N 3.1Å
93	G	74.3	Confident	89	Confident	11 Å²	11	28.9 Å²	28.9	11%	0.113	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	8.3	178.4	0	0	0	0	0	115.1	L44 W91	L44-G93 WeakPolarHBondContact CD1-O 3.32Å; W91-G93 VanDerWaalsContact C-N 3.33Å; W91-G93 PolarHBondContact O-N 3.02Å
94	K	83.4	Confident	89.3	Confident	146 Å²	146	26.2 Å²	26.2	64%	0.635	13%	0.125	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.3	178.5	-70.9	-173.3	-179.7	175.9	0	110.6	I90 W91	I90-K94 PolarHBondContact N-O 3.45Å; W91-K94 PolarHBondContact O-N 3.16Å
95	V	89.4	Confident	89.5	Confident	13 Å²	13	25.8 Å²	25.8	8%	0.079	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146	175.6	67.1	0	0	0	0	110	L44 L48 P87 W89 I311	L44-V95 HydrophobicContact CD1-CG1 4.08Å; L44-V95 HydrophobicContact CD2-CG1 3.82Å; L44-V95 HydrophobicContact CG-CG1 4.42Å; L48-V95 HydrophobicContact CD1-CB 4.1Å; L48-V95 HydrophobicContact CD1-CG1 3.62Å; L48-V95 HydrophobicContact CD1-CG2 3.45Å; L48-V95 VanDerWaalsContact CD1-CG2 3.45Å; P87-V95 HydrophobicContact CB-CG2 4.18Å; W89-V95 HydrophobicContact CD2-CB 4.13Å; W89-V95 HydrophobicContact CD2-CG2 4.02Å; W89-V95 HydrophobicContact CE3-CB 3.84Å; W89-V95 HydrophobicContact CE3-CG2 4.25Å; W89-V95 HydrophobicContact CG-CG2 4.49Å; W89-V95 HydrophobicContact CH2-CB 4.28Å; W89-V95 HydrophobicContact CZ2-CG2 4.27Å; W89-V95 HydrophobicContact CZ3-CB 3.94Å; V95-I311 HydrophobicContact CG1-CD1 4.19Å
96	R	90.4	Very high	89.5	Confident	72 Å²	72	30.7 Å²	30.7	27%	0.272	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	148.3	168.6	-68.4	-179.2	-173.3	175	8.2	107.9	P87 Y88 I90 M312	P87-R96 CarbonylContact C-O 3.58Å; P87-R96 WeakPolarHBondContact CA-O 3.49Å; Y88-R96 HydrophobicContact CD1-CB 3.85Å; Y88-R96 WeakPolarHBondContact CD1-O 3.44Å; Y88-R96 HydrophobicContact CD2-CB 4.37Å; Y88-R96 HydrophobicContact CE1-CB 3.23Å; Y88-R96 HydrophobicContact CE1-CG 4.38Å; Y88-R96 HydrophobicContact CE2-CB 3.86Å; Y88-R96 HydrophobicContact CE2-CG 4.36Å; Y88-R96 HydrophobicContact CG-CB 4.39Å; Y88-R96 VanDerWaalsContact CZ-CD 3.43Å; Y88-R96 PolarHBondContact N-O 3.14Å; Y88-R96 PolarHBondContact O-N 3.21Å; Y88-R96 WeakPolarHBondContact OH-CD 3.43Å; Y88-R96 PolarHBondContact OH-NH1 3.39Å; I90-R96 HydrophobicContact CD1-CG 4.11Å; I90-R96 VanDerWaalsContact CD1-CZ 3.48Å; I90-R96 VanDerWaalsContact CD1-NE 3.28Å; R96-M312 CarbonylContact C-O 3.55Å; R96-M312 VanDerWaalsContact CA-O 3.25Å; R96-M312 WeakPolarHBondContact CA-O 3.05Å; R96-M312 HydrophobicContact CG-CB 4.02Å
97	V	94.1	Very high	89.6	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	113.1	177.8	-174.8	0	0	0	0	108.3	L48 A85 L99 L307 I311 M312 V313 L314	L48-V97 HydrophobicContact CD1-CG2 4.48Å; L48-V97 HydrophobicContact CD2-CG2 3.73Å; A85-V97 HydrophobicContact CB-CG1 4.3Å; V97-L99 HydrophobicContact CG1-CD2 3.77Å; V97-L307 HydrophobicContact CB-CD1 4.3Å; V97-L307 HydrophobicContact CG1-CD1 4.2Å; V97-L307 HydrophobicContact CG2-CD1 4.38Å; V97-L307 HydrophobicContact CG2-CD2 4Å; V97-I311 HydrophobicContact CB-CG2 4.43Å; V97-I311 HydrophobicContact CG2-CG2 3.66Å; V97-M312 PolarHBondContact N-O 3.3Å; V97-V313 HydrophobicContact CB-CG1 4.43Å; V97-V313 CarbonylContact O-C 3.59Å; V97-V313 VanDerWaalsContact O-CA 3.32Å; V97-V313 WeakPolarHBondContact O-CA 3.35Å; V97-L314 PolarHBondContact O-N 2.9Å
98	Q	94.4	Very high	89.8	Confident	4 Å²	4	32.6 Å²	32.6	2%	0.019	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.2	178	-165.1	170.6	38	0	0	109.1	A85 C86 Y88 Y100 L314	A85-Q98 CarbonylContact C-O 3.58Å; A85-Q98 VanDerWaalsContact CA-O 3.23Å; A85-Q98 WeakPolarHBondContact CA-O 3.16Å; C86-Q98 PolarHBondContact N-O 3.38Å; C86-Q98 PolarHBondContact O-N 3.41Å; Y88-Q98 HydrophobicContact CD1-CB 4.03Å; Y88-Q98 HydrophobicContact CE1-CB 4.04Å; Q98-Y100 HydrophobicContact CG-CD1 4.23Å; Q98-L314 CarbonylContact C-O 3.56Å; Q98-L314 WeakPolarHBondContact CA-O 3.42Å; Q98-L314 HydrophobicContact CG-CD2 4.33Å
99	L	95.9	Very high	90.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	137.7	178.8	-51.1	-174.3	0	0	0	108.6	A85 V97 Y104 M105 I108 F301 V313 L314 L315 S316	A85-L99 HydrophobicContact CB-CD2 3.44Å; A85-L99 VanDerWaalsContact CB-CD2 3.44Å; V97-L99 HydrophobicContact CG1-CD2 3.77Å; L99-Y104 HydrophobicContact CD1-CD1 4.43Å; L99-Y104 HydrophobicContact CD2-CD1 3.83Å; L99-Y104 HydrophobicContact CD2-CE1 4.48Å; L99-M105 WeakPolarHBondContact O-CE 3.31Å; L99-I108 HydrophobicContact CD1-CD1 4.48Å; L99-I108 HydrophobicContact CD1-CG1 3.6Å; L99-F301 HydrophobicContact CD1-CE1 4.41Å; L99-F301 HydrophobicContact CD1-CZ 4.21Å; L99-V313 HydrophobicContact CD1-CB 4.09Å; L99-V313 HydrophobicContact CD1-CG1 4.28Å; L99-V313 HydrophobicContact CG-CB 4.43Å; L99-L314 PolarHBondContact N-O 3.26Å; L99-L315 HydrophobicContact CB-CD2 4.17Å; L99-L315 HydrophobicContact CD1-CD2 3.87Å; L99-L315 HydrophobicContact CG-CD2 4.43Å; L99-S316 WeakPolarHBondContact O-CB 3.21Å; L99-S316 PolarHBondContact O-N 3.41Å
100	Y	95.1	Very high	90.3	Very high	1 Å²	1	35.4 Å²	35.4	0%	0.004	19%	0.186	C	C	.	.			trans	-148.3	17.4	179.7	41.4	-98.7	0	0	0	111.9	R78 V79 F82 S84 C86 Q98 L320 N323	R78-Y100 PolarHBondContact O-OH 2.64Å; V79-Y100 HydrophobicContact CB-CD2 4.2Å; V79-Y100 HydrophobicContact CB-CE2 4.27Å; V79-Y100 HydrophobicContact CG1-CD2 4.06Å; V79-Y100 HydrophobicContact CG1-CE2 4.37Å; V79-Y100 HydrophobicContact CG2-CD1 3.89Å; V79-Y100 HydrophobicContact CG2-CD2 3.74Å; V79-Y100 HydrophobicContact CG2-CE1 4.25Å; V79-Y100 HydrophobicContact CG2-CE2 4.09Å; V79-Y100 HydrophobicContact CG2-CG 3.62Å; F82-Y100 WeakPolarHBondContact CB-OH 3.47Å; F82-Y100 VanDerWaalsContact O-CE2 3.29Å; F82-Y100 WeakPolarHBondContact O-CE2 3.42Å; F82-Y100 PolarHBondContact O-OH 3.16Å; S84-Y100 PolarHBondContact O-N 2.91Å; C86-Y100 HydrophobicContact CB-CE1 4.23Å; Q98-Y100 HydrophobicContact CG-CD1 4.23Å; Y100-L320 WeakPolarHBondContact O-CD1 3.24Å; Y100-N323 PolarHBondContact O-ND2 3.47Å
101	D	95.5	Very high	90.8	Very high	17 Å²	17	36.3 Å²	36.3	9%	0.091	19%	0.187	C	C	.	.			trans	-102.4	131.5	177.2	-166.8	-75.4	0	0	0	110.8	S84 D103 Y104 M105	S84-D101 WeakPolarHBondContact CB-OD2 3.45Å; S84-D101 PolarHBondContact OG-OD2 3.27Å; D101-D103 PolarHBondContact O-N 2.71Å; D101-D103 WeakPolarHBondContact OD1-CB 3.21Å; D101-D103 PolarHBondContact OD1-N 3.49Å; D101-Y104 HydrophobicContact CB-CD2 3.9Å; D101-Y104 HydrophobicContact CB-CG 4.16Å; D101-Y104 PolarHBondContact O-N 2.83Å; D101-Y104 VanDerWaalsContact O-N 3.15Å; D101-M105 WeakPolarHBondContact O-CG 3.33Å; D101-M105 PolarHBondContact O-N 3.15Å
102	P	95.4	Very high	91.4	Very high	9 Å²	9	34.8 Å²	34.8	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-56.9	-34.6	-177.6	-22	30.1	0	0	0	114.3	K106 L320 V326 H345	P102-K106 WeakPolarHBondContact O-CB 3.39Å; P102-K106 PolarHBondContact O-N 3.35Å; P102-L320 HydrophobicContact CB-CD1 4.3Å; P102-L320 HydrophobicContact CG-CD1 3.78Å; P102-V326 HydrophobicContact CG-CG1 4.49Å; P102-V326 HydrophobicContact CG-CG2 3.53Å; P102-H345 HydrophobicContact CB-CB 4.35Å; P102-H345 WeakPolarHBondContact CB-ND1 3.35Å
103	D	95.6	Very high	92.3	Very high	72 Å²	72	34 Å²	34	39%	0.385	19%	0.188	S	C	.	.	H	α-helix	trans	-71.3	-40.8	179.6	-76.8	-40.8	0	0	0	111.2	D101 K106 V107 P302 H345	D101-D103 PolarHBondContact O-N 2.71Å; D101-D103 WeakPolarHBondContact OD1-CB 3.21Å; D101-D103 PolarHBondContact OD1-N 3.49Å; D103-K106 PolarHBondContact O-N 3.03Å; D103-V107 WeakPolarHBondContact O-CG2 3.29Å; D103-V107 PolarHBondContact O-N 3.34Å; D103-V107 VanDerWaalsContact O-N 3.16Å; D103-P302 HydrophobicContact CB-CG 4.14Å; D103-H345 IonicContact OD1-CE1 3.19Å; D103-H345 IonicContact OD1-NE2 3.37Å; D103-H345 PolarHBondContact OD1-NE2 3.03Å
104	Y	96	Very high	93.1	Very high	4 Å²	4	35 Å²	35	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-44	174.8	-80.7	-119.7	0	0	0	111.6	F51 A85 L99 D101 K106 V107 I108 F301 D303 R305	F51-Y104 AromaticContact CE1-CE1 3.92Å; F51-Y104 HydrophobicContact CE1-CE1 3.92Å; A85-Y104 HydrophobicContact CB-CD1 4.25Å; A85-Y104 HydrophobicContact CB-CE1 4.03Å; L99-Y104 HydrophobicContact CD1-CD1 4.43Å; L99-Y104 HydrophobicContact CD2-CD1 3.83Å; L99-Y104 HydrophobicContact CD2-CE1 4.48Å; D101-Y104 HydrophobicContact CB-CD2 3.9Å; D101-Y104 HydrophobicContact CB-CG 4.16Å; D101-Y104 PolarHBondContact O-N 2.83Å; D101-Y104 VanDerWaalsContact O-N 3.15Å; Y104-K106 VanDerWaalsContact C-N 3.33Å; Y104-K106 PolarHBondContact O-N 3.36Å; Y104-V107 PolarHBondContact O-N 3.36Å; Y104-I108 PolarHBondContact O-N 2.65Å; Y104-I108 VanDerWaalsContact O-N 3.07Å; Y104-F301 HydrophobicContact CD1-CB 4.31Å; Y104-F301 AromaticContact CD1-CD1 3.29Å; Y104-F301 HydrophobicContact CD1-CD1 3.29Å; Y104-F301 AromaticContact CD1-CD2 3.71Å; Y104-F301 HydrophobicContact CD1-CD2 3.71Å; Y104-F301 AromaticContact CD1-CE1 3.29Å; Y104-F301 HydrophobicContact CD1-CE1 3.29Å; Y104-F301 AromaticContact CD1-CE2 3.69Å; Y104-F301 HydrophobicContact CD1-CE2 3.69Å; Y104-F301 AromaticContact CD1-CG 3.5Å; Y104-F301 HydrophobicContact CD1-CG 3.5Å; Y104-F301 VanDerWaalsContact CD1-CG 3.5Å; Y104-F301 AromaticContact CD1-CZ 3.49Å; Y104-F301 HydrophobicContact CD1-CZ 3.49Å; Y104-F301 VanDerWaalsContact CD1-CZ 3.49Å; Y104-F301 HydrophobicContact CD2-CB 4.23Å; Y104-F301 HydrophobicContact CD2-CD1 4.08Å; Y104-F301 HydrophobicContact CD2-CG 4.23Å; Y104-F301 HydrophobicContact CE1-CB 3.8Å; Y104-F301 AromaticContact CE1-CD1 3.56Å; Y104-F301 HydrophobicContact CE1-CD1 3.56Å; Y104-F301 AromaticContact CE1-CD2 3.13Å; Y104-F301 HydrophobicContact CE1-CD2 3.13Å; Y104-F301 AromaticContact CE1-CE1 3.83Å; Y104-F301 HydrophobicContact CE1-CE1 3.83Å; Y104-F301 AromaticContact CE1-CE2 3.4Å; Y104-F301 HydrophobicContact CE1-CE2 3.4Å; Y104-F301 VanDerWaalsContact CE1-CE2 3.4Å; Y104-F301 AromaticContact CE1-CG 3.19Å; Y104-F301 HydrophobicContact CE1-CG 3.19Å; Y104-F301 AromaticContact CE1-CZ 3.74Å; Y104-F301 HydrophobicContact CE1-CZ 3.74Å; Y104-F301 HydrophobicContact CE2-CB 3.69Å; Y104-F301 HydrophobicContact CE2-CD1 4.29Å; Y104-F301 AromaticContact CE2-CG 3.96Å; Y104-F301 HydrophobicContact CE2-CG 3.96Å; Y104-F301 AromaticContact CG-CD1 3.57Å; Y104-F301 HydrophobicContact CG-CD1 3.57Å; Y104-F301 AromaticContact CG-CE1 3.82Å; Y104-F301 HydrophobicContact CG-CE1 3.82Å; Y104-F301 HydrophobicContact CG-CG 4.01Å; Y104-F301 HydrophobicContact CG-CZ 4.44Å; Y104-F301 VanDerWaalsContact CZ-CB 3.43Å; Y104-F301 AromaticContact CZ-CD2 3.63Å; Y104-F301 AromaticContact CZ-CG 3.42Å; Y104-F301 VanDerWaalsContact CZ-CG 3.42Å; Y104-D303 PolarHBondContact OH-OD1 3.41Å; Y104-D303 PolarHBondContact OH-OD2 3.33Å; Y104-R305 PolarHBondContact OH-NE 3.36Å; Y104-R305 PolarHBondContact OH-NH2 2.9Å; Y104-R305 VanDerWaalsContact OH-NH2 3.12Å
105	M	95.4	Very high	93.3	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-56.2	-49	176.4	-70.7	-65.7	-174.9	0	0	110.8	L99 D101 V107 I108 L109 L315 S316 L320 H347 L350	L99-M105 WeakPolarHBondContact O-CE 3.31Å; D101-M105 WeakPolarHBondContact O-CG 3.33Å; D101-M105 PolarHBondContact O-N 3.15Å; M105-V107 VanDerWaalsContact C-N 3.34Å; M105-V107 PolarHBondContact O-N 3.26Å; M105-I108 PolarHBondContact O-N 3Å; M105-L109 HydrophobicContact CB-CD1 4.42Å; M105-L109 VanDerWaalsContact O-CB 3.28Å; M105-L109 WeakPolarHBondContact O-CB 3.46Å; M105-L109 VanDerWaalsContact O-CG 3.24Å; M105-L109 WeakPolarHBondContact O-CG 3.3Å; M105-L109 PolarHBondContact O-N 3.21Å; M105-L315 HydrophobicContact CE-CB 4.07Å; M105-L315 HydrophobicContact SD-CB 3.64Å; M105-L315 HydrophobicContact SD-CD1 4.41Å; M105-L315 HydrophobicContact SD-CD2 3.49Å; M105-L315 WeakPolarHBondContact SD-CD2 3.38Å; M105-L315 HydrophobicContact SD-CG 4Å; M105-S316 WeakPolarHBondContact CE-O 3.37Å; M105-L320 HydrophobicContact CE-CB 4.04Å; M105-L320 HydrophobicContact CE-CD2 4.3Å; M105-L320 HydrophobicContact CG-CD1 4.12Å; M105-L320 HydrophobicContact CG-CD2 4.14Å; M105-H347 HydrophobicContact CB-CB 4.49Å; M105-L350 HydrophobicContact CB-CD1 4.09Å; M105-L350 HydrophobicContact CG-CD1 4.4Å
106	K	95.3	Very high	92.9	Very high	103 Å²	103	28.5 Å²	28.5	45%	0.448	16%	0.164	S	C	.	.	H	α-helix	trans	-57.3	-45.3	178.4	-179	178	178.7	-172.9	0	112.2	P102 D103 Y104 G110 H347	P102-K106 WeakPolarHBondContact O-CB 3.39Å; P102-K106 PolarHBondContact O-N 3.35Å; D103-K106 PolarHBondContact O-N 3.03Å; Y104-K106 VanDerWaalsContact C-N 3.33Å; Y104-K106 PolarHBondContact O-N 3.36Å; K106-G110 PolarHBondContact O-N 3.13Å; K106-H347 HydrophobicContact CB-CB 4.26Å
107	V	95.7	Very high	91.9	Very high	42 Å²	42	30.7 Å²	30.7	26%	0.255	18%	0.177	S	C	.	.	H	α-helix	trans	-62.4	-45.9	179.1	173.1	0	0	0	0	111.3	D103 Y104 M105 R111 V299 F301 P302	D103-V107 WeakPolarHBondContact O-CG2 3.29Å; D103-V107 PolarHBondContact O-N 3.34Å; D103-V107 VanDerWaalsContact O-N 3.16Å; Y104-V107 PolarHBondContact O-N 3.36Å; M105-V107 VanDerWaalsContact C-N 3.34Å; M105-V107 PolarHBondContact O-N 3.26Å; V107-R111 VanDerWaalsContact O-CD 3.22Å; V107-R111 WeakPolarHBondContact O-CD 3.44Å; V107-R111 VanDerWaalsContact O-CG 3.26Å; V107-R111 WeakPolarHBondContact O-CG 3.34Å; V107-V299 HydrophobicContact CG1-CG2 3.38Å; V107-F301 HydrophobicContact CB-CD1 4.26Å; V107-F301 HydrophobicContact CB-CE1 4.44Å; V107-F301 HydrophobicContact CG1-CD1 4.29Å; V107-F301 HydrophobicContact CG1-CE1 4.37Å; V107-P302 HydrophobicContact CG2-CG 4.47Å
108	I	95.6	Very high	90.5	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-71.7	-41.2	-179	-61.7	-51.4	0	0	0	112	L99 Y104 M105 G110 R111 R293 L295 V299 F301 V313 L315	L99-I108 HydrophobicContact CD1-CD1 4.48Å; L99-I108 HydrophobicContact CD1-CG1 3.6Å; Y104-I108 PolarHBondContact O-N 2.65Å; Y104-I108 VanDerWaalsContact O-N 3.07Å; M105-I108 PolarHBondContact O-N 3Å; I108-G110 VanDerWaalsContact C-N 3.33Å; I108-G110 PolarHBondContact O-N 3.12Å; I108-R111 WeakPolarHBondContact O-CB 3.41Å; I108-R111 PolarHBondContact O-N 3.45Å; I108-R293 HydrophobicContact CG2-CB 4.44Å; I108-R293 HydrophobicContact CG2-CG 4.24Å; I108-L295 HydrophobicContact CD1-CD2 3.84Å; I108-V299 HydrophobicContact CD1-CG1 4.22Å; I108-V299 HydrophobicContact CD1-CG2 4.24Å; I108-F301 HydrophobicContact CD1-CE1 4.03Å; I108-F301 HydrophobicContact CD1-CZ 4.18Å; I108-F301 HydrophobicContact CG1-CE1 4.15Å; I108-V313 HydrophobicContact CG1-CG2 4.49Å; I108-V313 HydrophobicContact CG2-CG2 3.96Å; I108-L315 HydrophobicContact CB-CD2 3.91Å; I108-L315 HydrophobicContact CG1-CD2 4.27Å; I108-L315 HydrophobicContact CG2-CD1 4.04Å; I108-L315 HydrophobicContact CG2-CD2 3.8Å; I108-L315 HydrophobicContact CG2-CG 4.31Å
109	L	93.7	Very high	89	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-72.7	-26	-178.5	-68.2	172.8	0	0	0	113.1	M105 R111 I291 L315 L350	M105-L109 HydrophobicContact CB-CD1 4.42Å; M105-L109 VanDerWaalsContact O-CB 3.28Å; M105-L109 WeakPolarHBondContact O-CB 3.46Å; M105-L109 VanDerWaalsContact O-CG 3.24Å; M105-L109 WeakPolarHBondContact O-CG 3.3Å; M105-L109 PolarHBondContact O-N 3.21Å; L109-R111 PolarHBondContact O-N 2.74Å; L109-I291 HydrophobicContact CD2-CD1 4.29Å; L109-L315 HydrophobicContact CD2-CD1 3.42Å; L109-L315 VanDerWaalsContact CD2-CD1 3.42Å; L109-L315 HydrophobicContact CG-CD1 3.88Å; L109-L350 HydrophobicContact CD1-CD1 3.55Å
110	G	91.9	Very high	87.7	Confident	66 Å²	66	36.5 Å²	36.5	68%	0.68	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.5	171	0	0	0	0	0	114	K106 I108	K106-G110 PolarHBondContact O-N 3.13Å; I108-G110 VanDerWaalsContact C-N 3.33Å; I108-G110 PolarHBondContact O-N 3.12Å
111	R	92.4	Very high	86.5	Confident	54 Å²	54	43.9 Å²	43.9	20%	0.204	25%	0.249	C	C	.	.	S	Bend	trans	-97.6	157.7	-177.8	-65.2	164.8	54.8	91.2	12.8	111.5	V107 I108 L109 D113 T297 P298	V107-R111 VanDerWaalsContact O-CD 3.22Å; V107-R111 WeakPolarHBondContact O-CD 3.44Å; V107-R111 VanDerWaalsContact O-CG 3.26Å; V107-R111 WeakPolarHBondContact O-CG 3.34Å; I108-R111 WeakPolarHBondContact O-CB 3.41Å; I108-R111 PolarHBondContact O-N 3.45Å; L109-R111 PolarHBondContact O-N 2.74Å; R111-D113 VanDerWaalsContact C-N 3.3Å; R111-D113 WeakPolarHBondContact CB-OD2 3.43Å; R111-D113 IonicContact CZ-OD1 2.73Å; R111-D113 IonicContact CZ-OD2 3.64Å; R111-D113 IonicContact NE-OD1 3.92Å; R111-D113 IonicContact NE-OD2 2.64Å; R111-D113 PolarHBondContact NE-OD2 3.12Å; R111-D113 IonicContact NH2-OD1 3.65Å; R111-D113 PolarHBondContact NH2-OD1 2.96Å; R111-D113 IonicContact NH2-OD2 3.53Å; R111-D113 PolarHBondContact NH2-OD2 3.44Å; R111-D113 VanDerWaalsContact NH2-OD2 3.16Å; R111-D113 PolarHBondContact O-N 3.16Å; R111-T297 PolarHBondContact NH1-OG1 3.04Å; R111-T297 PolarHBondContact NH2-O 3.38Å; R111-T297 PolarHBondContact NH2-OG1 2.93Å; R111-P298 PolarHBondContact NH1-O 3.21Å
112	S	88.5	Confident	85.3	Confident	93 Å²	93	51.2 Å²	51.2	65%	0.65	28%	0.281	S	S	*	.			trans	-93.6	21.4	178.6	-67.2	0	0	0	0	113.8	R357	S112-R357 PolarHBondContact O-NH2 2.83Å
113	D	90.8	Very high	84.3	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-55.5	140.2	-177.1	-68.3	-62.4	0	0	0	112.1	R111 R293 S296 R357	R111-D113 VanDerWaalsContact C-N 3.3Å; R111-D113 WeakPolarHBondContact CB-OD2 3.43Å; R111-D113 IonicContact CZ-OD1 2.73Å; R111-D113 IonicContact CZ-OD2 3.64Å; R111-D113 IonicContact NE-OD1 3.92Å; R111-D113 IonicContact NE-OD2 2.64Å; R111-D113 PolarHBondContact NE-OD2 3.12Å; R111-D113 IonicContact NH2-OD1 3.65Å; R111-D113 PolarHBondContact NH2-OD1 2.96Å; R111-D113 IonicContact NH2-OD2 3.53Å; R111-D113 PolarHBondContact NH2-OD2 3.44Å; R111-D113 VanDerWaalsContact NH2-OD2 3.16Å; R111-D113 PolarHBondContact O-N 3.16Å; D113-R293 PolarHBondContact O-NH1 3.45Å; D113-S296 WeakPolarHBondContact OD1-CB 3.32Å; D113-S296 PolarHBondContact OD1-N 2.94Å; D113-S296 PolarHBondContact OD1-OG 2.92Å; D113-R357 PolarHBondContact O-NH2 3.11Å
114	P	89.8	Confident	83.4	Confident	32 Å²	32	51.8 Å²	51.8	21%	0.208	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-63.7	156.5	179.5	27.5	-34.9	0	0	0	112.1	N135 R293 E294	P114-N135 WeakPolarHBondContact CA-OD1 3.48Å; P114-N135 HydrophobicContact CB-CB 4.48Å; P114-R293 WeakPolarHBondContact O-CA 3.43Å; P114-E294 WeakPolarHBondContact CD-O 3.49Å; P114-E294 HydrophobicContact CG-CB 4.41Å; P114-E294 PolarHBondContact O-N 3.05Å
115	K	87.9	Confident	82.7	Confident	16 Å²	16	57.2 Å²	57.2	7%	0.07	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-66.4	146.2	172.1	-62.5	175.7	-172.6	126.3	0	109.7	H117 Y120 L131 L132 L134 N135	K115-H117 PolarHBondContact O-N 3.22Å; K115-Y120 HydrophobicContact CB-CD2 3.88Å; K115-Y120 HydrophobicContact CB-CE2 3.89Å; K115-Y120 HydrophobicContact CG-CE2 4.49Å; K115-L131 PolarHBondContact NZ-O 3.37Å; K115-L132 WeakPolarHBondContact CD-O 3.33Å; K115-L132 WeakPolarHBondContact CE-O 3.48Å; K115-L132 VanDerWaalsContact NZ-C 3.26Å; K115-L132 PolarHBondContact NZ-O 2.89Å; K115-L134 PolarHBondContact NZ-O 3.44Å; K115-N135 PolarHBondContact N-OD1 3.34Å
116	S	81.6	Confident	81.8	Confident	5 Å²	5	68.3 Å²	68.3	4%	0.035	36%	0.362	C	S	.	.			trans	-63.2	113.3	-177.9	57.8	0	0	0	0	112.4	G118 S119 Y120 G292 M312	S116-G118 PolarHBondContact O-N 2.62Å; S116-S119 PolarHBondContact OG-OG 3.28Å; S116-Y120 VanDerWaalsContact O-CD2 3.27Å; S116-Y120 WeakPolarHBondContact O-CD2 3.32Å; S116-G292 PolarHBondContact N-O 3.41Å; S116-G292 VanDerWaalsContact N-O 3.1Å; S116-G292 WeakPolarHBondContact OG-CA 3.27Å; S116-G292 PolarHBondContact OG-O 2.94Å; S116-M312 WeakPolarHBondContact CB-SD 3.12Å
117	H	69.1	Low	81.1	Confident	119 Å²	119	67.8 Å²	67.8	55%	0.551	36%	0.363	S	S	*	.	H	α-helix	trans	-56.9	-29.5	-173.7	-74.2	77.4	0	0	0	114.7	K115 K121 E294	K115-H117 PolarHBondContact O-N 3.22Å; H117-K121 WeakPolarHBondContact O-CB 3.4Å; H117-K121 PolarHBondContact O-N 2.9Å; H117-E294 IonicContact CE1-OE2 3.92Å; H117-E294 IonicContact ND1-OE2 3.05Å; H117-E294 PolarHBondContact ND1-OE2 3.34Å
118	G	65.2	Low	80.5	Confident	34 Å²	34	67.2 Å²	67.2	35%	0.351	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-49.5	-171.3	0	0	0	0	0	115.8	S116 F122	S116-G118 PolarHBondContact O-N 2.62Å; G118-F122 WeakPolarHBondContact O-CD2 3.43Å; G118-F122 WeakPolarHBondContact O-CE2 3.27Å
119	S	62.6	Low	79.9	Confident	49 Å²	49	75.2 Å²	75.2	34%	0.343	40%	0.397	S	S	.	.	H	α-helix	trans	-79.4	-39	-177.5	42.9	0	0	0	0	112.3	S116 K121	S116-S119 PolarHBondContact OG-OG 3.28Å; S119-K121 VanDerWaalsContact C-N 3.33Å; S119-K121 PolarHBondContact O-N 3.01Å
120	Y	69.3	Low	79.4	Confident	43 Å²	43	76.5 Å²	76.5	17%	0.169	41%	0.411	C	S	.	.	H	α-helix	trans	-74.5	-20.1	-175	-74.3	-69.8	0	0	0	114	K115 S116 F122 L123 A124 L132 L133	K115-Y120 HydrophobicContact CB-CD2 3.88Å; K115-Y120 HydrophobicContact CB-CE2 3.89Å; K115-Y120 HydrophobicContact CG-CE2 4.49Å; S116-Y120 VanDerWaalsContact O-CD2 3.27Å; S116-Y120 WeakPolarHBondContact O-CD2 3.32Å; Y120-F122 PolarHBondContact O-N 3.4Å; Y120-L123 HydrophobicContact CD1-CD1 4.11Å; Y120-L123 PolarHBondContact O-N 3.44Å; Y120-A124 PolarHBondContact O-N 3.3Å; Y120-L132 HydrophobicContact CE1-CD1 4.4Å; Y120-L132 HydrophobicContact CE1-CG 4.45Å; Y120-L133 HydrophobicContact CD1-CD2 3.56Å; Y120-L133 HydrophobicContact CG-CD2 4.04Å
121	K	68.8	Low	79.3	Confident	156 Å²	156	75.4 Å²	75.4	68%	0.678	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-31.1	176.8	-174.9	176.2	-179.8	-177.7	0	112.9	H117 S119 L123 P125	H117-K121 WeakPolarHBondContact O-CB 3.4Å; H117-K121 PolarHBondContact O-N 2.9Å; S119-K121 VanDerWaalsContact C-N 3.33Å; S119-K121 PolarHBondContact O-N 3.01Å; K121-L123 VanDerWaalsContact C-N 3.31Å; K121-P125 WeakPolarHBondContact O-CD 3.41Å
122	F	70.3	Confident	79	Confident	171 Å²	171	77.2 Å²	77.2	75%	0.75	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-21.8	179.5	-60.6	-72.8	0	0	0	113.1	G118 Y120 P125	G118-F122 WeakPolarHBondContact O-CD2 3.43Å; G118-F122 WeakPolarHBondContact O-CE2 3.27Å; Y120-F122 PolarHBondContact O-N 3.4Å; F122-P125 WeakPolarHBondContact O-CD 3.46Å
123	L	74	Confident	78.9	Confident	77 Å²	77	73.3 Å²	73.3	40%	0.403	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-28.6	176.5	-65.6	171.7	0	0	0	112.1	Y120 K121 P125 R126 I127	Y120-L123 HydrophobicContact CD1-CD1 4.11Å; Y120-L123 PolarHBondContact O-N 3.44Å; K121-L123 VanDerWaalsContact C-N 3.31Å; L123-P125 VanDerWaalsContact C-CD 3.45Å; L123-R126 PolarHBondContact O-N 3.43Å; L123-I127 HydrophobicContact CB-CD1 4.03Å; L123-I127 HydrophobicContact CB-CG1 4.16Å; L123-I127 VanDerWaalsContact O-CG1 3.3Å; L123-I127 WeakPolarHBondContact O-CG1 3.19Å; L123-I127 PolarHBondContact O-N 3.29Å; L123-I127 VanDerWaalsContact O-N 3.14Å
124	A	78.2	Confident	78.8	Confident	15 Å²	15	74.4 Å²	74.4	12%	0.124	38%	0.38	C	S	.	.	H	α-helix	trans	-53.3	-40.3	-174.3	0	0	0	0	0	115	Y120 R126 G128 Y129 L133	Y120-A124 PolarHBondContact O-N 3.3Å; A124-R126 VanDerWaalsContact C-N 3.27Å; A124-R126 PolarHBondContact O-N 2.92Å; A124-G128 VanDerWaalsContact O-CA 3.24Å; A124-G128 WeakPolarHBondContact O-CA 3.39Å; A124-G128 PolarHBondContact O-N 3.49Å; A124-Y129 HydrophobicContact CB-CE2 4.25Å; A124-L133 HydrophobicContact CB-CD1 3.79Å
125	P	81.2	Confident	78.7	Confident	118 Å²	118	75 Å²	75	77%	0.766	38%	0.382	S	S	*	.	H	α-helix	trans	-62.9	-29.7	177.9	-24	35.3	0	0	0	114.3	K121 F122 L123	K121-P125 WeakPolarHBondContact O-CD 3.41Å; F122-P125 WeakPolarHBondContact O-CD 3.46Å; L123-P125 VanDerWaalsContact C-CD 3.45Å
126	R	76.1	Confident	78.7	Confident	236 Å²	236	76.5 Å²	76.5	89%	0.891	40%	0.401	S	S	*	.	H	α-helix	trans	-93.2	-41.5	-174.6	-168.6	171.9	-175.1	147.4	0.2	113.1	L123 A124	L123-R126 PolarHBondContact O-N 3.43Å; A124-R126 VanDerWaalsContact C-N 3.27Å; A124-R126 PolarHBondContact O-N 2.92Å
127	I	80.9	Confident	79.1	Confident	91 Å²	91	82.2 Å²	82.2	47%	0.467	43%	0.427	S	S	.	.	H	α-helix	trans	-109.7	-5.4	-173.7	62.1	165.7	0	0	0	113.8	L123 L132 L133	L123-I127 HydrophobicContact CB-CD1 4.03Å; L123-I127 HydrophobicContact CB-CG1 4.16Å; L123-I127 VanDerWaalsContact O-CG1 3.3Å; L123-I127 WeakPolarHBondContact O-CG1 3.19Å; L123-I127 PolarHBondContact O-N 3.29Å; L123-I127 VanDerWaalsContact O-N 3.14Å; I127-L132 HydrophobicContact CD1-CD2 3.99Å; I127-L133 HydrophobicContact CD1-CD1 4.39Å; I127-L133 HydrophobicContact CD1-CG 4.3Å; I127-L133 HydrophobicContact CG1-CD1 4.36Å
128	G	83.3	Confident	80.1	Confident	30 Å²	30	79.8 Å²	79.8	31%	0.309	42%	0.421	S	S	.	.			trans	64.9	-175.4	-175.8	0	0	0	0	0	114	A124 G130 L133	A124-G128 VanDerWaalsContact O-CA 3.24Å; A124-G128 WeakPolarHBondContact O-CA 3.39Å; A124-G128 PolarHBondContact O-N 3.49Å; G128-G130 VanDerWaalsContact C-N 3.28Å; G128-G130 PolarHBondContact O-N 3.01Å; G128-L133 VanDerWaalsContact O-CD1 3.25Å; G128-L133 WeakPolarHBondContact O-CD1 3.4Å
129	Y	81.5	Confident	81.4	Confident	170 Å²	170	79.3 Å²	79.3	67%	0.667	41%	0.409	S	S	*	.	S	Bend	trans	-84.4	66.8	178	-72.7	-89	0	0	0	111.8	A124 L133 L134	A124-Y129 HydrophobicContact CB-CE2 4.25Å; Y129-L133 HydrophobicContact CD1-CB 4.16Å; Y129-L134 WeakPolarHBondContact O-CG 3.44Å
130	G	85	Confident	82.7	Confident	31 Å²	31	81.8 Å²	81.8	32%	0.32	41%	0.413	S	S	.	.			trans	-83.1	-171.9	173.4	0	0	0	0	0	113.9	G128 L132 L133 L134	G128-G130 VanDerWaalsContact C-N 3.28Å; G128-G130 PolarHBondContact O-N 3.01Å; G130-L132 PolarHBondContact O-N 2.98Å; G130-L133 PolarHBondContact O-N 3.34Å; G130-L134 VanDerWaalsContact O-CG 3.29Å; G130-L134 WeakPolarHBondContact O-CG 3.43Å; G130-L134 PolarHBondContact O-N 2.95Å
131	L	88.6	Confident	83.9	Confident	43 Å²	43	83.7 Å²	83.7	23%	0.225	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-34.1	-179.1	-172.4	67.7	0	0	0	113.1	K115 L133 W139 H142 R143 L146	K115-L131 PolarHBondContact NZ-O 3.37Å; L131-L133 PolarHBondContact O-N 2.91Å; L131-W139 VanDerWaalsContact O-CD1 3.31Å; L131-H142 HydrophobicContact CD1-CB 4.18Å; L131-R143 HydrophobicContact CD1-CB 3.83Å; L131-L146 HydrophobicContact CB-CD1 4.42Å; L131-L146 HydrophobicContact CD2-CD1 4.19Å
132	L	87.1	Confident	85	Confident	91 Å²	91	79.7 Å²	79.7	48%	0.476	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-31.6	177.7	-175.5	62.1	0	0	0	113.1	K115 Y120 I127 G130	K115-L132 WeakPolarHBondContact CD-O 3.33Å; K115-L132 WeakPolarHBondContact CE-O 3.48Å; K115-L132 VanDerWaalsContact NZ-C 3.26Å; K115-L132 PolarHBondContact NZ-O 2.89Å; Y120-L132 HydrophobicContact CE1-CD1 4.4Å; Y120-L132 HydrophobicContact CE1-CG 4.45Å; I127-L132 HydrophobicContact CD1-CD2 3.99Å; G130-L132 PolarHBondContact O-N 2.98Å
133	L	86.7	Confident	86.1	Confident	12 Å²	12	76.5 Å²	76.5	6%	0.063	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-24.1	-176.2	-58.4	-165.6	0	0	0	113.5	Y120 A124 I127 G128 Y129 G130 L131 N135	Y120-L133 HydrophobicContact CD1-CD2 3.56Å; Y120-L133 HydrophobicContact CG-CD2 4.04Å; A124-L133 HydrophobicContact CB-CD1 3.79Å; I127-L133 HydrophobicContact CD1-CD1 4.39Å; I127-L133 HydrophobicContact CD1-CG 4.3Å; I127-L133 HydrophobicContact CG1-CD1 4.36Å; G128-L133 VanDerWaalsContact O-CD1 3.25Å; G128-L133 WeakPolarHBondContact O-CD1 3.4Å; Y129-L133 HydrophobicContact CD1-CB 4.16Å; G130-L133 PolarHBondContact O-N 3.34Å; L131-L133 PolarHBondContact O-N 2.91Å; L133-N135 PolarHBondContact O-ND2 2.9Å
134	L	88.3	Confident	87.1	Confident	23 Å²	23	81.3 Å²	81.3	12%	0.12	40%	0.403	C	S	.	.			trans	-63.8	152.9	-179.6	-70.1	169.2	0	0	0	112.6	K115 Y129 G130 T138 W139 H142 R357	K115-L134 PolarHBondContact NZ-O 3.44Å; Y129-L134 WeakPolarHBondContact O-CG 3.44Å; G130-L134 VanDerWaalsContact O-CG 3.29Å; G130-L134 WeakPolarHBondContact O-CG 3.43Å; G130-L134 PolarHBondContact O-N 2.95Å; L134-T138 HydrophobicContact CD1-CG2 4.16Å; L134-T138 HydrophobicContact CD2-CG2 3.85Å; L134-W139 HydrophobicContact CB-CB 3.73Å; L134-W139 HydrophobicContact CB-CG 4.45Å; L134-H142 HydrophobicContact CD1-CB 4.23Å; L134-H142 WeakPolarHBondContact CD1-ND1 3.32Å; L134-R357 PolarHBondContact O-NH1 3.37Å
135	N	86.7	Confident	87.8	Confident	46 Å²	46	87.2 Å²	87.2	25%	0.246	43%	0.43	C	S	.	.			trans	-133.6	166	174.9	-65.1	-70.3	0	0	0	110.6	P114 K115 L133 W139 R357	P114-N135 WeakPolarHBondContact CA-OD1 3.48Å; P114-N135 HydrophobicContact CB-CB 4.48Å; K115-N135 PolarHBondContact N-OD1 3.34Å; L133-N135 PolarHBondContact O-ND2 2.9Å; N135-W139 PolarHBondContact O-N 3.36Å; N135-R357 PolarHBondContact OD1-NH1 3.3Å; N135-R357 PolarHBondContact OD1-NH2 3.5Å
136	G	87.8	Confident	88.3	Confident	46 Å²	46	85.5 Å²	85.5	47%	0.474	41%	0.414	S	S	.	.	H	α-helix	trans	62.6	-143.8	171.3	0	0	0	0	0	114.2	T138 W139 F140	G136-T138 PolarHBondContact O-N 2.81Å; G136-W139 WeakPolarHBondContact O-CB 3.45Å; G136-W139 PolarHBondContact O-N 2.76Å; G136-F140 PolarHBondContact O-N 2.94Å; G136-F140 VanDerWaalsContact O-N 3.12Å
137	Q	90.1	Very high	89	Confident	125 Å²	125	77.4 Å²	77.4	58%	0.584	39%	0.391	S	S	*	.	H	α-helix	trans	-65.8	-39.7	-173.1	-170.3	63.9	5.8	0	0	113.1	W139 F140 Q141	Q137-W139 VanDerWaalsContact C-N 3.33Å; Q137-W139 PolarHBondContact O-N 2.99Å; Q137-F140 WeakPolarHBondContact O-CB 3.33Å; Q137-F140 PolarHBondContact O-N 3.47Å; Q137-F140 VanDerWaalsContact O-N 3.15Å; Q137-Q141 WeakPolarHBondContact O-CG 3.01Å; Q137-Q141 PolarHBondContact O-N 2.84Å
138	T	89.5	Confident	89.6	Confident	68 Å²	68	77 Å²	77	42%	0.417	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-41.5	178.1	-46.6	0	0	0	0	111.2	L134 G136 F140 Q141 H142	L134-T138 HydrophobicContact CD1-CG2 4.16Å; L134-T138 HydrophobicContact CD2-CG2 3.85Å; G136-T138 PolarHBondContact O-N 2.81Å; T138-F140 VanDerWaalsContact C-N 3.34Å; T138-F140 PolarHBondContact O-N 2.74Å; T138-Q141 PolarHBondContact O-N 3.39Å; T138-H142 PolarHBondContact O-CD2 3.05Å; T138-H142 PolarHBondContact O-N 3.31Å
139	W	92.9	Very high	89.9	Confident	25 Å²	25	77.9 Å²	77.9	10%	0.095	40%	0.398	C	S	.	.	H	α-helix	trans	-59.7	-45.3	172.6	171.1	84.1	0	0	0	111.7	L131 L134 N135 G136 Q137 Q141 H142 R143 S356 R357	L131-W139 VanDerWaalsContact O-CD1 3.31Å; L134-W139 HydrophobicContact CB-CB 3.73Å; L134-W139 HydrophobicContact CB-CG 4.45Å; N135-W139 PolarHBondContact O-N 3.36Å; G136-W139 WeakPolarHBondContact O-CB 3.45Å; G136-W139 PolarHBondContact O-N 2.76Å; Q137-W139 VanDerWaalsContact C-N 3.33Å; Q137-W139 PolarHBondContact O-N 2.99Å; W139-Q141 PolarHBondContact O-N 3.12Å; W139-H142 PolarHBondContact O-N 3.07Å; W139-R143 HydrophobicContact CH2-CG 4.33Å; W139-R143 HydrophobicContact CZ2-CB 4.27Å; W139-R143 HydrophobicContact CZ2-CG 4.13Å; W139-R143 WeakPolarHBondContact O-CB 3.41Å; W139-R143 PolarHBondContact O-N 3.31Å; W139-S356 WeakPolarHBondContact CH2-O 3.49Å; W139-S356 WeakPolarHBondContact CZ2-O 3.44Å; W139-R357 HydrophobicContact CH2-CG 4.1Å; W139-R357 HydrophobicContact CZ2-CB 4.18Å; W139-R357 HydrophobicContact CZ2-CG 3.73Å
140	F	91.3	Very high	90.3	Very high	100 Å²	100	76.7 Å²	76.7	44%	0.439	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-42.4	179.8	-179.4	-97.9	0	0	0	111.9	G136 Q137 T138 R143 R144	G136-F140 PolarHBondContact O-N 2.94Å; G136-F140 VanDerWaalsContact O-N 3.12Å; Q137-F140 WeakPolarHBondContact O-CB 3.33Å; Q137-F140 PolarHBondContact O-N 3.47Å; Q137-F140 VanDerWaalsContact O-N 3.15Å; T138-F140 VanDerWaalsContact C-N 3.34Å; T138-F140 PolarHBondContact O-N 2.74Å; F140-R143 PolarHBondContact O-N 2.87Å; F140-R144 WeakPolarHBondContact O-CB 3.44Å; F140-R144 PolarHBondContact O-N 3.45Å
141	Q	93.6	Very high	90.4	Very high	84 Å²	84	80.2 Å²	80.2	39%	0.393	41%	0.405	S	S	.	.	H	α-helix	trans	-58.9	-50.9	175.4	-72.4	170.6	-10	0	0	111.5	Q137 T138 W139 R143 R144 M145	Q137-Q141 WeakPolarHBondContact O-CG 3.01Å; Q137-Q141 PolarHBondContact O-N 2.84Å; T138-Q141 PolarHBondContact O-N 3.39Å; W139-Q141 PolarHBondContact O-N 3.12Å; Q141-R143 PolarHBondContact O-N 3.4Å; Q141-R144 PolarHBondContact O-N 3.14Å; Q141-M145 VanDerWaalsContact O-CG 3.31Å; Q141-M145 WeakPolarHBondContact O-CG 3.4Å; Q141-M145 PolarHBondContact O-N 3.45Å
142	H	92.9	Very high	90.2	Very high	71 Å²	71	83.1 Å²	83.1	33%	0.329	42%	0.42	S	S	.	.	H	α-helix	trans	-63.9	-41	178.8	-75.9	-137.8	0	0	0	111.7	L131 L134 T138 W139 R144 M145 L146	L131-H142 HydrophobicContact CD1-CB 4.18Å; L134-H142 HydrophobicContact CD1-CB 4.23Å; L134-H142 WeakPolarHBondContact CD1-ND1 3.32Å; T138-H142 PolarHBondContact O-CD2 3.05Å; T138-H142 PolarHBondContact O-N 3.31Å; W139-H142 PolarHBondContact O-N 3.07Å; H142-R144 VanDerWaalsContact C-N 3.33Å; H142-R144 PolarHBondContact O-N 3.01Å; H142-M145 PolarHBondContact O-N 3.35Å; H142-L146 WeakPolarHBondContact O-CG 3.31Å; H142-L146 PolarHBondContact O-N 3.48Å
143	R	92.9	Very high	90	Very high	105 Å²	105	83 Å²	83	40%	0.396	42%	0.42	S	S	.	.	H	α-helix	trans	-60	-45.5	176.2	-175.4	64	-173	-169.4	-0.1	110.8	L131 W139 F140 Q141 M145 L146 T147	L131-R143 HydrophobicContact CD1-CB 3.83Å; W139-R143 HydrophobicContact CH2-CG 4.33Å; W139-R143 HydrophobicContact CZ2-CB 4.27Å; W139-R143 HydrophobicContact CZ2-CG 4.13Å; W139-R143 WeakPolarHBondContact O-CB 3.41Å; W139-R143 PolarHBondContact O-N 3.31Å; F140-R143 PolarHBondContact O-N 2.87Å; Q141-R143 PolarHBondContact O-N 3.4Å; R143-M145 VanDerWaalsContact C-N 3.31Å; R143-M145 PolarHBondContact O-N 3.05Å; R143-L146 PolarHBondContact O-N 3Å; R143-T147 PolarHBondContact NE-OG1 3.36Å; R143-T147 WeakPolarHBondContact O-CB 3.17Å; R143-T147 PolarHBondContact O-N 3.31Å; R143-T147 PolarHBondContact O-OG1 2.89Å
144	R	93.8	Very high	90	Very high	177 Å²	177	86.1 Å²	86.1	67%	0.668	44%	0.436	S	S	*	.	H	α-helix	trans	-63.5	-37.2	179.3	-168.7	175.3	74.8	168.9	4.1	112.1	F140 Q141 H142 P148	F140-R144 WeakPolarHBondContact O-CB 3.44Å; F140-R144 PolarHBondContact O-N 3.45Å; Q141-R144 PolarHBondContact O-N 3.14Å; H142-R144 VanDerWaalsContact C-N 3.33Å; H142-R144 PolarHBondContact O-N 3.01Å; R144-P148 WeakPolarHBondContact O-CD 3.27Å
145	M	93.5	Very high	89.8	Confident	140 Å²	140	87.5 Å²	87.5	69%	0.69	44%	0.443	S	S	*	.	H	α-helix	trans	-68.3	-40.3	176.4	-69.2	169.7	-179.4	0	0	112.6	Q141 H142 R143	Q141-M145 VanDerWaalsContact O-CG 3.31Å; Q141-M145 WeakPolarHBondContact O-CG 3.4Å; Q141-M145 PolarHBondContact O-N 3.45Å; H142-M145 PolarHBondContact O-N 3.35Å; R143-M145 VanDerWaalsContact C-N 3.31Å; R143-M145 PolarHBondContact O-N 3.05Å
146	L	91.8	Very high	89.6	Confident	81 Å²	81	87.8 Å²	87.8	42%	0.424	44%	0.443	S	S	.	.	H	α-helix	trans	-87	-28.4	-173.5	-67.9	172.2	0	0	0	114.3	L131 H142 R143 P148 A149 F150	L131-L146 HydrophobicContact CB-CD1 4.42Å; L131-L146 HydrophobicContact CD2-CD1 4.19Å; H142-L146 WeakPolarHBondContact O-CG 3.31Å; H142-L146 PolarHBondContact O-N 3.48Å; R143-L146 PolarHBondContact O-N 3Å; L146-P148 VanDerWaalsContact C-CD 3.44Å; L146-A149 WeakPolarHBondContact O-CB 3.24Å; L146-A149 PolarHBondContact O-N 2.75Å; L146-A149 VanDerWaalsContact O-N 3.08Å; L146-F150 WeakPolarHBondContact O-CD2 3.28Å
147	T	91.6	Very high	89.3	Confident	67 Å²	67	89.9 Å²	89.9	41%	0.411	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-54.5	-41.5	-175.8	-60.7	0	0	0	0	113.8	R143 A149 F150	R143-T147 PolarHBondContact NE-OG1 3.36Å; R143-T147 WeakPolarHBondContact O-CB 3.17Å; R143-T147 PolarHBondContact O-N 3.31Å; R143-T147 PolarHBondContact O-OG1 2.89Å; T147-A149 PolarHBondContact O-N 2.88Å; T147-F150 PolarHBondContact O-N 3.46Å; T147-F150 VanDerWaalsContact O-N 3.14Å
148	P	92.9	Very high	89.1	Confident	83 Å²	83	86.7 Å²	86.7	54%	0.539	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-59.4	-28.5	178.2	-25.8	35.8	0	0	0	114.7	R144 L146 F150 H151	R144-P148 WeakPolarHBondContact O-CD 3.27Å; L146-P148 VanDerWaalsContact C-CD 3.44Å; P148-F150 PolarHBondContact O-N 3.32Å; P148-H151 VanDerWaalsContact O-CB 3.31Å; P148-H151 WeakPolarHBondContact O-CB 3.21Å; P148-H151 PolarHBondContact O-N 3.34Å; P148-H151 VanDerWaalsContact O-N 3.16Å
149	A	88.6	Confident	88.9	Confident	47 Å²	47	84.2 Å²	84.2	39%	0.388	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-68.4	-18.2	179.8	0	0	0	0	0	113.2	L146 T147 I154	L146-A149 WeakPolarHBondContact O-CB 3.24Å; L146-A149 PolarHBondContact O-N 2.75Å; L146-A149 VanDerWaalsContact O-N 3.08Å; T147-A149 PolarHBondContact O-N 2.88Å; A149-I154 WeakPolarHBondContact O-CG2 3.32Å
150	F	90	Very high	88.4	Confident	145 Å²	145	84.8 Å²	84.8	64%	0.636	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-103	14.9	177.2	-58.6	-82.3	0	0	0	112.3	L146 T147 P148	L146-F150 WeakPolarHBondContact O-CD2 3.28Å; T147-F150 PolarHBondContact O-N 3.46Å; T147-F150 VanDerWaalsContact O-N 3.14Å; P148-F150 PolarHBondContact O-N 3.32Å
151	H	88.6	Confident	88.2	Confident	105 Å²	105	82.8 Å²	82.8	49%	0.486	42%	0.423	S	S	.	.	S	Bend	trans	-68.4	143.7	173.9	-168.8	-101.5	0	0	0	110.5	P148 D153 I154 L155	P148-H151 VanDerWaalsContact O-CB 3.31Å; P148-H151 WeakPolarHBondContact O-CB 3.21Å; P148-H151 PolarHBondContact O-N 3.34Å; P148-H151 VanDerWaalsContact O-N 3.16Å; H151-D153 IonicContact CE1-OD2 3.96Å; H151-D153 PolarHBondContact CE1-OD2 3.26Å; H151-D153 PolarHBondContact ND1-N 2.83Å; H151-D153 IonicContact ND1-OD2 3.16Å; H151-D153 PolarHBondContact ND1-OD2 3.12Å; H151-D153 PolarHBondContact O-N 3.2Å; H151-I154 HydrophobicContact CB-CG1 4.46Å; H151-I154 PolarHBondContact O-N 3.39Å; H151-L155 PolarHBondContact O-N 3.44Å; H151-L155 VanDerWaalsContact O-N 3.09Å
152	N	82.9	Confident	88	Confident	104 Å²	104	82.5 Å²	82.5	56%	0.556	42%	0.422	S	S	*	.	H	α-helix	trans	-53	-32.5	-176.3	-74.5	-21.8	0	0	0	113.5	K156	N152-K156 WeakPolarHBondContact O-CG 3.22Å; N152-K156 PolarHBondContact O-N 2.72Å
153	D	83.8	Confident	87.8	Confident	88 Å²	88	80.8 Å²	80.8	47%	0.471	42%	0.421	S	S	.	.	H	α-helix	trans	-69.6	-30.5	177.5	-66.1	-41.4	0	0	0	113.8	H151 K156	H151-D153 IonicContact CE1-OD2 3.96Å; H151-D153 PolarHBondContact CE1-OD2 3.26Å; H151-D153 PolarHBondContact ND1-N 2.83Å; H151-D153 IonicContact ND1-OD2 3.16Å; H151-D153 PolarHBondContact ND1-OD2 3.12Å; H151-D153 PolarHBondContact O-N 3.2Å; D153-K156 WeakPolarHBondContact O-CG 3.15Å; D153-K156 VanDerWaalsContact OD1-CE 3.24Å; D153-K156 WeakPolarHBondContact OD1-CE 3.49Å; D153-K156 IonicContact OD1-NZ 2.64Å; D153-K156 PolarHBondContact OD1-NZ 2.96Å
154	I	86.1	Confident	87.6	Confident	78 Å²	78	79.3 Å²	79.3	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-82.1	-31.3	176.6	-56.1	-59.2	0	0	0	110.9	A149 H151 K156 P157 Y158	A149-I154 WeakPolarHBondContact O-CG2 3.32Å; H151-I154 HydrophobicContact CB-CG1 4.46Å; H151-I154 PolarHBondContact O-N 3.39Å; I154-K156 PolarHBondContact O-N 3.24Å; I154-P157 WeakPolarHBondContact O-CD 2.99Å; I154-Y158 HydrophobicContact CG2-CE2 4.24Å
155	L	84.7	Confident	87.5	Confident	52 Å²	52	70.9 Å²	70.9	27%	0.272	39%	0.389	S	S	.	.	H	α-helix	trans	-72.7	-15.5	176.6	-59.9	179.4	0	0	0	112.7	H151 Y158 W261	H151-L155 PolarHBondContact O-N 3.44Å; H151-L155 VanDerWaalsContact O-N 3.09Å; L155-Y158 HydrophobicContact CD2-CD2 3.71Å; L155-Y158 HydrophobicContact CD2-CE2 3.97Å; L155-Y158 WeakPolarHBondContact O-CB 3.3Å; L155-Y158 PolarHBondContact O-N 3.08Å; L155-Y158 VanDerWaalsContact O-N 3.13Å; L155-W261 WeakPolarHBondContact O-CZ3 3.44Å
156	K	82.1	Confident	87.4	Confident	53 Å²	53	66.8 Å²	66.8	23%	0.23	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-51.6	-177.6	-52.5	-168.8	165.7	157	0	114.2	N152 D153 I154 Y158 W261	N152-K156 WeakPolarHBondContact O-CG 3.22Å; N152-K156 PolarHBondContact O-N 2.72Å; D153-K156 WeakPolarHBondContact O-CG 3.15Å; D153-K156 VanDerWaalsContact OD1-CE 3.24Å; D153-K156 WeakPolarHBondContact OD1-CE 3.49Å; D153-K156 IonicContact OD1-NZ 2.64Å; D153-K156 PolarHBondContact OD1-NZ 2.96Å; I154-K156 PolarHBondContact O-N 3.24Å; K156-Y158 PolarHBondContact O-N 3.41Å; K156-W261 VanDerWaalsContact C-CE3 3.45Å; K156-W261 VanDerWaalsContact CA-CD2 3.44Å; K156-W261 VanDerWaalsContact CA-CE2 3.48Å; K156-W261 VanDerWaalsContact CA-CE3 3.45Å; K156-W261 VanDerWaalsContact CA-CH2 3.44Å; K156-W261 HydrophobicContact CB-CD2 3.53Å; K156-W261 HydrophobicContact CB-CE3 4.1Å; K156-W261 HydrophobicContact CB-CG 3.79Å; K156-W261 HydrophobicContact CB-CH2 4.22Å; K156-W261 HydrophobicContact CB-CZ2 3.78Å; K156-W261 HydrophobicContact CB-CZ3 4.32Å; K156-W261 HydrophobicContact CD-CZ2 4.28Å; K156-W261 HydrophobicContact CG-CD2 4.03Å; K156-W261 HydrophobicContact CG-CG 4.39Å; K156-W261 HydrophobicContact CG-CH2 4.2Å; K156-W261 HydrophobicContact CG-CZ2 3.44Å; K156-W261 VanDerWaalsContact CG-CZ2 3.44Å; K156-W261 VanDerWaalsContact CG-NE1 3.28Å; K156-W261 WeakPolarHBondContact O-CZ3 3.31Å
157	P	82	Confident	87.4	Confident	89 Å²	89	68.6 Å²	68.6	58%	0.578	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-23.9	-178.5	-20.3	36.9	0	0	0	112.5	I154 V159 G160	I154-P157 WeakPolarHBondContact O-CD 2.99Å; P157-V159 VanDerWaalsContact C-N 3.34Å; P157-V159 PolarHBondContact O-N 3.11Å; P157-G160 PolarHBondContact O-N 2.98Å
158	Y	86.3	Confident	87.4	Confident	59 Å²	59	67.1 Å²	67.1	23%	0.231	36%	0.364	C	S	.	.	H	α-helix	trans	-70.9	-23.7	-173	-59.7	-24.7	0	0	0	114.5	I154 L155 K156 G160 L161 M162 S200	I154-Y158 HydrophobicContact CG2-CE2 4.24Å; L155-Y158 HydrophobicContact CD2-CD2 3.71Å; L155-Y158 HydrophobicContact CD2-CE2 3.97Å; L155-Y158 WeakPolarHBondContact O-CB 3.3Å; L155-Y158 PolarHBondContact O-N 3.08Å; L155-Y158 VanDerWaalsContact O-N 3.13Å; K156-Y158 PolarHBondContact O-N 3.41Å; Y158-G160 VanDerWaalsContact C-N 3.27Å; Y158-G160 PolarHBondContact O-N 3.01Å; Y158-L161 HydrophobicContact CD1-CD1 4.06Å; Y158-L161 CarbonylContact O-C 3.39Å; Y158-L161 WeakPolarHBondContact O-CB 3.23Å; Y158-L161 PolarHBondContact O-N 3.01Å; Y158-L161 VanDerWaalsContact O-N 3.11Å; Y158-M162 VanDerWaalsContact O-CG 3.31Å; Y158-M162 WeakPolarHBondContact O-CG 3.06Å; Y158-M162 PolarHBondContact O-N 2.81Å; Y158-S200 VanDerWaalsContact CE1-O 3.27Å; Y158-S200 WeakPolarHBondContact CE1-O 3.36Å; Y158-S200 VanDerWaalsContact CZ-O 3.29Å; Y158-S200 PolarHBondContact OH-O 3.16Å
159	V	83.9	Confident	87.4	Confident	15 Å²	15	63.7 Å²	63.7	9%	0.091	34%	0.341	C	S	.	.	H	α-helix	trans	-65.2	-31.8	176.4	147	0	0	0	0	113	P157 L161 M162 A163 W261 F264	P157-V159 VanDerWaalsContact C-N 3.34Å; P157-V159 PolarHBondContact O-N 3.11Å; V159-L161 VanDerWaalsContact C-N 3.31Å; V159-M162 HydrophobicContact CG2-SD 4.04Å; V159-M162 PolarHBondContact O-N 3.4Å; V159-A163 WeakPolarHBondContact O-CB 3.48Å; V159-A163 PolarHBondContact O-N 2.87Å; V159-W261 HydrophobicContact CB-CE3 3.48Å; V159-W261 VanDerWaalsContact CB-CE3 3.48Å; V159-W261 HydrophobicContact CB-CZ3 3.39Å; V159-W261 HydrophobicContact CG1-CE3 3.92Å; V159-W261 HydrophobicContact CG1-CZ3 4.21Å; V159-W261 HydrophobicContact CG2-CE3 3.79Å; V159-W261 HydrophobicContact CG2-CH2 4.15Å; V159-W261 HydrophobicContact CG2-CZ3 3.18Å; V159-F264 HydrophobicContact CB-CD1 3.99Å; V159-F264 HydrophobicContact CB-CE1 4.03Å; V159-F264 HydrophobicContact CG1-CB 3.79Å; V159-F264 HydrophobicContact CG1-CD1 3.23Å; V159-F264 HydrophobicContact CG1-CD2 3.84Å; V159-F264 HydrophobicContact CG1-CE1 3.57Å; V159-F264 HydrophobicContact CG1-CE2 4.17Å; V159-F264 HydrophobicContact CG1-CG 3.34Å; V159-F264 HydrophobicContact CG1-CZ 4.04Å; V159-F264 HydrophobicContact CG2-CD1 3.57Å; V159-F264 HydrophobicContact CG2-CE1 3.21Å; V159-F264 HydrophobicContact CG2-CG 4.5Å; V159-F264 HydrophobicContact CG2-CZ 3.97Å
160	G	83.6	Confident	87.5	Confident	38 Å²	38	65.6 Å²	65.6	39%	0.392	34%	0.344	S	S	.	.	H	α-helix	trans	-59.5	-48.3	171.6	0	0	0	0	0	110.2	P157 Y158 M162 A163 D164	P157-G160 PolarHBondContact O-N 2.98Å; Y158-G160 VanDerWaalsContact C-N 3.27Å; Y158-G160 PolarHBondContact O-N 3.01Å; G160-M162 PolarHBondContact O-N 3.27Å; G160-A163 PolarHBondContact O-N 3.09Å; G160-D164 VanDerWaalsContact O-CG 3.23Å; G160-D164 PolarHBondContact O-N 3.45Å
161	L	87.1	Confident	87.6	Confident	58 Å²	58	62.5 Å²	62.5	30%	0.304	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-41.7	177	-55	176.1	0	0	0	112.3	Y158 V159 D164 S165 K199	Y158-L161 HydrophobicContact CD1-CD1 4.06Å; Y158-L161 CarbonylContact O-C 3.39Å; Y158-L161 WeakPolarHBondContact O-CB 3.23Å; Y158-L161 PolarHBondContact O-N 3.01Å; Y158-L161 VanDerWaalsContact O-N 3.11Å; V159-L161 VanDerWaalsContact C-N 3.31Å; L161-D164 PolarHBondContact O-N 3.28Å; L161-S165 PolarHBondContact O-N 2.88Å; L161-S165 PolarHBondContact O-OG 2.89Å; L161-K199 HydrophobicContact CB-CB 4.47Å; L161-K199 HydrophobicContact CD1-CB 4.3Å
162	M	88.9	Confident	87.6	Confident	77 Å²	77	60.2 Å²	60.2	38%	0.379	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-47.4	174.8	-68.9	169.4	-174.3	0	0	111.2	Y158 V159 G160 D164 S165 V166 T196	Y158-M162 VanDerWaalsContact O-CG 3.31Å; Y158-M162 WeakPolarHBondContact O-CG 3.06Å; Y158-M162 PolarHBondContact O-N 2.81Å; V159-M162 HydrophobicContact CG2-SD 4.04Å; V159-M162 PolarHBondContact O-N 3.4Å; G160-M162 PolarHBondContact O-N 3.27Å; M162-D164 VanDerWaalsContact C-N 3.31Å; M162-D164 PolarHBondContact O-N 2.84Å; M162-S165 PolarHBondContact O-N 3.07Å; M162-V166 VanDerWaalsContact O-CG2 3.3Å; M162-V166 WeakPolarHBondContact O-CG2 3.49Å; M162-V166 PolarHBondContact O-N 3.16Å; M162-T196 HydrophobicContact CB-CG2 4.31Å; M162-T196 HydrophobicContact CE-CG2 4.42Å; M162-T196 HydrophobicContact CG-CG2 3.47Å; M162-T196 VanDerWaalsContact CG-CG2 3.47Å
163	A	88.3	Confident	88	Confident	36 Å²	36	58 Å²	58	30%	0.298	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-37.9	179.3	0	0	0	0	0	111.8	V159 G160 V166 R167	V159-A163 WeakPolarHBondContact O-CB 3.48Å; V159-A163 PolarHBondContact O-N 2.87Å; G160-A163 PolarHBondContact O-N 3.09Å; A163-V166 PolarHBondContact O-N 3.46Å; A163-R167 WeakPolarHBondContact O-CB 3.4Å; A163-R167 PolarHBondContact O-N 3.45Å
164	D	88.7	Confident	88.2	Confident	74 Å²	74	60.9 Å²	60.9	40%	0.396	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-43.8	176.2	-66.4	-22.7	0	0	0	111.7	G160 L161 M162 V166 R167 V168	G160-D164 VanDerWaalsContact O-CG 3.23Å; G160-D164 PolarHBondContact O-N 3.45Å; L161-D164 PolarHBondContact O-N 3.28Å; M162-D164 VanDerWaalsContact C-N 3.31Å; M162-D164 PolarHBondContact O-N 2.84Å; D164-V166 VanDerWaalsContact C-N 3.34Å; D164-V166 PolarHBondContact O-N 2.75Å; D164-R167 PolarHBondContact O-N 2.85Å; D164-R167 IonicContact OD1-CZ 3.83Å; D164-R167 IonicContact OD1-NH1 2.74Å; D164-R167 PolarHBondContact OD1-NH1 2.9Å; D164-V168 WeakPolarHBondContact O-CG2 3.46Å; D164-V168 PolarHBondContact O-N 2.96Å; D164-V168 VanDerWaalsContact O-N 3.12Å
165	S	91.6	Very high	88.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-38.9	173.6	-71.5	0	0	0	0	112.5	L161 M162 M169 D195 T196 K199 Q209	L161-S165 PolarHBondContact O-N 2.88Å; L161-S165 PolarHBondContact O-OG 2.89Å; M162-S165 PolarHBondContact O-N 3.07Å; S165-M169 PolarHBondContact O-N 3.28Å; S165-D195 WeakPolarHBondContact CB-OD2 3.37Å; S165-D195 PolarHBondContact OG-OD2 2.86Å; S165-T196 VanDerWaalsContact CB-OG1 3.32Å; S165-T196 WeakPolarHBondContact CB-OG1 3.35Å; S165-K199 PolarHBondContact OG-NZ 3.23Å; S165-Q209 PolarHBondContact O-NE2 3.44Å
166	V	91.9	Very high	88.3	Confident	53 Å²	53	64.9 Å²	64.9	32%	0.321	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-41.1	174	169.9	0	0	0	0	111.2	M162 A163 D164 V168 M169 L170 M192	M162-V166 VanDerWaalsContact O-CG2 3.3Å; M162-V166 WeakPolarHBondContact O-CG2 3.49Å; M162-V166 PolarHBondContact O-N 3.16Å; A163-V166 PolarHBondContact O-N 3.46Å; D164-V166 VanDerWaalsContact C-N 3.34Å; D164-V166 PolarHBondContact O-N 2.75Å; V166-V168 PolarHBondContact O-N 3.44Å; V166-M169 WeakPolarHBondContact O-CB 3.37Å; V166-M169 PolarHBondContact O-N 2.96Å; V166-M169 VanDerWaalsContact O-N 3.16Å; V166-L170 HydrophobicContact CG1-CD1 3.89Å; V166-L170 HydrophobicContact CG1-CG 4.19Å; V166-L170 WeakPolarHBondContact O-CG 3.34Å; V166-L170 PolarHBondContact O-N 2.93Å; V166-M192 HydrophobicContact CG2-CE 4.26Å; V166-M192 HydrophobicContact CG2-CG 4.31Å; V166-M192 HydrophobicContact CG2-SD 3.84Å
167	R	91	Very high	88.2	Confident	119 Å²	119	68.3 Å²	68.3	45%	0.449	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-46.6	178.6	-170	178.9	-60.5	104.5	4	111.6	A163 D164 M169 L170 D171	A163-R167 WeakPolarHBondContact O-CB 3.4Å; A163-R167 PolarHBondContact O-N 3.45Å; D164-R167 PolarHBondContact O-N 2.85Å; D164-R167 IonicContact OD1-CZ 3.83Å; D164-R167 IonicContact OD1-NH1 2.74Å; D164-R167 PolarHBondContact OD1-NH1 2.9Å; R167-M169 PolarHBondContact O-N 3.22Å; R167-L170 PolarHBondContact O-N 2.83Å; R167-D171 PolarHBondContact O-N 3.29Å
168	V	91.5	Very high	87.6	Confident	37 Å²	37	67.5 Å²	67.5	22%	0.224	36%	0.362	C	S	.	.	H	α-helix	trans	-56.9	-39.7	175.8	173.8	0	0	0	0	111.9	D164 V166 K172 Q209 V210	D164-V168 WeakPolarHBondContact O-CG2 3.46Å; D164-V168 PolarHBondContact O-N 2.96Å; D164-V168 VanDerWaalsContact O-N 3.12Å; V166-V168 PolarHBondContact O-N 3.44Å; V168-K172 WeakPolarHBondContact O-CG 3.4Å; V168-K172 PolarHBondContact O-N 3.21Å; V168-Q209 HydrophobicContact CG1-CB 4Å; V168-V210 HydrophobicContact CG1-CG1 4.08Å
169	M	93.6	Very high	86.8	Confident	11 Å²	11	71 Å²	71	5%	0.054	38%	0.381	C	S	.	.	H	α-helix	trans	-66.6	-42.3	176.5	-170.4	-177.2	70.1	0	0	111.7	S165 V166 R167 K172 W173 H188 V189 M192	S165-M169 PolarHBondContact O-N 3.28Å; V166-M169 WeakPolarHBondContact O-CB 3.37Å; V166-M169 PolarHBondContact O-N 2.96Å; V166-M169 VanDerWaalsContact O-N 3.16Å; R167-M169 PolarHBondContact O-N 3.22Å; M169-K172 WeakPolarHBondContact O-CB 2.87Å; M169-K172 PolarHBondContact O-N 3.44Å; M169-W173 HydrophobicContact CE-CH2 4.05Å; M169-W173 HydrophobicContact CE-CZ2 4Å; M169-W173 HydrophobicContact CG-CZ2 4.41Å; M169-W173 PolarHBondContact O-N 3.35Å; M169-W173 VanDerWaalsContact O-N 3.09Å; M169-W173 HydrophobicContact SD-CZ2 4.09Å; M169-H188 HydrophobicContact CG-CB 4.18Å; M169-H188 HydrophobicContact SD-CB 4.18Å; M169-V189 HydrophobicContact SD-CG2 4.17Å; M169-M192 HydrophobicContact CB-CB 4.25Å; M169-M192 HydrophobicContact CB-CG 4.22Å; M169-M192 HydrophobicContact CE-CE 4.4Å; M169-M192 HydrophobicContact CG-CB 4.36Å; M169-M192 HydrophobicContact SD-CB 3.66Å; M169-M192 HydrophobicContact SD-CE 4.37Å; M169-M192 HydrophobicContact SD-CG 4.01Å
170	L	91.6	Very high	86.4	Confident	86 Å²	86	78.2 Å²	78.2	45%	0.45	42%	0.419	S	S	.	.	H	α-helix	trans	-68.3	-38.5	179.9	-68.8	176.3	0	0	0	112.4	V166 R167 K172 W173 E174	V166-L170 HydrophobicContact CG1-CD1 3.89Å; V166-L170 HydrophobicContact CG1-CG 4.19Å; V166-L170 WeakPolarHBondContact O-CG 3.34Å; V166-L170 PolarHBondContact O-N 2.93Å; R167-L170 PolarHBondContact O-N 2.83Å; L170-K172 VanDerWaalsContact C-N 3.27Å; L170-K172 PolarHBondContact O-N 2.82Å; L170-W173 HydrophobicContact CD2-CE3 3.97Å; L170-W173 HydrophobicContact CD2-CZ3 4.39Å; L170-W173 PolarHBondContact O-N 3.05Å; L170-W173 VanDerWaalsContact O-N 3.1Å; L170-E174 PolarHBondContact O-N 3.03Å
171	D	90.9	Very high	86.2	Confident	80 Å²	80	79.7 Å²	79.7	43%	0.428	42%	0.423	S	S	.	.	H	α-helix	trans	-59.9	-41	175.7	-62.3	-21.5	0	0	0	110.2	R167 E174 E175	R167-D171 PolarHBondContact O-N 3.29Å; D171-E174 PolarHBondContact O-N 3.29Å; D171-E175 PolarHBondContact O-N 2.64Å
172	K	89.3	Confident	86.1	Confident	57 Å²	57	83.3 Å²	83.3	25%	0.248	45%	0.45	C	S	.	.	H	α-helix	trans	-63.6	-40.5	173	-72	175.7	162.3	-132.5	0	113	V168 M169 L170 E174 E175 L176 Q209	V168-K172 WeakPolarHBondContact O-CG 3.4Å; V168-K172 PolarHBondContact O-N 3.21Å; M169-K172 WeakPolarHBondContact O-CB 2.87Å; M169-K172 PolarHBondContact O-N 3.44Å; L170-K172 VanDerWaalsContact C-N 3.27Å; L170-K172 PolarHBondContact O-N 2.82Å; K172-E174 VanDerWaalsContact C-N 3.31Å; K172-E175 PolarHBondContact O-N 3.39Å; K172-L176 VanDerWaalsContact O-CG 3.31Å; K172-L176 WeakPolarHBondContact O-CG 3.36Å; K172-L176 PolarHBondContact O-N 3.39Å; K172-L176 VanDerWaalsContact O-N 3.14Å; K172-Q209 WeakPolarHBondContact CE-O 3.32Å; K172-Q209 PolarHBondContact NZ-O 3.21Å
173	W	90.6	Very high	86	Confident	58 Å²	58	82.4 Å²	82.4	22%	0.22	45%	0.447	C	S	.	.	H	α-helix	trans	-65.8	-37.1	177.3	-71	4.2	0	0	0	111.2	M169 L170 E175 L176 L177 L183 V185 H188	M169-W173 HydrophobicContact CE-CH2 4.05Å; M169-W173 HydrophobicContact CE-CZ2 4Å; M169-W173 HydrophobicContact CG-CZ2 4.41Å; M169-W173 PolarHBondContact O-N 3.35Å; M169-W173 VanDerWaalsContact O-N 3.09Å; M169-W173 HydrophobicContact SD-CZ2 4.09Å; L170-W173 HydrophobicContact CD2-CE3 3.97Å; L170-W173 HydrophobicContact CD2-CZ3 4.39Å; L170-W173 PolarHBondContact O-N 3.05Å; L170-W173 VanDerWaalsContact O-N 3.1Å; W173-E175 VanDerWaalsContact C-N 3.3Å; W173-E175 PolarHBondContact O-N 3.46Å; W173-L176 PolarHBondContact O-N 2.93Å; W173-L177 WeakPolarHBondContact O-CB 3.44Å; W173-L177 WeakPolarHBondContact O-CG 3.25Å; W173-L177 PolarHBondContact O-N 2.94Å; W173-L183 HydrophobicContact CB-CD2 4.31Å; W173-L183 HydrophobicContact CD2-CD2 3.89Å; W173-L183 HydrophobicContact CG-CD2 3.71Å; W173-V185 HydrophobicContact CH2-CB 4.45Å; W173-V185 HydrophobicContact CH2-CG1 3.98Å; W173-V185 HydrophobicContact CZ2-CB 4.19Å; W173-V185 HydrophobicContact CZ2-CG1 3.89Å; W173-H188 AromaticContact CD1-ND1 3.64Å; W173-H188 HydrophobicContact CZ2-CB 4.21Å; W173-H188 AromaticContact NE1-CG 3.4Å; W173-H188 AromaticContact NE1-ND1 3.27Å; W173-H188 PolarHBondContact NE1-ND1 2.94Å
174	E	89.2	Confident	86	Confident	149 Å²	149	85.6 Å²	85.6	70%	0.696	46%	0.455	S	S	*	.	H	α-helix	trans	-61.5	-37.3	175.9	-169	166.3	-163.2	0	0	112.1	L170 D171 K172	L170-E174 PolarHBondContact O-N 3.03Å; D171-E174 PolarHBondContact O-N 3.29Å; K172-E174 VanDerWaalsContact C-N 3.31Å
175	E	87.1	Confident	86.1	Confident	154 Å²	154	84.8 Å²	84.8	72%	0.72	45%	0.453	S	S	*	.	H	α-helix	trans	-68.3	-39.1	173.7	-67.5	176.7	-179.9	0	0	113	D171 K172 W173	D171-E175 PolarHBondContact O-N 2.64Å; K172-E175 PolarHBondContact O-N 3.39Å; W173-E175 VanDerWaalsContact C-N 3.3Å; W173-E175 PolarHBondContact O-N 3.46Å
176	L	84.8	Confident	86	Confident	60 Å²	60	91.6 Å²	91.6	31%	0.314	48%	0.483	S	S	.	.	H	α-helix	trans	-77.3	-28.4	-178	-67.3	172	0	0	0	113.1	K172 W173 G178 Q179 L183	K172-L176 VanDerWaalsContact O-CG 3.31Å; K172-L176 WeakPolarHBondContact O-CG 3.36Å; K172-L176 PolarHBondContact O-N 3.39Å; K172-L176 VanDerWaalsContact O-N 3.14Å; W173-L176 PolarHBondContact O-N 2.93Å; L176-G178 PolarHBondContact O-N 3.39Å; L176-G178 VanDerWaalsContact O-N 3.14Å; L176-Q179 WeakPolarHBondContact O-CB 3.33Å; L176-Q179 PolarHBondContact O-N 3.48Å; L176-Q179 VanDerWaalsContact O-N 3.17Å; L176-L183 HydrophobicContact CB-CD1 4.44Å; L176-L183 HydrophobicContact CD1-CD1 3.75Å
177	L	79.6	Confident	85.9	Confident	125 Å²	125	94.3 Å²	94.3	65%	0.654	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-65.8	-13.3	178.5	-77.1	168.2	0	0	0	113.6	W173 Q179	W173-L177 WeakPolarHBondContact O-CB 3.44Å; W173-L177 WeakPolarHBondContact O-CG 3.25Å; W173-L177 PolarHBondContact O-N 2.94Å; L177-Q179 PolarHBondContact O-N 2.88Å
178	G	70.7	Confident	86	Confident	72 Å²	72	90.5 Å²	90.5	74%	0.742	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-68.3	-4.5	171.5	0	0	0	0	0	114.7	L176	L176-G178 PolarHBondContact O-N 3.39Å; L176-G178 VanDerWaalsContact O-N 3.14Å
179	Q	69.7	Low	86.1	Confident	132 Å²	132	91.4 Å²	91.4	62%	0.617	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-109.7	1	-168.9	-56.6	-178.1	7.8	0	0	114.9	L176 L177 S181	L176-Q179 WeakPolarHBondContact O-CB 3.33Å; L176-Q179 PolarHBondContact O-N 3.48Å; L176-Q179 VanDerWaalsContact O-N 3.17Å; L177-Q179 PolarHBondContact O-N 2.88Å; Q179-S181 PolarHBondContact O-N 3.34Å
180	D	74.8	Confident	86.1	Confident	167 Å²	167	93.2 Å²	93.2	89%	0.893	50%	0.499	S	S	*	.			trans	50.2	23.3	179.8	-88.6	-18.8	0	0	0	115.3
181	S	80.1	Confident	86.1	Confident	69 Å²	69	90.5 Å²	90.5	48%	0.483	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-101.2	149.2	179	58.7	0	0	0	0	112	Q179 L183	Q179-S181 PolarHBondContact O-N 3.34Å; S181-L183 PolarHBondContact O-N 3.47Å
182	P	84.9	Confident	86.3	Confident	133 Å²	133	88 Å²	88	86%	0.864	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-57.5	130.7	169.3	-22.4	33.1	0	0	0	110.8
183	L	85.9	Confident	86.5	Confident	59 Å²	59	88.4 Å²	88.4	31%	0.309	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-98.7	119.5	179.5	-177.5	65.7	0	0	0	110.5	W173 L176 S181 V185	W173-L183 HydrophobicContact CB-CD2 4.31Å; W173-L183 HydrophobicContact CD2-CD2 3.89Å; W173-L183 HydrophobicContact CG-CD2 3.71Å; L176-L183 HydrophobicContact CB-CD1 4.44Å; L176-L183 HydrophobicContact CD1-CD1 3.75Å; S181-L183 PolarHBondContact O-N 3.47Å; L183-V185 PolarHBondContact O-N 2.94Å
184	E	88.1	Confident	86.6	Confident	102 Å²	102	88.8 Å²	88.8	48%	0.477	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-69.2	121.2	168.9	-161.4	-58.8	106.5	0	0	108.8	F186 Q187 H188	E184-F186 VanDerWaalsContact CD-N 3.34Å; E184-F186 WeakPolarHBondContact OE1-CA 3.36Å; E184-F186 WeakPolarHBondContact OE1-CB 3.3Å; E184-F186 PolarHBondContact OE1-N 3.35Å; E184-F186 PolarHBondContact OE2-N 3.36Å; E184-Q187 WeakPolarHBondContact OE2-CB 3.36Å; E184-Q187 PolarHBondContact OE2-N 2.92Å; E184-H188 PolarHBondContact O-CD2 2.73Å
185	V	91.6	Very high	86.7	Confident	58 Å²	58	81.7 Å²	81.7	35%	0.352	45%	0.451	S	S	.	.			trans	-99.1	-23	-172.3	-64.5	0	0	0	0	113.9	W173 L183 Q187 H188 V189	W173-V185 HydrophobicContact CH2-CB 4.45Å; W173-V185 HydrophobicContact CH2-CG1 3.98Å; W173-V185 HydrophobicContact CZ2-CB 4.19Å; W173-V185 HydrophobicContact CZ2-CG1 3.89Å; L183-V185 PolarHBondContact O-N 2.94Å; V185-Q187 PolarHBondContact O-N 3.05Å; V185-H188 PolarHBondContact O-N 2.64Å; V185-V189 WeakPolarHBondContact O-CB 3.46Å; V185-V189 VanDerWaalsContact O-CG2 3.27Å; V185-V189 WeakPolarHBondContact O-CG2 3.26Å; V185-V189 PolarHBondContact O-N 2.64Å
186	F	90.2	Very high	87	Confident	143 Å²	143	75.2 Å²	75.2	63%	0.627	42%	0.421	S	S	*	.	H	α-helix	trans	-60.8	-46.3	-174.2	-178	-97.7	0	0	0	111.8	E184 S190	E184-F186 VanDerWaalsContact CD-N 3.34Å; E184-F186 WeakPolarHBondContact OE1-CA 3.36Å; E184-F186 WeakPolarHBondContact OE1-CB 3.3Å; E184-F186 PolarHBondContact OE1-N 3.35Å; E184-F186 PolarHBondContact OE2-N 3.36Å; F186-S190 WeakPolarHBondContact O-CB 3.3Å; F186-S190 PolarHBondContact O-N 2.97Å; F186-S190 PolarHBondContact O-OG 3.46Å
187	Q	89.9	Confident	87.3	Confident	110 Å²	110	76.4 Å²	76.4	51%	0.514	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-44.2	179	-176.9	173.5	-7	0	0	111.3	E184 V185 S190 L191	E184-Q187 WeakPolarHBondContact OE2-CB 3.36Å; E184-Q187 PolarHBondContact OE2-N 2.92Å; V185-Q187 PolarHBondContact O-N 3.05Å; Q187-S190 PolarHBondContact O-N 3.15Å; Q187-L191 HydrophobicContact CG-CD1 4.26Å; Q187-L191 WeakPolarHBondContact O-CG 3.04Å; Q187-L191 PolarHBondContact O-N 3.17Å
188	H	92.3	Very high	87.9	Confident	38 Å²	38	72.9 Å²	72.9	18%	0.176	41%	0.408	C	S	.	.	H	α-helix	trans	-62.9	-48.6	179.1	-71.7	-103.6	0	0	0	111.6	M169 W173 E184 V185 S190 L191 M192	M169-H188 HydrophobicContact CG-CB 4.18Å; M169-H188 HydrophobicContact SD-CB 4.18Å; W173-H188 AromaticContact CD1-ND1 3.64Å; W173-H188 HydrophobicContact CZ2-CB 4.21Å; W173-H188 AromaticContact NE1-CG 3.4Å; W173-H188 AromaticContact NE1-ND1 3.27Å; W173-H188 PolarHBondContact NE1-ND1 2.94Å; E184-H188 PolarHBondContact O-CD2 2.73Å; V185-H188 PolarHBondContact O-N 2.64Å; H188-S190 VanDerWaalsContact C-N 3.32Å; H188-S190 PolarHBondContact O-N 2.59Å; H188-L191 PolarHBondContact O-N 3.01Å; H188-M192 WeakPolarHBondContact O-CB 3.11Å; H188-M192 PolarHBondContact O-N 3.49Å
189	V	93.9	Very high	88.9	Confident	56 Å²	56	71 Å²	71	34%	0.339	38%	0.38	S	S	.	.	H	α-helix	trans	-64	-38.1	177.9	172.5	0	0	0	0	111.2	M169 V185 M192 T193	M169-V189 HydrophobicContact SD-CG2 4.17Å; V185-V189 WeakPolarHBondContact O-CB 3.46Å; V185-V189 VanDerWaalsContact O-CG2 3.27Å; V185-V189 WeakPolarHBondContact O-CG2 3.26Å; V185-V189 PolarHBondContact O-N 2.64Å; V189-M192 HydrophobicContact CG1-CE 4.39Å; V189-M192 PolarHBondContact O-N 2.7Å; V189-T193 VanDerWaalsContact O-CB 3.32Å; V189-T193 WeakPolarHBondContact O-CB 3.22Å; V189-T193 PolarHBondContact O-N 3.46Å; V189-T193 PolarHBondContact O-OG1 2.56Å
190	S	92.1	Very high	89.8	Confident	50 Å²	50	65.3 Å²	65.3	35%	0.35	35%	0.354	S	S	.	.	H	α-helix	trans	-64	-44.9	176.8	-66.7	0	0	0	0	112.1	F186 Q187 H188 T193 L194	F186-S190 WeakPolarHBondContact O-CB 3.3Å; F186-S190 PolarHBondContact O-N 2.97Å; F186-S190 PolarHBondContact O-OG 3.46Å; Q187-S190 PolarHBondContact O-N 3.15Å; H188-S190 VanDerWaalsContact C-N 3.32Å; H188-S190 PolarHBondContact O-N 2.59Å; S190-T193 PolarHBondContact O-N 3.47Å; S190-L194 WeakPolarHBondContact O-CB 3.17Å; S190-L194 PolarHBondContact O-N 3.31Å
191	L	92.7	Very high	90.5	Very high	29 Å²	29	60.5 Å²	60.5	15%	0.152	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-42.3	176.5	-70.6	172.4	0	0	0	111.7	Q187 H188 T193 L194 D195 Q209	Q187-L191 HydrophobicContact CG-CD1 4.26Å; Q187-L191 WeakPolarHBondContact O-CG 3.04Å; Q187-L191 PolarHBondContact O-N 3.17Å; H188-L191 PolarHBondContact O-N 3.01Å; L191-T193 VanDerWaalsContact C-N 3.33Å; L191-T193 PolarHBondContact O-N 3.36Å; L191-L194 PolarHBondContact O-N 3.41Å; L191-D195 VanDerWaalsContact O-CB 3.25Å; L191-D195 WeakPolarHBondContact O-CB 3.45Å; L191-D195 PolarHBondContact O-N 2.66Å; L191-Q209 HydrophobicContact CB-CG 4.15Å
192	M	94.4	Very high	91	Very high	27 Å²	27	64 Å²	64	13%	0.133	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-41.5	175	178.8	-79.4	-67.4	0	0	111.9	V166 M169 H188 V189 D195 T196	V166-M192 HydrophobicContact CG2-CE 4.26Å; V166-M192 HydrophobicContact CG2-CG 4.31Å; V166-M192 HydrophobicContact CG2-SD 3.84Å; M169-M192 HydrophobicContact CB-CB 4.25Å; M169-M192 HydrophobicContact CB-CG 4.22Å; M169-M192 HydrophobicContact CE-CE 4.4Å; M169-M192 HydrophobicContact CG-CB 4.36Å; M169-M192 HydrophobicContact SD-CB 3.66Å; M169-M192 HydrophobicContact SD-CE 4.37Å; M169-M192 HydrophobicContact SD-CG 4.01Å; H188-M192 WeakPolarHBondContact O-CB 3.11Å; H188-M192 PolarHBondContact O-N 3.49Å; V189-M192 HydrophobicContact CG1-CE 4.39Å; V189-M192 PolarHBondContact O-N 2.7Å; M192-D195 PolarHBondContact O-N 3.26Å; M192-T196 WeakPolarHBondContact O-CB 3.38Å; M192-T196 PolarHBondContact O-N 2.88Å; M192-T196 PolarHBondContact O-OG1 3.04Å
193	T	93.7	Very high	91.2	Very high	65 Å²	65	61.9 Å²	61.9	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-44.7	177	-58.2	0	0	0	0	111.3	V189 S190 L191 T196 I197	V189-T193 VanDerWaalsContact O-CB 3.32Å; V189-T193 WeakPolarHBondContact O-CB 3.22Å; V189-T193 PolarHBondContact O-N 3.46Å; V189-T193 PolarHBondContact O-OG1 2.56Å; S190-T193 PolarHBondContact O-N 3.47Å; L191-T193 VanDerWaalsContact C-N 3.33Å; L191-T193 PolarHBondContact O-N 3.36Å; T193-T196 WeakPolarHBondContact O-CB 3.39Å; T193-T196 PolarHBondContact O-N 3.08Å; T193-I197 HydrophobicContact CG2-CD1 4.13Å; T193-I197 WeakPolarHBondContact O-CG1 3.39Å; T193-I197 PolarHBondContact O-N 2.88Å
194	L	92.8	Very high	91.3	Very high	67 Å²	67	62.3 Å²	62.3	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-62.1	-46.2	176.8	178	60.9	0	0	0	111.6	S190 L191 T196 I197 M198 I208	S190-L194 WeakPolarHBondContact O-CB 3.17Å; S190-L194 PolarHBondContact O-N 3.31Å; L191-L194 PolarHBondContact O-N 3.41Å; L194-T196 VanDerWaalsContact C-N 3.33Å; L194-T196 PolarHBondContact O-N 3.21Å; L194-I197 PolarHBondContact O-N 2.82Å; L194-M198 HydrophobicContact CD1-CG 4.09Å; L194-M198 HydrophobicContact CG-CG 4.4Å; L194-M198 WeakPolarHBondContact O-CB 3.39Å; L194-M198 VanDerWaalsContact O-CG 3.27Å; L194-M198 WeakPolarHBondContact O-CG 3.34Å; L194-M198 PolarHBondContact O-N 3.23Å; L194-I208 HydrophobicContact CD2-CG2 4.25Å; L194-I208 HydrophobicContact CG-CD1 4.22Å
195	D	92.1	Very high	91	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.8	-44.9	177.4	-175.6	58.4	0	0	0	111.5	S165 L191 M192 I197 M198 K199 S207 I208 Q209	S165-D195 WeakPolarHBondContact CB-OD2 3.37Å; S165-D195 PolarHBondContact OG-OD2 2.86Å; L191-D195 VanDerWaalsContact O-CB 3.25Å; L191-D195 WeakPolarHBondContact O-CB 3.45Å; L191-D195 PolarHBondContact O-N 2.66Å; M192-D195 PolarHBondContact O-N 3.26Å; D195-I197 PolarHBondContact O-N 3.36Å; D195-M198 PolarHBondContact O-N 3.14Å; D195-K199 WeakPolarHBondContact O-CB 3.2Å; D195-K199 WeakPolarHBondContact O-CG 3.21Å; D195-K199 PolarHBondContact O-N 3.21Å; D195-K199 WeakPolarHBondContact OD1-CE 3.46Å; D195-K199 IonicContact OD1-NZ 3.98Å; D195-K199 WeakPolarHBondContact OD2-CE 3.32Å; D195-K199 IonicContact OD2-NZ 2.69Å; D195-K199 PolarHBondContact OD2-NZ 2.93Å; D195-S207 WeakPolarHBondContact OD1-CA 3.33Å; D195-I208 HydrophobicContact CB-CB 4.41Å; D195-I208 PolarHBondContact OD1-N 3.08Å; D195-Q209 HydrophobicContact CB-CG 4.1Å; D195-Q209 PolarHBondContact OD2-NE2 3.34Å
196	T	92.3	Very high	90.5	Very high	17 Å²	17	64.6 Å²	64.6	10%	0.104	35%	0.35	C	S	.	.	H	α-helix	trans	-57.8	-46.5	174.5	-63.2	0	0	0	0	112	M162 S165 M192 T193 L194 S200	M162-T196 HydrophobicContact CB-CG2 4.31Å; M162-T196 HydrophobicContact CE-CG2 4.42Å; M162-T196 HydrophobicContact CG-CG2 3.47Å; M162-T196 VanDerWaalsContact CG-CG2 3.47Å; S165-T196 VanDerWaalsContact CB-OG1 3.32Å; S165-T196 WeakPolarHBondContact CB-OG1 3.35Å; M192-T196 WeakPolarHBondContact O-CB 3.38Å; M192-T196 PolarHBondContact O-N 2.88Å; M192-T196 PolarHBondContact O-OG1 3.04Å; T193-T196 WeakPolarHBondContact O-CB 3.39Å; T193-T196 PolarHBondContact O-N 3.08Å; L194-T196 VanDerWaalsContact C-N 3.33Å; L194-T196 PolarHBondContact O-N 3.21Å; T196-S200 VanDerWaalsContact O-CB 3.22Å; T196-S200 WeakPolarHBondContact O-CB 3.39Å; T196-S200 PolarHBondContact O-N 3.22Å; T196-S200 PolarHBondContact O-OG 2.95Å
197	I	92.3	Very high	90	Very high	85 Å²	85	58.6 Å²	58.6	44%	0.436	33%	0.325	S	S	.	.	H	α-helix	trans	-65.1	-43.8	179	-69.7	166.9	0	0	0	110.5	T193 L194 D195 S200 A201 F202	T193-I197 HydrophobicContact CG2-CD1 4.13Å; T193-I197 WeakPolarHBondContact O-CG1 3.39Å; T193-I197 PolarHBondContact O-N 2.88Å; L194-I197 PolarHBondContact O-N 2.82Å; D195-I197 PolarHBondContact O-N 3.36Å; I197-S200 PolarHBondContact O-N 3.36Å; I197-A201 HydrophobicContact CG2-CB 4.43Å; I197-A201 WeakPolarHBondContact O-CB 3.47Å; I197-A201 PolarHBondContact O-N 3.06Å; I197-F202 HydrophobicContact CG2-CD2 4.49Å; I197-F202 HydrophobicContact CG2-CE2 4.2Å
198	M	92.3	Very high	89.8	Confident	52 Å²	52	54.6 Å²	54.6	26%	0.256	31%	0.308	S	S	.	.	H	α-helix	trans	-63.9	-42.7	-179	-73.1	-66.3	-59.5	0	0	111.9	L194 D195 F202 S203 H204 I208	L194-M198 HydrophobicContact CD1-CG 4.09Å; L194-M198 HydrophobicContact CG-CG 4.4Å; L194-M198 WeakPolarHBondContact O-CB 3.39Å; L194-M198 VanDerWaalsContact O-CG 3.27Å; L194-M198 WeakPolarHBondContact O-CG 3.34Å; L194-M198 PolarHBondContact O-N 3.23Å; D195-M198 PolarHBondContact O-N 3.14Å; M198-F202 HydrophobicContact CE-CB 4.47Å; M198-F202 CarbonylContact O-C 3.39Å; M198-F202 WeakPolarHBondContact O-CA 3.4Å; M198-F202 WeakPolarHBondContact O-CB 3.49Å; M198-F202 PolarHBondContact O-N 2.85Å; M198-F202 HydrophobicContact SD-CD2 3.77Å; M198-F202 HydrophobicContact SD-CE2 4.34Å; M198-F202 HydrophobicContact SD-CG 4.34Å; M198-S203 PolarHBondContact O-N 2.91Å; M198-H204 HydrophobicContact CB-CB 3.93Å; M198-H204 HydrophobicContact CE-CB 4.14Å; M198-H204 VanDerWaalsContact O-CB 3.31Å; M198-H204 WeakPolarHBondContact O-CB 3.27Å; M198-H204 PolarHBondContact O-N 2.82Å; M198-I208 HydrophobicContact CB-CD1 3.8Å; M198-I208 HydrophobicContact CG-CD1 3.52Å
199	K	90.4	Very high	89.6	Confident	33 Å²	33	53.1 Å²	53.1	14%	0.143	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-45.1	174.3	-70.9	171.5	177.7	168	0	112.2	L161 S165 D195 S203 G206	L161-K199 HydrophobicContact CB-CB 4.47Å; L161-K199 HydrophobicContact CD1-CB 4.3Å; S165-K199 PolarHBondContact OG-NZ 3.23Å; D195-K199 WeakPolarHBondContact O-CB 3.2Å; D195-K199 WeakPolarHBondContact O-CG 3.21Å; D195-K199 PolarHBondContact O-N 3.21Å; D195-K199 WeakPolarHBondContact OD1-CE 3.46Å; D195-K199 IonicContact OD1-NZ 3.98Å; D195-K199 WeakPolarHBondContact OD2-CE 3.32Å; D195-K199 IonicContact OD2-NZ 2.69Å; D195-K199 PolarHBondContact OD2-NZ 2.93Å; K199-S203 WeakPolarHBondContact O-CA 3.18Å; K199-S203 PolarHBondContact O-N 2.78Å; K199-G206 WeakPolarHBondContact CE-O 3.32Å
200	S	89.7	Confident	89	Confident	11 Å²	11	54.4 Å²	54.4	8%	0.077	31%	0.309	C	S	.	.	H	α-helix	trans	-78.8	-47.5	-171.6	-53.9	0	0	0	0	113.2	Y158 T196 I197	Y158-S200 VanDerWaalsContact CE1-O 3.27Å; Y158-S200 WeakPolarHBondContact CE1-O 3.36Å; Y158-S200 VanDerWaalsContact CZ-O 3.29Å; Y158-S200 PolarHBondContact OH-O 3.16Å; T196-S200 VanDerWaalsContact O-CB 3.22Å; T196-S200 WeakPolarHBondContact O-CB 3.39Å; T196-S200 PolarHBondContact O-N 3.22Å; T196-S200 PolarHBondContact O-OG 2.95Å; I197-S200 PolarHBondContact O-N 3.36Å
201	A	88.8	Confident	87.9	Confident	66 Å²	66	57.2 Å²	57.2	55%	0.545	32%	0.32	S	S	.	.	H	α-helix	trans	-92.6	-26.7	-173	0	0	0	0	0	113.5	I197	I197-A201 HydrophobicContact CG2-CB 4.43Å; I197-A201 WeakPolarHBondContact O-CB 3.47Å; I197-A201 PolarHBondContact O-N 3.06Å
202	F	90.1	Very high	86.3	Confident	142 Å²	142	63.2 Å²	63.2	62%	0.623	34%	0.34	S	S	*	.	H	α-helix	trans	-118.2	4	-174.6	-60.5	-80.2	0	0	0	113.6	I197 M198 H204	I197-F202 HydrophobicContact CG2-CD2 4.49Å; I197-F202 HydrophobicContact CG2-CE2 4.2Å; M198-F202 HydrophobicContact CE-CB 4.47Å; M198-F202 CarbonylContact O-C 3.39Å; M198-F202 WeakPolarHBondContact O-CA 3.4Å; M198-F202 WeakPolarHBondContact O-CB 3.49Å; M198-F202 PolarHBondContact O-N 2.85Å; M198-F202 HydrophobicContact SD-CD2 3.77Å; M198-F202 HydrophobicContact SD-CE2 4.34Å; M198-F202 HydrophobicContact SD-CG 4.34Å; F202-H204 PolarHBondContact O-N 2.82Å; F202-H204 VanDerWaalsContact O-N 3.12Å
203	S	89.4	Confident	84	Confident	90 Å²	90	67.5 Å²	67.5	63%	0.629	37%	0.37	S	S	*	.			trans	53	31.7	-179.5	-56.2	0	0	0	0	113.5	M198 K199	M198-S203 PolarHBondContact O-N 2.91Å; K199-S203 WeakPolarHBondContact O-CA 3.18Å; K199-S203 PolarHBondContact O-N 2.78Å
204	H	88.8	Confident	81.7	Confident	68 Å²	68	70 Å²	70	32%	0.315	39%	0.391	S	S	.	.			trans	-64	135.4	-179.7	-177.4	65.2	0	0	0	111	M198 F202	M198-H204 HydrophobicContact CB-CB 3.93Å; M198-H204 HydrophobicContact CE-CB 4.14Å; M198-H204 VanDerWaalsContact O-CB 3.31Å; M198-H204 WeakPolarHBondContact O-CB 3.27Å; M198-H204 PolarHBondContact O-N 2.82Å; F202-H204 PolarHBondContact O-N 2.82Å; F202-H204 VanDerWaalsContact O-N 3.12Å
205	Q	82.1	Confident	79.1	Confident	171 Å²	171	71 Å²	71	80%	0.799	40%	0.396	S	S	*	.			trans	-102.9	112.7	176.8	-58.7	-62.8	-31	0	0	108
206	G	79.8	Confident	76.5	Confident	37 Å²	37	76.4 Å²	76.4	38%	0.381	43%	0.431	S	S	.	.	S	Bend	trans	142.9	-176.8	-176.1	0	0	0	0	0	112.4	K199	K199-G206 WeakPolarHBondContact CE-O 3.32Å
207	S	80.8	Confident	73.8	Confident	16 Å²	16	81 Å²	81	11%	0.112	46%	0.46	C	S	.	.			trans	-135.2	104.8	174.2	176.9	0	0	0	0	109.7	D195 Q209 V210 D211	D195-S207 WeakPolarHBondContact OD1-CA 3.33Å; S207-Q209 PolarHBondContact O-N 3.04Å; S207-V210 VanDerWaalsContact O-CG2 3.3Å; S207-V210 WeakPolarHBondContact O-CG2 3.31Å; S207-V210 PolarHBondContact O-N 3.17Å; S207-D211 PolarHBondContact N-OD2 2.89Å; S207-D211 VanDerWaalsContact O-CG 3.28Å; S207-D211 PolarHBondContact O-N 2.98Å; S207-D211 VanDerWaalsContact O-N 3.1Å; S207-D211 VanDerWaalsContact O-OD2 3.05Å
208	I	84.5	Confident	71.1	Confident	27 Å²	27	85.1 Å²	85.1	14%	0.138	48%	0.477	C	S	.	.	H	α-helix	trans	-61	-22.9	-178.4	-61.5	172.3	0	0	0	111.1	L194 D195 M198 V210	L194-I208 HydrophobicContact CD2-CG2 4.25Å; L194-I208 HydrophobicContact CG-CD1 4.22Å; D195-I208 HydrophobicContact CB-CB 4.41Å; D195-I208 PolarHBondContact OD1-N 3.08Å; M198-I208 HydrophobicContact CB-CD1 3.8Å; M198-I208 HydrophobicContact CG-CD1 3.52Å; I208-V210 VanDerWaalsContact C-N 3.3Å; I208-V210 PolarHBondContact O-N 3.42Å
209	Q	87.8	Confident	68.3	Low	7 Å²	7	92.1 Å²	92.1	3%	0.033	51%	0.509	C	S	.	.	H	α-helix	trans	-63.7	-34.4	175.7	-61.3	-176.6	65.1	0	0	112.1	S165 V168 K172 L191 D195 S207	S165-Q209 PolarHBondContact O-NE2 3.44Å; V168-Q209 HydrophobicContact CG1-CB 4Å; K172-Q209 WeakPolarHBondContact CE-O 3.32Å; K172-Q209 PolarHBondContact NZ-O 3.21Å; L191-Q209 HydrophobicContact CB-CG 4.15Å; D195-Q209 HydrophobicContact CB-CG 4.1Å; D195-Q209 PolarHBondContact OD2-NE2 3.34Å; S207-Q209 PolarHBondContact O-N 3.04Å
210	V	83	Confident	65.4	Low	83 Å²	83	93.8 Å²	93.8	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-100	-25.4	-178.6	-54.9	0	0	0	0	113.1	V168 S207 I208 R212	V168-V210 HydrophobicContact CG1-CG1 4.08Å; S207-V210 VanDerWaalsContact O-CG2 3.3Å; S207-V210 WeakPolarHBondContact O-CG2 3.31Å; S207-V210 PolarHBondContact O-N 3.17Å; I208-V210 VanDerWaalsContact C-N 3.3Å; I208-V210 PolarHBondContact O-N 3.42Å; V210-R212 VanDerWaalsContact C-N 3.34Å; V210-R212 PolarHBondContact O-N 3.19Å
211	D	69.2	Low	62.5	Low	109 Å²	109	98.9 Å²	98.9	58%	0.583	57%	0.571	S	S	*	*	H	α-helix	trans	-80.4	-11.8	-172.8	-63.2	-34.3	0	0	0	113.9	S207	S207-D211 PolarHBondContact N-OD2 2.89Å; S207-D211 VanDerWaalsContact O-CG 3.28Å; S207-D211 PolarHBondContact O-N 2.98Å; S207-D211 VanDerWaalsContact O-N 3.1Å; S207-D211 VanDerWaalsContact O-OD2 3.05Å
212	R	58.9	Low	59.6	Low	154 Å²	154	102 Å²	102	58%	0.581	58%	0.583	S	S	*	*	S	Bend	trans	-88	134.2	171.8	-90.6	-173.4	174.9	169.7	-1.3	110.9	V210 S214	V210-R212 VanDerWaalsContact C-N 3.34Å; V210-R212 PolarHBondContact O-N 3.19Å; R212-S214 PolarHBondContact O-N 3.23Å
213	P	45.3	Very low	56.7	Low	118 Å²	118	101.9 Å²	101.9	77%	0.766	59%	0.594	S	S	*	*			trans	-56.5	127	166.1	-14.2	26.5	0	0	0	108.6	D215	P213-D215 PolarHBondContact O-N 3.1Å
214	S	45.5	Very low	53.8	Low	118 Å²	118	107.1 Å²	107.1	83%	0.825	61%	0.609	S	S	*	*	S	Bend	trans	-77.7	61.2	177.5	48.7	0	0	0	0	110.6	R212	R212-S214 PolarHBondContact O-N 3.23Å
215	D	37.7	Very low	50.8	Low	88 Å²	88	108 Å²	108	47%	0.471	64%	0.637	S	S	.	*			trans	-171.8	125.7	159.6	-133.9	-32.4	0	0	0	112.6	P213 T217	P213-D215 PolarHBondContact O-N 3.1Å; D215-T217 VanDerWaalsContact C-N 3.25Å; D215-T217 VanDerWaalsContact OD1-CB 3.3Å; D215-T217 WeakPolarHBondContact OD1-CB 3.4Å; D215-T217 PolarHBondContact OD1-N 3.23Å; D215-T217 VanDerWaalsContact OD1-N 3.15Å; D215-T217 PolarHBondContact OD1-OG1 3.49Å
216	P	38.6	Very low	48.1	Very low	112 Å²	112	103.7 Å²	103.7	73%	0.727	64%	0.638	S	S	*	*	S	Bend	trans	-79.1	-6.7	161.2	-8	25.8	0	0	0	112.9
217	T	35.9	Very low	45.5	Very low	115 Å²	115	106 Å²	106	71%	0.706	66%	0.661	S	S	*	*	S	Bend	trans	-88.4	-5.2	-167.2	-25.6	0	0	0	0	114.7	D215	D215-T217 VanDerWaalsContact C-N 3.25Å; D215-T217 VanDerWaalsContact OD1-CB 3.3Å; D215-T217 WeakPolarHBondContact OD1-CB 3.4Å; D215-T217 PolarHBondContact OD1-N 3.23Å; D215-T217 VanDerWaalsContact OD1-N 3.15Å; D215-T217 PolarHBondContact OD1-OG1 3.49Å
218	E	35.5	Very low	42.9	Very low	170 Å²	170	109.7 Å²	109.7	79%	0.794	69%	0.693	S	S	*	*	S	Bend	trans	-104.3	-8.1	-178	-71.9	-159.7	154.3	0	0	115.8	G220	E218-G220 PolarHBondContact O-N 3.27Å
219	E	32.3	Very low	40.1	Very low	200 Å²	200	112 Å²	112	94%	0.935	72%	0.724	S	S	*	*	S	Bend	trans	-97.1	71.2	171.7	-77.1	-168.3	168.1	0	0	111
220	G	30.6	Very low	37.2	Very low	67 Å²	67	120.8 Å²	120.8	69%	0.691	76%	0.764	S	S	*	*			trans	-171.8	21.5	-179.2	0	0	0	0	0	117.3	E218 T222	E218-G220 PolarHBondContact O-N 3.27Å; G220-T222 PolarHBondContact O-N 3.12Å
221	S	28.8	Very low	34.6	Very low	118 Å²	118	124.4 Å²	124.4	83%	0.825	78%	0.781	S	S	*	*			trans	-94.6	69.7	170.4	73.6	0	0	0	0	111.7
222	T	27.2	Very low	32.6	Very low	132 Å²	132	128.2 Å²	128.2	81%	0.81	80%	0.796	S	S	*	*			trans	-130.5	104.2	144.5	46.1	0	0	0	0	107.3	G220 E224	G220-T222 PolarHBondContact O-N 3.12Å; T222-E224 PolarHBondContact O-N 3.22Å
223	T	29	Very low	31.2	Very low	140 Å²	140	128.1 Å²	128.1	86%	0.859	80%	0.802	S	S	*	*			trans	-43.5	119.6	170.1	40.4	0	0	0	0	112.4
224	E	28.8	Very low	30.4	Very low	199 Å²	199	131.3 Å²	131.3	93%	0.93	81%	0.806	S	S	*	*			trans	-158.3	125.5	131.1	-108.7	176.2	-167	0	0	109.2	T222	T222-E224 PolarHBondContact O-N 3.22Å
225	G	26.7	Very low	29.6	Very low	88 Å²	88	133.8 Å²	133.8	91%	0.907	81%	0.805	S	S	*	*			trans	-80.8	159	-164.7	0	0	0	0	0	115.3
226	G	24	Very low	29.1	Very low	80 Å²	80	133.5 Å²	133.5	83%	0.825	82%	0.815	S	S	*	*			trans	169.8	89.3	167.4	0	0	0	0	0	110.3
227	G	25.8	Very low	28.8	Very low	84 Å²	84	134 Å²	134	87%	0.866	81%	0.811	S	S	*	*			trans	-68.1	145.6	-177.8	0	0	0	0	0	114
228	A	25.2	Very low	28.4	Very low	95 Å²	95	131 Å²	131	79%	0.785	80%	0.802	S	S	*	*			trans	-151.2	128	151.8	0	0	0	0	0	106.6	E230	A228-E230 PolarHBondContact O-N 2.97Å
229	G	27.4	Very low	28.3	Very low	75 Å²	75	128.9 Å²	128.9	77%	0.773	79%	0.79	S	S	*	*			trans	-58.5	129.4	-170.5	0	0	0	0	0	113.2
230	E	25.9	Very low	28.1	Very low	191 Å²	191	124.8 Å²	124.8	89%	0.893	78%	0.784	S	S	*	*			trans	-88.5	96.5	160.8	-73.3	177.3	152.5	0	0	106.7	A228	A228-E230 PolarHBondContact O-N 2.97Å
231	D	27.6	Very low	28.3	Very low	160 Å²	160	125.3 Å²	125.3	86%	0.856	79%	0.789	S	S	*	*			trans	-70.4	129.4	167.6	-72	-37.3	0	0	0	108.6	E233	D231-E233 PolarHBondContact O-N 3.45Å
232	Q	28.4	Very low	28.9	Very low	189 Å²	189	124 Å²	124	88%	0.883	77%	0.77	S	S	*	*			trans	-63.8	116.5	179.5	-72	162.4	-31.6	0	0	111
233	E	28.8	Very low	29	Very low	152 Å²	152	122.9 Å²	122.9	71%	0.71	77%	0.765	S	S	*	*			trans	-95.9	92.9	157.2	-83.3	-173.6	142.3	0	0	108.9	D231 E235	D231-E233 PolarHBondContact O-N 3.45Å; E233-E235 PolarHBondContact O-N 3.44Å; E233-E235 VanDerWaalsContact O-N 3.12Å
234	E	29.1	Very low	29.3	Very low	185 Å²	185	120.8 Å²	120.8	86%	0.864	75%	0.754	S	S	*	*			trans	-69.1	91.9	160.8	-88.1	-168.4	146.7	0	0	109	A236	E234-A236 VanDerWaalsContact C-N 3.29Å; E234-A236 PolarHBondContact O-N 3.28Å; E234-A236 VanDerWaalsContact O-N 3.16Å
235	E	27.8	Very low	29.9	Very low	170 Å²	170	117.9 Å²	117.9	79%	0.794	74%	0.744	S	S	*	*			trans	-83	83.5	159.7	-146.9	-173.5	-168	0	0	108.4	E233 L237	E233-E235 PolarHBondContact O-N 3.44Å; E233-E235 VanDerWaalsContact O-N 3.12Å; E235-L237 PolarHBondContact O-N 2.78Å
236	A	27.1	Very low	30.7	Very low	82 Å²	82	116.8 Å²	116.8	68%	0.678	73%	0.732	S	S	*	*			trans	-62.6	105.9	171.8	0	0	0	0	0	109.4	E234 G238	E234-A236 VanDerWaalsContact C-N 3.29Å; E234-A236 PolarHBondContact O-N 3.28Å; E234-A236 VanDerWaalsContact O-N 3.16Å; A236-G238 PolarHBondContact O-N 3.16Å
237	L	32.2	Very low	31.1	Very low	123 Å²	123	121.4 Å²	121.4	64%	0.644	73%	0.733	S	S	*	*			trans	-67.4	40.2	155.1	-75.1	169.3	0	0	0	111.1	E235 F239	E235-L237 PolarHBondContact O-N 2.78Å; L237-F239 PolarHBondContact O-N 3.01Å
238	G	28.4	Very low	31.7	Very low	50 Å²	50	125.9 Å²	125.9	52%	0.515	72%	0.723	S	S	.	*			trans	-78.6	106.7	176.5	0	0	0	0	0	109.1	A236 S240	A236-G238 PolarHBondContact O-N 3.16Å; G238-S240 PolarHBondContact O-N 2.69Å
239	F	32.8	Very low	32.1	Very low	126 Å²	126	124.2 Å²	124.2	55%	0.553	71%	0.71	S	S	*	*			trans	-66.2	64.1	155.1	-68.4	-86	0	0	0	109.1	L237 G241 F333	L237-F239 PolarHBondContact O-N 3.01Å; F239-G241 PolarHBondContact O-N 3.2Å; F239-F333 HydrophobicContact CE1-CD2 4.39Å; F239-F333 HydrophobicContact CE1-CE2 4.28Å
240	S	28.5	Very low	32.1	Very low	114 Å²	114	127.1 Å²	127.1	80%	0.797	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	112.4	174.7	70	0	0	0	0	108.6	G238	G238-S240 PolarHBondContact O-N 2.69Å
241	G	34.9	Very low	32.4	Very low	78 Å²	78	121.8 Å²	121.8	80%	0.804	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.1	-2.7	173.8	0	0	0	0	0	116.7	F239	F239-G241 PolarHBondContact O-N 3.2Å
242	H	41.5	Very low	32.7	Very low	90 Å²	90	120 Å²	120	42%	0.417	70%	0.701	S	S	.	*	S	Bend	trans	-105.8	145.6	175.3	-66.5	-65.1	0	0	0	111.2
243	P	30	Very low	32.8	Very low	110 Å²	110	116.3 Å²	116.3	71%	0.714	69%	0.693	S	S	*	*			trans	-55.8	143.5	179.1	22.8	-32	0	0	0	109.9	L245	P243-L245 PolarHBondContact O-N 3.28Å; P243-L245 VanDerWaalsContact O-N 3.11Å
244	P	33.8	Very low	33.3	Very low	95 Å²	95	119.5 Å²	119.5	62%	0.617	70%	0.699	S	S	*	*			trans	-55.8	122.2	-174.6	19	-30	0	0	0	110.5	G246	P244-G246 PolarHBondContact O-N 2.9Å
245	L	43	Very low	33.8	Very low	138 Å²	138	114.9 Å²	114.9	72%	0.723	69%	0.685	S	S	*	*	S	Bend	trans	-66.9	73.1	167.2	-76.8	163.8	0	0	0	108.6	P243	P243-L245 PolarHBondContact O-N 3.28Å; P243-L245 VanDerWaalsContact O-N 3.11Å
246	G	43.7	Very low	34.2	Very low	65 Å²	65	112.2 Å²	112.2	67%	0.67	68%	0.684	S	S	*	*			trans	144.7	63.3	177.9	0	0	0	0	0	114.8	P244	P244-G246 PolarHBondContact O-N 2.9Å
247	Q	32.5	Very low	35	Very low	177 Å²	177	117.9 Å²	117.9	83%	0.827	69%	0.688	S	S	*	*			trans	-86.7	105.8	149	-76.1	-171.8	7.5	0	0	108.2	A249	Q247-A249 PolarHBondContact O-N 3.39Å
248	R	37.5	Very low	35.4	Very low	179 Å²	179	116 Å²	116	68%	0.675	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-69.9	117.5	172.2	-170.8	177.9	-172.5	172.2	2.9	108.1
249	A	32.4	Very low	36.1	Very low	60 Å²	60	120 Å²	120	50%	0.496	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-58.6	125.2	168.5	0	0	0	0	0	109	Q247 G251 L252	Q247-A249 PolarHBondContact O-N 3.39Å; A249-G251 PolarHBondContact O-N 3.45Å; A249-L252 HydrophobicContact CB-CD1 4.41Å
250	P	28.1	Very low	36.9	Very low	136 Å²	136	115.9 Å²	115.9	88%	0.883	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	121.2	178.4	-1.7	10.4	0	0	0	109.3
251	G	32.9	Very low	37.9	Very low	79 Å²	79	113.2 Å²	113.2	81%	0.814	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.9	-4.3	173.7	0	0	0	0	0	116.9	A249	A249-G251 PolarHBondContact O-N 3.45Å
252	L	33.3	Very low	38.6	Very low	123 Å²	123	115 Å²	115	64%	0.644	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-74.8	127.2	171.2	-101	95.7	0	0	0	111	A249	A249-L252 HydrophobicContact CB-CD1 4.41Å
253	P	31.6	Very low	39.3	Very low	111 Å²	111	112.6 Å²	112.6	72%	0.721	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-56.4	149.6	173.4	21.7	-30	0	0	0	110.7
254	R	37.7	Very low	40.6	Very low	218 Å²	218	110.5 Å²	110.5	82%	0.823	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-48.4	132.7	172.2	-70.7	-176.1	178.6	-148.7	-1.3	107.9	C256	R254-C256 PolarHBondContact O-N 3.28Å
255	P	39.4	Very low	41.5	Very low	88 Å²	88	111 Å²	111	57%	0.571	62%	0.623	S	S	*	*			trans	-58	115.3	173.8	-14.6	25.9	0	0	0	107.1	W257	P255-W257 VanDerWaalsContact O-CD1 3.23Å; P255-W257 PolarHBondContact O-N 3.46Å
256	C	37.6	Very low	42.2	Very low	114 Å²	114	108.8 Å²	108.8	77%	0.77	61%	0.612	S	S	*	*			trans	-61.7	97.6	160.3	-89.8	0	0	0	0	105.3	R254 C258	R254-C256 PolarHBondContact O-N 3.28Å; C256-C258 PolarHBondContact O-N 3.04Å
257	W	43.3	Very low	43.3	Very low	201 Å²	201	109.7 Å²	109.7	76%	0.761	60%	0.599	S	S	*	*			trans	-67.1	83.5	167	-68.2	89	0	0	0	106.7	P255 S259	P255-W257 VanDerWaalsContact O-CD1 3.23Å; P255-W257 PolarHBondContact O-N 3.46Å; W257-S259 PolarHBondContact O-N 3.28Å
258	C	40.5	Very low	44.9	Very low	84 Å²	84	105.1 Å²	105.1	57%	0.568	58%	0.58	S	S	*	*			trans	-60.9	129.2	176.7	-68.7	0	0	0	0	109.2	C256 G260 C263	C256-C258 PolarHBondContact O-N 3.04Å; C258-G260 VanDerWaalsContact C-N 3.3Å; C258-G260 PolarHBondContact O-N 3.33Å; C258-C263 HydrophobicContact CB-CB 4.37Å
259	S	42.3	Very low	46.4	Very low	133 Å²	133	102.8 Å²	102.8	93%	0.93	58%	0.581	S	S	*	*	S	Bend	trans	-70.7	72.8	-179.1	42.4	0	0	0	0	112.2	W257	W257-S259 PolarHBondContact O-N 3.28Å
260	G	50.2	Low	48.6	Very low	41 Å²	41	106.5 Å²	106.5	42%	0.423	59%	0.587	S	S	.	*			trans	-170.8	136.8	173.7	0	0	0	0	0	116	C258 N262 C263 F264	C258-G260 VanDerWaalsContact C-N 3.3Å; C258-G260 PolarHBondContact O-N 3.33Å; G260-N262 VanDerWaalsContact C-N 3.28Å; G260-N262 PolarHBondContact O-N 3.48Å; G260-C263 WeakPolarHBondContact O-CB 2.97Å; G260-C263 PolarHBondContact O-N 2.84Å; G260-F264 PolarHBondContact O-N 2.97Å
261	W	49.4	Very low	51.4	Low	58 Å²	58	104 Å²	104	22%	0.22	57%	0.565	C	S	.	*	H	α-helix	trans	-50.6	-40.4	177.3	168.1	-98.7	0	0	0	114.2	L155 K156 V159 C263 F264 R265	L155-W261 WeakPolarHBondContact O-CZ3 3.44Å; K156-W261 VanDerWaalsContact C-CE3 3.45Å; K156-W261 VanDerWaalsContact CA-CD2 3.44Å; K156-W261 VanDerWaalsContact CA-CE2 3.48Å; K156-W261 VanDerWaalsContact CA-CE3 3.45Å; K156-W261 VanDerWaalsContact CA-CH2 3.44Å; K156-W261 HydrophobicContact CB-CD2 3.53Å; K156-W261 HydrophobicContact CB-CE3 4.1Å; K156-W261 HydrophobicContact CB-CG 3.79Å; K156-W261 HydrophobicContact CB-CH2 4.22Å; K156-W261 HydrophobicContact CB-CZ2 3.78Å; K156-W261 HydrophobicContact CB-CZ3 4.32Å; K156-W261 HydrophobicContact CD-CZ2 4.28Å; K156-W261 HydrophobicContact CG-CD2 4.03Å; K156-W261 HydrophobicContact CG-CG 4.39Å; K156-W261 HydrophobicContact CG-CH2 4.2Å; K156-W261 HydrophobicContact CG-CZ2 3.44Å; K156-W261 VanDerWaalsContact CG-CZ2 3.44Å; K156-W261 VanDerWaalsContact CG-NE1 3.28Å; K156-W261 WeakPolarHBondContact O-CZ3 3.31Å; V159-W261 HydrophobicContact CB-CE3 3.48Å; V159-W261 VanDerWaalsContact CB-CE3 3.48Å; V159-W261 HydrophobicContact CB-CZ3 3.39Å; V159-W261 HydrophobicContact CG1-CE3 3.92Å; V159-W261 HydrophobicContact CG1-CZ3 4.21Å; V159-W261 HydrophobicContact CG2-CE3 3.79Å; V159-W261 HydrophobicContact CG2-CH2 4.15Å; V159-W261 HydrophobicContact CG2-CZ3 3.18Å; W261-C263 VanDerWaalsContact C-N 3.26Å; W261-C263 PolarHBondContact O-N 3.02Å; W261-F264 PolarHBondContact O-N 3.15Å; W261-R265 HydrophobicContact CZ2-CB 4.34Å; W261-R265 WeakPolarHBondContact O-CB 3.25Å; W261-R265 PolarHBondContact O-N 2.78Å
262	N	50.3	Low	54.1	Low	116 Å²	116	103.7 Å²	103.7	62%	0.62	55%	0.549	S	S	*	.	H	α-helix	trans	-64.6	-31.8	-178.6	-73.7	-18.2	0	0	0	112.3	G260 N266	G260-N262 VanDerWaalsContact C-N 3.28Å; G260-N262 PolarHBondContact O-N 3.48Å; N262-N266 VanDerWaalsContact O-CB 3.31Å; N262-N266 WeakPolarHBondContact O-CB 3.49Å; N262-N266 PolarHBondContact O-N 3.01Å; N262-N266 PolarHBondContact O-ND2 3.41Å; N262-N266 VanDerWaalsContact O-ND2 3.14Å
263	C	55.4	Low	56.9	Low	38 Å²	38	104.4 Å²	104.4	26%	0.257	54%	0.544	S	S	.	.	H	α-helix	trans	-71	-47.5	175.4	-167	0	0	0	0	110.4	C258 G260 W261 N266 H267	C258-C263 HydrophobicContact CB-CB 4.37Å; G260-C263 WeakPolarHBondContact O-CB 2.97Å; G260-C263 PolarHBondContact O-N 2.84Å; W261-C263 VanDerWaalsContact C-N 3.26Å; W261-C263 PolarHBondContact O-N 3.02Å; C263-N266 PolarHBondContact O-N 3.36Å; C263-H267 WeakPolarHBondContact O-CB 3.27Å; C263-H267 PolarHBondContact O-N 2.7Å; C263-H267 PolarHBondContact O-ND1 3.27Å; C263-H267 VanDerWaalsContact O-ND1 3.08Å; C263-H267 PolarHBondContact SG-CE1 3.42Å
264	F	57.3	Low	59.8	Low	67 Å²	67	102.5 Å²	102.5	29%	0.294	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-45.7	177.9	-176.3	-94.7	0	0	0	113.5	V159 G260 W261 H267 L268	V159-F264 HydrophobicContact CB-CD1 3.99Å; V159-F264 HydrophobicContact CB-CE1 4.03Å; V159-F264 HydrophobicContact CG1-CB 3.79Å; V159-F264 HydrophobicContact CG1-CD1 3.23Å; V159-F264 HydrophobicContact CG1-CD2 3.84Å; V159-F264 HydrophobicContact CG1-CE1 3.57Å; V159-F264 HydrophobicContact CG1-CE2 4.17Å; V159-F264 HydrophobicContact CG1-CG 3.34Å; V159-F264 HydrophobicContact CG1-CZ 4.04Å; V159-F264 HydrophobicContact CG2-CD1 3.57Å; V159-F264 HydrophobicContact CG2-CE1 3.21Å; V159-F264 HydrophobicContact CG2-CG 4.5Å; V159-F264 HydrophobicContact CG2-CZ 3.97Å; G260-F264 PolarHBondContact O-N 2.97Å; W261-F264 PolarHBondContact O-N 3.15Å; F264-H267 CarbonylContact O-C 3.52Å; F264-H267 WeakPolarHBondContact O-CB 3.38Å; F264-H267 PolarHBondContact O-N 3.37Å; F264-H267 VanDerWaalsContact O-N 3.15Å; F264-L268 HydrophobicContact CD1-CD1 3.83Å; F264-L268 HydrophobicContact CD1-CG 3.97Å; F264-L268 HydrophobicContact CE1-CD1 3.33Å; F264-L268 HydrophobicContact CE1-CD2 4Å; F264-L268 HydrophobicContact CE1-CG 3.64Å; F264-L268 HydrophobicContact CZ-CD1 4.09Å; F264-L268 HydrophobicContact CZ-CD2 3.92Å; F264-L268 HydrophobicContact CZ-CG 4.07Å; F264-L268 PolarHBondContact O-N 2.97Å
265	R	53.2	Low	62.4	Low	104 Å²	104	95 Å²	95	39%	0.392	51%	0.509	S	S	.	.	H	α-helix	trans	-62.7	-46.4	178.3	-177.5	-176.9	175.9	-175.1	2.7	111.9	W261 H267 L268 D269	W261-R265 HydrophobicContact CZ2-CB 4.34Å; W261-R265 WeakPolarHBondContact O-CB 3.25Å; W261-R265 PolarHBondContact O-N 2.78Å; R265-H267 PolarHBondContact O-N 2.88Å; R265-L268 PolarHBondContact O-N 2.83Å; R265-D269 PolarHBondContact O-N 2.96Å
266	N	58.3	Low	64.9	Low	93 Å²	93	92.1 Å²	92.1	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-29.5	176.6	-70.9	-14	0	0	0	111.4	N262 C263 Q270	N262-N266 VanDerWaalsContact O-CB 3.31Å; N262-N266 WeakPolarHBondContact O-CB 3.49Å; N262-N266 PolarHBondContact O-N 3.01Å; N262-N266 PolarHBondContact O-ND2 3.41Å; N262-N266 VanDerWaalsContact O-ND2 3.14Å; C263-N266 PolarHBondContact O-N 3.36Å; N266-Q270 VanDerWaalsContact O-CD 3.24Å; N266-Q270 WeakPolarHBondContact O-CG 3.35Å; N266-Q270 PolarHBondContact O-NE2 3.02Å
267	H	65.8	Low	67.7	Low	84 Å²	84	87.7 Å²	87.7	39%	0.389	46%	0.458	S	S	.	.	H	α-helix	trans	-77	-35.2	173.9	-67	153.5	0	0	0	113.8	C263 F264 R265 D269 Q270 M271	C263-H267 WeakPolarHBondContact O-CB 3.27Å; C263-H267 PolarHBondContact O-N 2.7Å; C263-H267 PolarHBondContact O-ND1 3.27Å; C263-H267 VanDerWaalsContact O-ND1 3.08Å; C263-H267 PolarHBondContact SG-CE1 3.42Å; F264-H267 CarbonylContact O-C 3.52Å; F264-H267 WeakPolarHBondContact O-CB 3.38Å; F264-H267 PolarHBondContact O-N 3.37Å; F264-H267 VanDerWaalsContact O-N 3.15Å; R265-H267 PolarHBondContact O-N 2.88Å; H267-D269 PolarHBondContact O-N 3.1Å; H267-Q270 CarbonylContact O-C 3.51Å; H267-Q270 WeakPolarHBondContact O-CA 3.33Å; H267-Q270 WeakPolarHBondContact O-CB 3.41Å; H267-Q270 PolarHBondContact O-N 3.47Å; H267-M271 HydrophobicContact CB-CE 4.21Å; H267-M271 WeakPolarHBondContact O-CG 3.35Å; H267-M271 PolarHBondContact O-N 3.07Å
268	L	66.4	Low	70.2	Confident	81 Å²	81	82.6 Å²	82.6	42%	0.424	45%	0.445	S	S	.	.	H	α-helix	trans	-61.4	-43.7	176.8	-76	-177.7	0	0	0	112	F264 R265 Q270 M271	F264-L268 HydrophobicContact CD1-CD1 3.83Å; F264-L268 HydrophobicContact CD1-CG 3.97Å; F264-L268 HydrophobicContact CE1-CD1 3.33Å; F264-L268 HydrophobicContact CE1-CD2 4Å; F264-L268 HydrophobicContact CE1-CG 3.64Å; F264-L268 HydrophobicContact CZ-CD1 4.09Å; F264-L268 HydrophobicContact CZ-CD2 3.92Å; F264-L268 HydrophobicContact CZ-CG 4.07Å; F264-L268 PolarHBondContact O-N 2.97Å; R265-L268 PolarHBondContact O-N 2.83Å; L268-Q270 PolarHBondContact O-N 2.71Å; L268-Q270 VanDerWaalsContact O-N 3.17Å; L268-M271 PolarHBondContact O-N 3.49Å
269	D	69.4	Low	72.8	Confident	130 Å²	130	82.4 Å²	82.4	70%	0.695	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.5	175.1	-68.4	-25.8	0	0	0	112	R265 H267	R265-D269 PolarHBondContact O-N 2.96Å; H267-D269 PolarHBondContact O-N 3.1Å
270	Q	78.8	Confident	75.3	Confident	137 Å²	137	76 Å²	76	64%	0.64	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	7.1	176.6	-66.3	172.9	33.6	0	0	113.8	N266 H267 L268 P272	N266-Q270 VanDerWaalsContact O-CD 3.24Å; N266-Q270 WeakPolarHBondContact O-CG 3.35Å; N266-Q270 PolarHBondContact O-NE2 3.02Å; H267-Q270 CarbonylContact O-C 3.51Å; H267-Q270 WeakPolarHBondContact O-CA 3.33Å; H267-Q270 WeakPolarHBondContact O-CB 3.41Å; H267-Q270 PolarHBondContact O-N 3.47Å; L268-Q270 PolarHBondContact O-N 2.71Å; L268-Q270 VanDerWaalsContact O-N 3.17Å; Q270-P272 WeakPolarHBondContact O-CD 3.42Å
271	M	86.8	Confident	77.5	Confident	84 Å²	84	75.6 Å²	75.6	41%	0.414	38%	0.382	S	S	.	.			trans	-112.2	55.4	175.5	-66.5	179.6	-168.1	0	0	112.5	H267 L268 Y273 T274 T275	H267-M271 HydrophobicContact CB-CE 4.21Å; H267-M271 WeakPolarHBondContact O-CG 3.35Å; H267-M271 PolarHBondContact O-N 3.07Å; L268-M271 PolarHBondContact O-N 3.49Å; M271-Y273 VanDerWaalsContact C-N 3.31Å; M271-Y273 PolarHBondContact O-N 2.97Å; M271-T274 PolarHBondContact O-N 3.43Å; M271-T275 PolarHBondContact O-N 2.92Å; M271-T275 PolarHBondContact O-OG1 2.98Å; M271-T275 VanDerWaalsContact O-OG1 3.13Å
272	P	89	Confident	79.7	Confident	73 Å²	73	74.2 Å²	74.2	47%	0.474	38%	0.379	S	S	.	.	H	α-helix	trans	-64.2	-37.7	-177.7	27.9	-34.9	0	0	0	111.4	Q270 T275 M276	Q270-P272 WeakPolarHBondContact O-CD 3.42Å; P272-T275 WeakPolarHBondContact O-CB 3.47Å; P272-T275 PolarHBondContact O-N 3.12Å; P272-M276 HydrophobicContact CB-CE 4.07Å; P272-M276 VanDerWaalsContact O-CG 3.29Å; P272-M276 WeakPolarHBondContact O-CG 3.4Å; P272-M276 PolarHBondContact O-N 3.38Å
273	Y	91.8	Very high	81.8	Confident	138 Å²	138	68.7 Å²	68.7	54%	0.541	35%	0.349	S	S	.	.	H	α-helix	trans	-66.3	-43.9	178.2	-171.6	-105	0	0	0	112.3	M271 T275 M276 C277 P335	M271-Y273 VanDerWaalsContact C-N 3.31Å; M271-Y273 PolarHBondContact O-N 2.97Å; Y273-T275 VanDerWaalsContact C-N 3.27Å; Y273-T275 PolarHBondContact O-N 3.47Å; Y273-M276 WeakPolarHBondContact O-CB 3.4Å; Y273-M276 PolarHBondContact O-N 3.3Å; Y273-M276 VanDerWaalsContact O-N 3.08Å; Y273-C277 VanDerWaalsContact CE1-SG 3.56Å; Y273-C277 PolarHBondContact O-N 3.09Å; Y273-C277 PolarHBondContact O-SG 3.5Å; Y273-C277 VanDerWaalsContact O-SG 3.37Å; Y273-P335 HydrophobicContact CE2-CB 4.13Å; Y273-P335 HydrophobicContact CE2-CG 4.44Å
274	T	92.5	Very high	83.6	Confident	71 Å²	71	67.5 Å²	67.5	44%	0.436	34%	0.34	S	S	.	.	H	α-helix	trans	-58.8	-41.8	174.3	-51.1	0	0	0	0	111.1	M271 M276 C277 I278	M271-T274 PolarHBondContact O-N 3.43Å; T274-M276 VanDerWaalsContact C-N 3.33Å; T274-M276 PolarHBondContact O-N 3.06Å; T274-C277 PolarHBondContact O-N 2.95Å; T274-I278 HydrophobicContact CG2-CD1 4.08Å; T274-I278 WeakPolarHBondContact O-CG1 3.33Å; T274-I278 PolarHBondContact O-N 2.8Å
275	T	92.1	Very high	85.4	Confident	61 Å²	61	71.3 Å²	71.3	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-40.3	175.5	-61.4	0	0	0	0	111.9	M271 P272 Y273 I278 K279	M271-T275 PolarHBondContact O-N 2.92Å; M271-T275 PolarHBondContact O-OG1 2.98Å; M271-T275 VanDerWaalsContact O-OG1 3.13Å; P272-T275 WeakPolarHBondContact O-CB 3.47Å; P272-T275 PolarHBondContact O-N 3.12Å; Y273-T275 VanDerWaalsContact C-N 3.27Å; Y273-T275 PolarHBondContact O-N 3.47Å; T275-I278 PolarHBondContact O-N 3.19Å; T275-K279 HydrophobicContact CG2-CD 4.35Å; T275-K279 WeakPolarHBondContact O-CG 3.34Å; T275-K279 PolarHBondContact O-N 2.95Å
276	M	93.9	Very high	87.3	Confident	27 Å²	27	67 Å²	67	13%	0.133	34%	0.339	C	S	.	.	H	α-helix	trans	-62.3	-44.8	174.3	-70.5	176.7	-141.9	0	0	111.7	P272 Y273 T274 K279 E280 P335 F338 A339	P272-M276 HydrophobicContact CB-CE 4.07Å; P272-M276 VanDerWaalsContact O-CG 3.29Å; P272-M276 WeakPolarHBondContact O-CG 3.4Å; P272-M276 PolarHBondContact O-N 3.38Å; Y273-M276 WeakPolarHBondContact O-CB 3.4Å; Y273-M276 PolarHBondContact O-N 3.3Å; Y273-M276 VanDerWaalsContact O-N 3.08Å; T274-M276 VanDerWaalsContact C-N 3.33Å; T274-M276 PolarHBondContact O-N 3.06Å; M276-K279 PolarHBondContact O-N 3.35Å; M276-E280 PolarHBondContact O-N 3.14Å; M276-P335 HydrophobicContact CB-CB 3.79Å; M276-P335 WeakPolarHBondContact CB-O 3.38Å; M276-F338 HydrophobicContact CB-CB 4.3Å; M276-F338 HydrophobicContact CG-CB 3.99Å; M276-A339 HydrophobicContact CE-CB 4.35Å; M276-A339 HydrophobicContact SD-CB 4.14Å
277	C	95.3	Very high	88.8	Confident	21 Å²	21	67.1 Å²	67.1	14%	0.142	35%	0.345	C	S	.	.	H	α-helix	trans	-61.5	-44.4	176.2	-65.8	0	0	0	0	112	Y273 T274 K279 E280 A281 F333 P335	Y273-C277 VanDerWaalsContact CE1-SG 3.56Å; Y273-C277 PolarHBondContact O-N 3.09Å; Y273-C277 PolarHBondContact O-SG 3.5Å; Y273-C277 VanDerWaalsContact O-SG 3.37Å; T274-C277 PolarHBondContact O-N 2.95Å; C277-K279 VanDerWaalsContact C-N 3.32Å; C277-K279 PolarHBondContact O-N 3.29Å; C277-E280 PolarHBondContact O-N 3.12Å; C277-A281 WeakPolarHBondContact O-CB 3.42Å; C277-A281 PolarHBondContact O-N 3.29Å; C277-F333 HydrophobicContact CB-CZ 4.27Å; C277-P335 VanDerWaalsContact SG-CG 3.57Å
278	I	94.9	Very high	90	Very high	93 Å²	93	66.6 Å²	66.6	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-43.2	176.5	-68.8	166.1	0	0	0	110.5	T274 T275 A281 L282	T274-I278 HydrophobicContact CG2-CD1 4.08Å; T274-I278 WeakPolarHBondContact O-CG1 3.33Å; T274-I278 PolarHBondContact O-N 2.8Å; T275-I278 PolarHBondContact O-N 3.19Å; I278-A281 PolarHBondContact O-N 3.05Å; I278-L282 HydrophobicContact CG2-CD1 4.06Å; I278-L282 HydrophobicContact CG2-CG 4.46Å; I278-L282 WeakPolarHBondContact O-CB 2.95Å; I278-L282 VanDerWaalsContact O-CG 3.31Å; I278-L282 WeakPolarHBondContact O-CG 3.39Å; I278-L282 PolarHBondContact O-N 3.06Å
279	K	95.2	Very high	91.2	Very high	80 Å²	80	65.7 Å²	65.7	35%	0.348	35%	0.347	S	S	.	.	H	α-helix	trans	-64.7	-41.2	178	-74.5	177.5	177.8	-179.6	0	112.4	T275 M276 C277 L282 R283 F338 F349	T275-K279 HydrophobicContact CG2-CD 4.35Å; T275-K279 WeakPolarHBondContact O-CG 3.34Å; T275-K279 PolarHBondContact O-N 2.95Å; M276-K279 PolarHBondContact O-N 3.35Å; C277-K279 VanDerWaalsContact C-N 3.32Å; C277-K279 PolarHBondContact O-N 3.29Å; K279-L282 PolarHBondContact O-N 3.35Å; K279-R283 PolarHBondContact O-N 2.6Å; K279-F338 HydrophobicContact CB-CB 4.34Å; K279-F338 HydrophobicContact CB-CD1 3.85Å; K279-F338 HydrophobicContact CB-CD2 3.6Å; K279-F338 HydrophobicContact CB-CE1 3.94Å; K279-F338 HydrophobicContact CB-CE2 3.72Å; K279-F338 HydrophobicContact CB-CG 3.65Å; K279-F338 HydrophobicContact CB-CZ 3.86Å; K279-F338 HydrophobicContact CD-CB 3.98Å; K279-F338 HydrophobicContact CD-CD1 3.68Å; K279-F338 HydrophobicContact CD-CE1 4.3Å; K279-F338 HydrophobicContact CD-CG 3.85Å; K279-F338 HydrophobicContact CG-CD1 4.37Å; K279-F338 HydrophobicContact CG-CG 4.43Å; K279-F349 HydrophobicContact CB-CE1 4.26Å; K279-F349 HydrophobicContact CB-CZ 3.91Å; K279-F349 HydrophobicContact CD-CE1 4.48Å; K279-F349 HydrophobicContact CG-CE1 4.03Å; K279-F349 HydrophobicContact CG-CZ 4.11Å; K279-F349 VanDerWaalsContact O-CE2 3.26Å; K279-F349 WeakPolarHBondContact O-CE2 3.37Å; K279-F349 WeakPolarHBondContact O-CZ 3.36Å
280	E	95.8	Very high	92.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-67.7	-37.3	176.4	-175.8	65.8	174.1	0	0	112.1	M276 C277 R283 L284 F333 D334 R337 F338	M276-E280 PolarHBondContact O-N 3.14Å; C277-E280 PolarHBondContact O-N 3.12Å; E280-R283 VanDerWaalsContact CD-NE 3.31Å; E280-R283 WeakPolarHBondContact O-CB 3.4Å; E280-R283 PolarHBondContact O-N 3.49Å; E280-R283 IonicContact OE1-CZ 3.44Å; E280-R283 IonicContact OE1-NE 3.22Å; E280-R283 PolarHBondContact OE1-NE 3.47Å; E280-R283 IonicContact OE1-NH2 2.78Å; E280-R283 PolarHBondContact OE1-NH2 3.15Å; E280-R283 WeakPolarHBondContact OE2-CD 3.44Å; E280-R283 IonicContact OE2-CZ 3.76Å; E280-R283 IonicContact OE2-NE 2.79Å; E280-R283 PolarHBondContact OE2-NE 3.4Å; E280-R283 IonicContact OE2-NH2 3.86Å; E280-L284 PolarHBondContact O-N 3.21Å; E280-L284 VanDerWaalsContact O-N 3.09Å; E280-F333 HydrophobicContact CB-CD2 4.46Å; E280-F333 HydrophobicContact CB-CE2 4Å; E280-F333 HydrophobicContact CB-CZ 4.09Å; E280-F333 HydrophobicContact CG-CD1 4.36Å; E280-F333 HydrophobicContact CG-CD2 3.72Å; E280-F333 HydrophobicContact CG-CE1 4.43Å; E280-F333 HydrophobicContact CG-CE2 3.77Å; E280-F333 HydrophobicContact CG-CG 4Å; E280-F333 HydrophobicContact CG-CZ 4.13Å; E280-D334 PolarHBondContact OE1-N 3.44Å; E280-R337 IonicContact OE1-NE 3.37Å; E280-R337 PolarHBondContact OE1-NE 2.98Å; E280-F338 HydrophobicContact CB-CD2 4.28Å; E280-F338 HydrophobicContact CB-CE2 4.03Å; E280-F338 WeakPolarHBondContact OE2-CE2 3.47Å
281	A	95.8	Very high	93	Very high	32 Å²	32	55.3 Å²	55.3	26%	0.264	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-45.9	170.7	0	0	0	0	0	111.5	C277 I278 R283 L284 Y285 F333	C277-A281 WeakPolarHBondContact O-CB 3.42Å; C277-A281 PolarHBondContact O-N 3.29Å; I278-A281 PolarHBondContact O-N 3.05Å; A281-R283 PolarHBondContact O-N 3.36Å; A281-L284 PolarHBondContact O-N 3.06Å; A281-Y285 WeakPolarHBondContact O-CA 2.99Å; A281-Y285 PolarHBondContact O-N 3.46Å; A281-F333 HydrophobicContact CB-CE2 4.24Å
282	L	95.8	Very high	93.2	Very high	28 Å²	28	51.6 Å²	51.6	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-67.6	-22.5	176.1	-71.2	174.3	0	0	0	113.5	I278 K279 P286 P287 H321 F349 P351 F352	I278-L282 HydrophobicContact CG2-CD1 4.06Å; I278-L282 HydrophobicContact CG2-CG 4.46Å; I278-L282 WeakPolarHBondContact O-CB 2.95Å; I278-L282 VanDerWaalsContact O-CG 3.31Å; I278-L282 WeakPolarHBondContact O-CG 3.39Å; I278-L282 PolarHBondContact O-N 3.06Å; K279-L282 PolarHBondContact O-N 3.35Å; L282-P286 WeakPolarHBondContact O-CA 3.45Å; L282-P287 HydrophobicContact CD2-CG 3.82Å; L282-H321 PolarHBondContact O-ND1 3.36Å; L282-F349 HydrophobicContact CB-CE2 4.28Å; L282-F349 HydrophobicContact CB-CZ 4.01Å; L282-P351 HydrophobicContact CB-CB 3.96Å; L282-P351 HydrophobicContact CB-CG 4.38Å; L282-P351 HydrophobicContact CD1-CB 4.3Å; L282-P351 HydrophobicContact CD1-CG 4.31Å; L282-F352 HydrophobicContact CD1-CE2 3.92Å; L282-F352 HydrophobicContact CD1-CZ 3.91Å
283	R	95.4	Very high	93.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.8	-54.9	172.3	-173.4	-168.7	66.6	76.4	-3.6	109.3	K279 E280 A281 H321 W327 L330 F338 F349	K279-R283 PolarHBondContact O-N 2.6Å; E280-R283 VanDerWaalsContact CD-NE 3.31Å; E280-R283 WeakPolarHBondContact O-CB 3.4Å; E280-R283 PolarHBondContact O-N 3.49Å; E280-R283 IonicContact OE1-CZ 3.44Å; E280-R283 IonicContact OE1-NE 3.22Å; E280-R283 PolarHBondContact OE1-NE 3.47Å; E280-R283 IonicContact OE1-NH2 2.78Å; E280-R283 PolarHBondContact OE1-NH2 3.15Å; E280-R283 WeakPolarHBondContact OE2-CD 3.44Å; E280-R283 IonicContact OE2-CZ 3.76Å; E280-R283 IonicContact OE2-NE 2.79Å; E280-R283 PolarHBondContact OE2-NE 3.4Å; E280-R283 IonicContact OE2-NH2 3.86Å; A281-R283 PolarHBondContact O-N 3.36Å; R283-H321 WeakPolarHBondContact CA-ND1 3.25Å; R283-H321 HydrophobicContact CG-CB 3.83Å; R283-H321 PolarHBondContact NH1-O 2.92Å; R283-H321 VanDerWaalsContact NH1-O 3.1Å; R283-H321 WeakPolarHBondContact O-CB 3.24Å; R283-H321 PolarHBondContact O-ND1 3.12Å; R283-H321 VanDerWaalsContact O-ND1 3.14Å; R283-W327 VanDerWaalsContact CD-CH2 3.5Å; R283-W327 VanDerWaalsContact CD-CZ3 3.47Å; R283-W327 HydrophobicContact CG-CH2 4.09Å; R283-W327 HydrophobicContact CG-CZ2 3.94Å; R283-L330 PolarHBondContact NH1-O 3.48Å; R283-L330 PolarHBondContact NH2-O 3.35Å; R283-F338 HydrophobicContact CB-CZ 4.34Å; R283-F349 HydrophobicContact CB-CD2 4.32Å; R283-F349 HydrophobicContact CB-CE2 3.98Å
284	L	93.3	Very high	93.5	Very high	13 Å²	13	45 Å²	45	7%	0.068	25%	0.252	C	S	.	.	H	α-helix	trans	-70.1	-43.1	-177.3	-72.3	168.7	0	0	0	112.8	E280 A281 P286 H322 L330 F333	E280-L284 PolarHBondContact O-N 3.21Å; E280-L284 VanDerWaalsContact O-N 3.09Å; A281-L284 PolarHBondContact O-N 3.06Å; L284-P286 VanDerWaalsContact C-CD 3.42Å; L284-P286 VanDerWaalsContact O-CD 3.26Å; L284-P286 WeakPolarHBondContact O-CD 3.27Å; L284-H322 PolarHBondContact O-CE1 3.29Å; L284-H322 VanDerWaalsContact O-CE1 3.27Å; L284-L330 WeakPolarHBondContact CD2-O 3.43Å; L284-F333 HydrophobicContact CD1-CB 4.24Å; L284-F333 HydrophobicContact CD1-CD2 3.68Å; L284-F333 HydrophobicContact CD1-CG 4.43Å
285	Y	93.1	Very high	93.6	Very high	148 Å²	148	41.7 Å²	41.7	58%	0.58	23%	0.232	S	C	*	.	S	Bend	trans	-123.5	69.4	-174	-52.4	-75.2	0	0	0	110	A281 P287	A281-Y285 WeakPolarHBondContact O-CA 2.99Å; A281-Y285 PolarHBondContact O-N 3.46Å; Y285-P287 WeakPolarHBondContact O-CD 3.38Å
286	P	93.1	Very high	93.7	Very high	13 Å²	13	41.3 Å²	41.3	8%	0.084	23%	0.232	C	C	.	.			trans	-65.8	124.3	177.8	27.3	-32.8	0	0	0	109.7	L282 L284 V288 I317 Y318	L282-P286 WeakPolarHBondContact O-CA 3.45Å; L284-P286 VanDerWaalsContact C-CD 3.42Å; L284-P286 VanDerWaalsContact O-CD 3.26Å; L284-P286 WeakPolarHBondContact O-CD 3.27Å; P286-V288 PolarHBondContact O-N 2.81Å; P286-I317 HydrophobicContact CB-CG2 3.94Å; P286-I317 HydrophobicContact CG-CG2 4.46Å; P286-Y318 HydrophobicContact CG-CD2 3.91Å
287	P	91.2	Very high	93.7	Very high	96 Å²	96	43.4 Å²	43.4	62%	0.623	25%	0.246	S	C	*	.	S	Bend	trans	-58.6	-25.5	-179.8	-26.7	35	0	0	0	113.7	L282 Y285	L282-P287 HydrophobicContact CD2-CG 3.82Å; Y285-P287 WeakPolarHBondContact O-CD 3.38Å
288	V	91.5	Very high	93.8	Very high	72 Å²	72	46.6 Å²	46.6	44%	0.436	27%	0.267	S	S	.	.	S	Bend	trans	-122.1	105.7	171.8	-178.8	0	0	0	0	108.3	P286 G290 I291 I317	P286-V288 PolarHBondContact O-N 2.81Å; V288-G290 VanDerWaalsContact C-N 3.29Å; V288-G290 PolarHBondContact O-N 3.02Å; V288-I291 HydrophobicContact CG1-CG2 3.97Å; V288-I317 WeakPolarHBondContact O-CD1 3.41Å
289	P	91.6	Very high	93.9	Very high	63 Å²	63	42.5 Å²	42.5	41%	0.409	25%	0.246	S	C	.	.			trans	-74.9	-16	-173.6	27.3	-34.5	0	0	0	113.8	L72 I317 Y318	L72-P289 HydrophobicContact CD2-CB 4.31Å; P289-I317 PolarHBondContact O-N 2.92Å; P289-Y318 PolarHBondContact O-N 3.32Å
290	G	92.3	Very high	94	Very high	26 Å²	26	43.2 Å²	43.2	27%	0.268	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.8	160.1	173.1	0	0	0	0	0	115.1	V288 L315	V288-G290 VanDerWaalsContact C-N 3.29Å; V288-G290 PolarHBondContact O-N 3.02Å; G290-L315 CarbonylContact C-O 3.45Å; G290-L315 WeakPolarHBondContact CA-O 3.38Å
291	I	92.2	Very high	94	Very high	22 Å²	22	43.5 Å²	43.5	11%	0.113	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143	-179.3	60.4	174.4	0	0	0	111.4	L109 V288 L315 I317 S353	L109-I291 HydrophobicContact CD2-CD1 4.29Å; V288-I291 HydrophobicContact CG1-CG2 3.97Å; I291-L315 HydrophobicContact CD1-CD1 3.95Å; I291-L315 HydrophobicContact CG1-CB 3.81Å; I291-L315 HydrophobicContact CG1-CD1 3.91Å; I291-L315 HydrophobicContact CG1-CG 4.3Å; I291-L315 PolarHBondContact N-O 3.34Å; I291-L315 PolarHBondContact O-N 2.8Å; I291-I317 HydrophobicContact CG2-CD1 4.42Å; I291-S353 VanDerWaalsContact CD1-OG 3.3Å; I291-S353 WeakPolarHBondContact CD1-OG 3.45Å
292	G	92.5	Very high	94	Very high	7 Å²	7	46.3 Å²	46.3	7%	0.072	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.8	-174.4	0	0	0	0	0	113.9	S116 V313	S116-G292 PolarHBondContact N-O 3.41Å; S116-G292 VanDerWaalsContact N-O 3.1Å; S116-G292 WeakPolarHBondContact OG-CA 3.27Å; S116-G292 PolarHBondContact OG-O 2.94Å; G292-V313 WeakPolarHBondContact CA-O 3.25Å
293	R	92.8	Very high	93.9	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.045	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.9	172.4	-58.6	-62.9	-179.4	119.9	10.3	111	I108 D113 P114 M312 V313 R357	I108-R293 HydrophobicContact CG2-CB 4.44Å; I108-R293 HydrophobicContact CG2-CG 4.24Å; D113-R293 PolarHBondContact O-NH1 3.45Å; P114-R293 WeakPolarHBondContact O-CA 3.43Å; R293-M312 CarbonylContact O-C 3.56Å; R293-M312 WeakPolarHBondContact O-CA 3.42Å; R293-V313 HydrophobicContact CB-CG2 3.77Å; R293-V313 PolarHBondContact N-O 2.66Å; R293-V313 PolarHBondContact O-N 3.03Å; R293-R357 VanDerWaalsContact NH1-CD 3.33Å
294	E	93.3	Very high	93.8	Very high	60 Å²	60	51.2 Å²	51.2	28%	0.28	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	120.6	172.8	-174.4	-179.2	164.3	0	0	108.8	P114 H117 S296 M312	P114-E294 WeakPolarHBondContact CD-O 3.49Å; P114-E294 HydrophobicContact CG-CB 4.41Å; P114-E294 PolarHBondContact O-N 3.05Å; H117-E294 IonicContact CE1-OE2 3.92Å; H117-E294 IonicContact ND1-OE2 3.05Å; H117-E294 PolarHBondContact ND1-OE2 3.34Å; E294-S296 PolarHBondContact O-N 3.18Å; E294-S296 VanDerWaalsContact O-N 3.15Å; E294-M312 HydrophobicContact CB-SD 3.98Å; E294-M312 HydrophobicContact CG-CG 4.49Å; E294-M312 HydrophobicContact CG-SD 4.19Å
295	L	94.6	Very high	93.9	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	32%	0.315	C	S	.	.			trans	-67.1	114.9	-174.9	-64.8	-177.5	0	0	0	111	I108 V299 L307 G310 I311 V313	I108-L295 HydrophobicContact CD1-CD2 3.84Å; L295-V299 HydrophobicContact CD1-CG1 3.71Å; L295-V299 HydrophobicContact CD2-CG1 4.29Å; L295-L307 HydrophobicContact CD1-CB 3.64Å; L295-L307 HydrophobicContact CD1-CD1 4.2Å; L295-G310 PolarHBondContact O-N 2.97Å; L295-I311 HydrophobicContact CD1-CB 4.23Å; L295-I311 WeakPolarHBondContact CG-O 3.49Å; L295-I311 PolarHBondContact N-O 3.14Å; L295-V313 HydrophobicContact CD1-CG1 4.09Å; L295-V313 HydrophobicContact CD2-CG1 4.29Å; L295-V313 HydrophobicContact CD2-CG2 4.24Å; L295-V313 HydrophobicContact CG-CG1 4.11Å
296	S	93.3	Very high	94.1	Very high	53 Å²	53	47.2 Å²	47.2	37%	0.371	30%	0.302	S	S	.	.	S	Bend	trans	-78.2	-27.4	178.1	63.6	0	0	0	0	112.9	D113 E294 K309	D113-S296 WeakPolarHBondContact OD1-CB 3.32Å; D113-S296 PolarHBondContact OD1-N 2.94Å; D113-S296 PolarHBondContact OD1-OG 2.92Å; E294-S296 PolarHBondContact O-N 3.18Å; E294-S296 VanDerWaalsContact O-N 3.15Å; S296-K309 WeakPolarHBondContact O-CD 3.4Å; S296-K309 WeakPolarHBondContact O-CE 3.37Å; S296-K309 WeakPolarHBondContact O-CG 3.49Å
297	T	95.4	Very high	94.2	Very high	71 Å²	71	46.6 Å²	46.6	44%	0.436	30%	0.298	S	S	.	.	S	Bend	trans	-137.6	158.6	174.3	62.1	0	0	0	0	109.9	R111	R111-T297 PolarHBondContact NH1-OG1 3.04Å; R111-T297 PolarHBondContact NH2-O 3.38Å; R111-T297 PolarHBondContact NH2-OG1 2.93Å
298	P	96.7	Very high	94.4	Very high	87 Å²	87	43.5 Å²	43.5	57%	0.565	28%	0.278	S	S	*	.			trans	-56.8	153.7	173.5	-21.6	33.6	0	0	0	111.9	R111 L307 K309	R111-P298 PolarHBondContact NH1-O 3.21Å; P298-L307 WeakPolarHBondContact CA-O 3.42Å; P298-K309 HydrophobicContact CG-CB 4.44Å
299	V	96.8	Very high	94.6	Very high	7 Å²	7	46.7 Å²	46.7	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.6	179.8	66.4	0	0	0	0	110.4	V107 I108 L295 F301 S306 L307	V107-V299 HydrophobicContact CG1-CG2 3.38Å; I108-V299 HydrophobicContact CD1-CG1 4.22Å; I108-V299 HydrophobicContact CD1-CG2 4.24Å; L295-V299 HydrophobicContact CD1-CG1 3.71Å; L295-V299 HydrophobicContact CD2-CG1 4.29Å; V299-F301 HydrophobicContact CG1-CE2 4.22Å; V299-F301 HydrophobicContact CG1-CZ 3.99Å; V299-F301 HydrophobicContact CG2-CE1 4.48Å; V299-S306 CarbonylContact O-C 3.54Å; V299-S306 WeakPolarHBondContact O-CA 3.38Å; V299-S306 WeakPolarHBondContact O-CB 3.38Å; V299-L307 HydrophobicContact CG1-CB 3.9Å; V299-L307 PolarHBondContact N-O 2.68Å; V299-L307 PolarHBondContact O-N 2.71Å
300	T	96.9	Very high	94.6	Very high	95 Å²	95	45.6 Å²	45.6	58%	0.583	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	134	172.9	-53.9	0	0	0	0	108.1	R305	T300-R305 WeakPolarHBondContact CA-O 3.31Å
301	F	96.6	Very high	94.6	Very high	7 Å²	7	44.6 Å²	44.6	3%	0.031	28%	0.275	C	S	.	.			trans	-94	164.6	-179.3	-61.5	-72.1	0	0	0	111.2	F51 L99 Y104 V107 I108 V299 D303 G304 R305 L307	F51-F301 HydrophobicContact CZ-CD2 4.24Å; F51-F301 HydrophobicContact CZ-CE2 4.11Å; L99-F301 HydrophobicContact CD1-CE1 4.41Å; L99-F301 HydrophobicContact CD1-CZ 4.21Å; Y104-F301 HydrophobicContact CD1-CB 4.31Å; Y104-F301 AromaticContact CD1-CD1 3.29Å; Y104-F301 HydrophobicContact CD1-CD1 3.29Å; Y104-F301 AromaticContact CD1-CD2 3.71Å; Y104-F301 HydrophobicContact CD1-CD2 3.71Å; Y104-F301 AromaticContact CD1-CE1 3.29Å; Y104-F301 HydrophobicContact CD1-CE1 3.29Å; Y104-F301 AromaticContact CD1-CE2 3.69Å; Y104-F301 HydrophobicContact CD1-CE2 3.69Å; Y104-F301 AromaticContact CD1-CG 3.5Å; Y104-F301 HydrophobicContact CD1-CG 3.5Å; Y104-F301 VanDerWaalsContact CD1-CG 3.5Å; Y104-F301 AromaticContact CD1-CZ 3.49Å; Y104-F301 HydrophobicContact CD1-CZ 3.49Å; Y104-F301 VanDerWaalsContact CD1-CZ 3.49Å; Y104-F301 HydrophobicContact CD2-CB 4.23Å; Y104-F301 HydrophobicContact CD2-CD1 4.08Å; Y104-F301 HydrophobicContact CD2-CG 4.23Å; Y104-F301 HydrophobicContact CE1-CB 3.8Å; Y104-F301 AromaticContact CE1-CD1 3.56Å; Y104-F301 HydrophobicContact CE1-CD1 3.56Å; Y104-F301 AromaticContact CE1-CD2 3.13Å; Y104-F301 HydrophobicContact CE1-CD2 3.13Å; Y104-F301 AromaticContact CE1-CE1 3.83Å; Y104-F301 HydrophobicContact CE1-CE1 3.83Å; Y104-F301 AromaticContact CE1-CE2 3.4Å; Y104-F301 HydrophobicContact CE1-CE2 3.4Å; Y104-F301 VanDerWaalsContact CE1-CE2 3.4Å; Y104-F301 AromaticContact CE1-CG 3.19Å; Y104-F301 HydrophobicContact CE1-CG 3.19Å; Y104-F301 AromaticContact CE1-CZ 3.74Å; Y104-F301 HydrophobicContact CE1-CZ 3.74Å; Y104-F301 HydrophobicContact CE2-CB 3.69Å; Y104-F301 HydrophobicContact CE2-CD1 4.29Å; Y104-F301 AromaticContact CE2-CG 3.96Å; Y104-F301 HydrophobicContact CE2-CG 3.96Å; Y104-F301 AromaticContact CG-CD1 3.57Å; Y104-F301 HydrophobicContact CG-CD1 3.57Å; Y104-F301 AromaticContact CG-CE1 3.82Å; Y104-F301 HydrophobicContact CG-CE1 3.82Å; Y104-F301 HydrophobicContact CG-CG 4.01Å; Y104-F301 HydrophobicContact CG-CZ 4.44Å; Y104-F301 VanDerWaalsContact CZ-CB 3.43Å; Y104-F301 AromaticContact CZ-CD2 3.63Å; Y104-F301 AromaticContact CZ-CG 3.42Å; Y104-F301 VanDerWaalsContact CZ-CG 3.42Å; V107-F301 HydrophobicContact CB-CD1 4.26Å; V107-F301 HydrophobicContact CB-CE1 4.44Å; V107-F301 HydrophobicContact CG1-CD1 4.29Å; V107-F301 HydrophobicContact CG1-CE1 4.37Å; I108-F301 HydrophobicContact CD1-CE1 4.03Å; I108-F301 HydrophobicContact CD1-CZ 4.18Å; I108-F301 HydrophobicContact CG1-CE1 4.15Å; V299-F301 HydrophobicContact CG1-CE2 4.22Å; V299-F301 HydrophobicContact CG1-CZ 3.99Å; V299-F301 HydrophobicContact CG2-CE1 4.48Å; F301-D303 PolarHBondContact O-N 2.96Å; F301-D303 VanDerWaalsContact O-N 3.11Å; F301-G304 PolarHBondContact O-N 3.45Å; F301-R305 WeakPolarHBondContact CD2-O 3.19Å; F301-R305 PolarHBondContact N-O 3.3Å; F301-L307 HydrophobicContact CE2-CD1 3.72Å; F301-L307 HydrophobicContact CE2-CG 3.91Å; F301-L307 HydrophobicContact CZ-CD1 3.9Å
302	P	94.8	Very high	94.6	Very high	91 Å²	91	45.2 Å²	45.2	59%	0.591	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.4	-174.3	-29.3	40.2	0	0	0	115.4	D103 V107 G304	D103-P302 HydrophobicContact CB-CG 4.14Å; V107-P302 HydrophobicContact CG2-CG 4.47Å; P302-G304 VanDerWaalsContact C-N 3.27Å; P302-G304 PolarHBondContact O-N 3.02Å
303	D	93.9	Very high	94.7	Very high	79 Å²	79	45 Å²	45	42%	0.422	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	7.6	176.4	66.5	0.4	0	0	0	113.9	Y104 F301 R305	Y104-D303 PolarHBondContact OH-OD1 3.41Å; Y104-D303 PolarHBondContact OH-OD2 3.33Å; F301-D303 PolarHBondContact O-N 2.96Å; F301-D303 VanDerWaalsContact O-N 3.11Å; D303-R305 VanDerWaalsContact C-N 3.31Å; D303-R305 PolarHBondContact O-N 3.3Å; D303-R305 WeakPolarHBondContact OD1-CB 3.35Å; D303-R305 PolarHBondContact OD1-N 2.96Å; D303-R305 IonicContact OD1-NE 3.01Å; D303-R305 IonicContact OD2-CZ 3.61Å; D303-R305 IonicContact OD2-NE 3.37Å; D303-R305 PolarHBondContact OD2-NE 3.46Å; D303-R305 IonicContact OD2-NH2 3.94Å; D303-R305 PolarHBondContact OD2-NH2 3.2Å
304	G	94.1	Very high	94.8	Very high	52 Å²	52	45.9 Å²	45.9	54%	0.536	28%	0.28	S	S	.	.	S	Bend	trans	84.9	-6.7	179	0	0	0	0	0	114.9	F301 P302	F301-G304 PolarHBondContact O-N 3.45Å; P302-G304 VanDerWaalsContact C-N 3.27Å; P302-G304 PolarHBondContact O-N 3.02Å
305	R	95.6	Very high	94.9	Very high	33 Å²	33	43.1 Å²	43.1	13%	0.125	27%	0.268	C	S	.	.			trans	-70.4	150.6	174.8	-65.6	-175.1	-75.5	-177.2	-7.9	110.8	Q50 F51 P83 Y104 T300 F301 D303	Q50-R305 HydrophobicContact CB-CG 4.16Å; Q50-R305 WeakPolarHBondContact O-CD 3.21Å; Q50-R305 VanDerWaalsContact OE1-CA 3.23Å; F51-R305 HydrophobicContact CE1-CB 4.05Å; F51-R305 HydrophobicContact CE2-CB 4.48Å; F51-R305 HydrophobicContact CZ-CB 3.78Å; P83-R305 PolarHBondContact O-NH1 2.92Å; P83-R305 PolarHBondContact O-NH2 3.19Å; Y104-R305 PolarHBondContact OH-NE 3.36Å; Y104-R305 PolarHBondContact OH-NH2 2.9Å; Y104-R305 VanDerWaalsContact OH-NH2 3.12Å; T300-R305 WeakPolarHBondContact CA-O 3.31Å; F301-R305 WeakPolarHBondContact CD2-O 3.19Å; F301-R305 PolarHBondContact N-O 3.3Å; D303-R305 VanDerWaalsContact C-N 3.31Å; D303-R305 PolarHBondContact O-N 3.3Å; D303-R305 WeakPolarHBondContact OD1-CB 3.35Å; D303-R305 PolarHBondContact OD1-N 2.96Å; D303-R305 IonicContact OD1-NE 3.01Å; D303-R305 IonicContact OD2-CZ 3.61Å; D303-R305 IonicContact OD2-NE 3.37Å; D303-R305 PolarHBondContact OD2-NE 3.46Å; D303-R305 IonicContact OD2-NH2 3.94Å; D303-R305 PolarHBondContact OD2-NH2 3.2Å
306	S	96	Very high	94.9	Very high	43 Å²	43	43.1 Å²	43.1	30%	0.301	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.1	-176.3	69.9	0	0	0	0	113.5	F51 V299	F51-S306 WeakPolarHBondContact CE2-O 3.29Å; V299-S306 CarbonylContact O-C 3.54Å; V299-S306 WeakPolarHBondContact O-CA 3.38Å; V299-S306 WeakPolarHBondContact O-CB 3.38Å
307	L	96.6	Very high	95.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.6	172.5	-68.8	172.1	0	0	0	110.5	L48 F51 V97 L295 P298 V299 F301 I311 V313	L48-L307 HydrophobicContact CD2-CD2 3.35Å; F51-L307 HydrophobicContact CD2-CD2 4.1Å; F51-L307 HydrophobicContact CE2-CD2 3.43Å; F51-L307 VanDerWaalsContact CE2-CD2 3.43Å; F51-L307 HydrophobicContact CE2-CG 3.93Å; F51-L307 HydrophobicContact CZ-CD2 3.99Å; F51-L307 HydrophobicContact CZ-CG 4.01Å; V97-L307 HydrophobicContact CB-CD1 4.3Å; V97-L307 HydrophobicContact CG1-CD1 4.2Å; V97-L307 HydrophobicContact CG2-CD1 4.38Å; V97-L307 HydrophobicContact CG2-CD2 4Å; L295-L307 HydrophobicContact CD1-CB 3.64Å; L295-L307 HydrophobicContact CD1-CD1 4.2Å; P298-L307 WeakPolarHBondContact CA-O 3.42Å; V299-L307 HydrophobicContact CG1-CB 3.9Å; V299-L307 PolarHBondContact N-O 2.68Å; V299-L307 PolarHBondContact O-N 2.71Å; F301-L307 HydrophobicContact CE2-CD1 3.72Å; F301-L307 HydrophobicContact CE2-CG 3.91Å; F301-L307 HydrophobicContact CZ-CD1 3.9Å; L307-I311 HydrophobicContact CD2-CG2 4.44Å; L307-V313 HydrophobicContact CD1-CG1 3.79Å
308	P	95.5	Very high	95	Very high	31 Å²	31	38.8 Å²	38.8	20%	0.201	24%	0.236	C	C	.	.			trans	-73.8	164.8	175.9	30.5	-34.2	0	0	0	112	W43 A47 I311	W43-P308 HydrophobicContact CH2-CB 4.12Å; W43-P308 HydrophobicContact CH2-CG 3.78Å; W43-P308 HydrophobicContact CZ2-CB 4.04Å; W43-P308 HydrophobicContact CZ2-CG 3.97Å; A47-P308 HydrophobicContact CB-CG 3.94Å; P308-I311 HydrophobicContact CG-CD1 4.32Å; P308-I311 HydrophobicContact CG-CG1 3.74Å; P308-I311 WeakPolarHBondContact O-CG1 3.49Å
309	K	94.9	Very high	94.9	Very high	138 Å²	138	34.6 Å²	34.6	60%	0.6	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	146.5	169.1	174.9	-179.8	179.7	179.9	0	111.2	S296 P298 I311	S296-K309 WeakPolarHBondContact O-CD 3.4Å; S296-K309 WeakPolarHBondContact O-CE 3.37Å; S296-K309 WeakPolarHBondContact O-CG 3.49Å; P298-K309 HydrophobicContact CG-CB 4.44Å; K309-I311 VanDerWaalsContact C-N 3.27Å; K309-I311 PolarHBondContact O-N 2.78Å
310	G	91.6	Very high	94.9	Very high	40 Å²	40	34.3 Å²	34.3	41%	0.412	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	-7.6	174.6	0	0	0	0	0	114	L295	L295-G310 PolarHBondContact O-N 2.97Å
311	I	92.7	Very high	94.8	Very high	6 Å²	6	29.8 Å²	29.8	3%	0.031	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-70.3	135.5	171.7	-61.6	-63.2	0	0	0	109.5	L44 V95 V97 L295 L307 P308 K309 V313	L44-I311 HydrophobicContact CD2-CD1 3.65Å; V95-I311 HydrophobicContact CG1-CD1 4.19Å; V97-I311 HydrophobicContact CB-CG2 4.43Å; V97-I311 HydrophobicContact CG2-CG2 3.66Å; L295-I311 HydrophobicContact CD1-CB 4.23Å; L295-I311 WeakPolarHBondContact CG-O 3.49Å; L295-I311 PolarHBondContact N-O 3.14Å; L307-I311 HydrophobicContact CD2-CG2 4.44Å; P308-I311 HydrophobicContact CG-CD1 4.32Å; P308-I311 HydrophobicContact CG-CG1 3.74Å; P308-I311 WeakPolarHBondContact O-CG1 3.49Å; K309-I311 VanDerWaalsContact C-N 3.27Å; K309-I311 PolarHBondContact O-N 2.78Å; I311-V313 HydrophobicContact CG2-CG1 4.45Å
312	M	92.8	Very high	94.6	Very high	35 Å²	35	29.8 Å²	29.8	17%	0.172	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118.7	173.2	-67.4	-102.3	-76.7	0	0	108.7	R96 V97 S116 R293 E294	R96-M312 CarbonylContact C-O 3.55Å; R96-M312 VanDerWaalsContact CA-O 3.25Å; R96-M312 WeakPolarHBondContact CA-O 3.05Å; R96-M312 HydrophobicContact CG-CB 4.02Å; V97-M312 PolarHBondContact N-O 3.3Å; S116-M312 WeakPolarHBondContact CB-SD 3.12Å; R293-M312 CarbonylContact O-C 3.56Å; R293-M312 WeakPolarHBondContact O-CA 3.42Å; E294-M312 HydrophobicContact CB-SD 3.98Å; E294-M312 HydrophobicContact CG-CG 4.49Å; E294-M312 HydrophobicContact CG-SD 4.19Å
313	V	94.8	Very high	94.6	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	133.8	174.4	-61	0	0	0	0	109.4	V97 L99 I108 G292 R293 L295 L307 I311	V97-V313 HydrophobicContact CB-CG1 4.43Å; V97-V313 CarbonylContact O-C 3.59Å; V97-V313 VanDerWaalsContact O-CA 3.32Å; V97-V313 WeakPolarHBondContact O-CA 3.35Å; L99-V313 HydrophobicContact CD1-CB 4.09Å; L99-V313 HydrophobicContact CD1-CG1 4.28Å; L99-V313 HydrophobicContact CG-CB 4.43Å; I108-V313 HydrophobicContact CG1-CG2 4.49Å; I108-V313 HydrophobicContact CG2-CG2 3.96Å; G292-V313 WeakPolarHBondContact CA-O 3.25Å; R293-V313 HydrophobicContact CB-CG2 3.77Å; R293-V313 PolarHBondContact N-O 2.66Å; R293-V313 PolarHBondContact O-N 3.03Å; L295-V313 HydrophobicContact CD1-CG1 4.09Å; L295-V313 HydrophobicContact CD2-CG1 4.29Å; L295-V313 HydrophobicContact CD2-CG2 4.24Å; L295-V313 HydrophobicContact CG-CG1 4.11Å; L307-V313 HydrophobicContact CD1-CG1 3.79Å; I311-V313 HydrophobicContact CG2-CG1 4.45Å
314	L	94	Very high	94.5	Very high	31 Å²	31	24.9 Å²	24.9	16%	0.162	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	111.7	171.9	179.9	69.5	0	0	0	107.8	Y88 V97 Q98 L99 S316	Y88-L314 HydrophobicContact CE1-CB 4.29Å; Y88-L314 HydrophobicContact CE1-CD2 4.25Å; Y88-L314 VanDerWaalsContact OH-CD2 3.31Å; Y88-L314 WeakPolarHBondContact OH-CD2 3.3Å; V97-L314 PolarHBondContact O-N 2.9Å; Q98-L314 CarbonylContact C-O 3.56Å; Q98-L314 WeakPolarHBondContact CA-O 3.42Å; Q98-L314 HydrophobicContact CG-CD2 4.33Å; L99-L314 PolarHBondContact N-O 3.26Å; L314-S316 PolarHBondContact O-N 3.48Å
315	L	95.2	Very high	94.3	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	102.3	171.3	-55.8	177.2	0	0	0	107.5	L99 M105 I108 L109 G290 I291 I317	L99-L315 HydrophobicContact CB-CD2 4.17Å; L99-L315 HydrophobicContact CD1-CD2 3.87Å; L99-L315 HydrophobicContact CG-CD2 4.43Å; M105-L315 HydrophobicContact CE-CB 4.07Å; M105-L315 HydrophobicContact SD-CB 3.64Å; M105-L315 HydrophobicContact SD-CD1 4.41Å; M105-L315 HydrophobicContact SD-CD2 3.49Å; M105-L315 WeakPolarHBondContact SD-CD2 3.38Å; M105-L315 HydrophobicContact SD-CG 4Å; I108-L315 HydrophobicContact CB-CD2 3.91Å; I108-L315 HydrophobicContact CG1-CD2 4.27Å; I108-L315 HydrophobicContact CG2-CD1 4.04Å; I108-L315 HydrophobicContact CG2-CD2 3.8Å; I108-L315 HydrophobicContact CG2-CG 4.31Å; L109-L315 HydrophobicContact CD2-CD1 3.42Å; L109-L315 VanDerWaalsContact CD2-CD1 3.42Å; L109-L315 HydrophobicContact CG-CD1 3.88Å; G290-L315 CarbonylContact C-O 3.45Å; G290-L315 WeakPolarHBondContact CA-O 3.38Å; I291-L315 HydrophobicContact CD1-CD1 3.95Å; I291-L315 HydrophobicContact CG1-CB 3.81Å; I291-L315 HydrophobicContact CG1-CD1 3.91Å; I291-L315 HydrophobicContact CG1-CG 4.3Å; I291-L315 PolarHBondContact N-O 3.34Å; I291-L315 PolarHBondContact O-N 2.8Å; L315-I317 PolarHBondContact O-N 3.38Å
316	S	95.5	Very high	94	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	100.3	176.1	-174.7	0	0	0	0	109.7	L99 M105 L314 Y318 G319 L320	L99-S316 WeakPolarHBondContact O-CB 3.21Å; L99-S316 PolarHBondContact O-N 3.41Å; M105-S316 WeakPolarHBondContact CE-O 3.37Å; L314-S316 PolarHBondContact O-N 3.48Å; S316-Y318 VanDerWaalsContact C-N 3.34Å; S316-G319 PolarHBondContact OG-N 3.32Å; S316-L320 VanDerWaalsContact O-CB 3.3Å; S316-L320 WeakPolarHBondContact O-CB 3.31Å; S316-L320 PolarHBondContact O-N 3.47Å
317	I	95.8	Very high	93.8	Very high	7 Å²	7	27.9 Å²	27.9	4%	0.036	15%	0.148	C	C	.	.	H	α-helix	trans	-66.2	-42.9	174.5	-63.7	168.2	0	0	0	108.9	P286 V288 P289 I291 L315 G319 L320 H321	P286-I317 HydrophobicContact CB-CG2 3.94Å; P286-I317 HydrophobicContact CG-CG2 4.46Å; V288-I317 WeakPolarHBondContact O-CD1 3.41Å; P289-I317 PolarHBondContact O-N 2.92Å; I291-I317 HydrophobicContact CG2-CD1 4.42Å; L315-I317 PolarHBondContact O-N 3.38Å; I317-G319 PolarHBondContact O-N 2.88Å; I317-L320 WeakPolarHBondContact O-CB 3.46Å; I317-L320 PolarHBondContact O-N 3.35Å; I317-H321 VanDerWaalsContact CG2-CE1 3.43Å; I317-H321 WeakPolarHBondContact CG2-CE1 3.25Å; I317-H321 WeakPolarHBondContact O-CB 3.38Å; I317-H321 PolarHBondContact O-CD2 2.88Å; I317-H321 VanDerWaalsContact O-CG 3.24Å; I317-H321 PolarHBondContact O-N 2.89Å
318	Y	94.9	Very high	93.4	Very high	25 Å²	25	31.7 Å²	31.7	10%	0.098	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-48.4	176.2	-175	-96.3	0	0	0	112.2	L72 I75 Q76 P286 P289 S316 L320 H321 H322	L72-Y318 HydrophobicContact CB-CD1 4.37Å; L72-Y318 HydrophobicContact CB-CE1 3.77Å; L72-Y318 HydrophobicContact CD1-CE2 4.16Å; L72-Y318 HydrophobicContact CD2-CD1 3.93Å; L72-Y318 HydrophobicContact CD2-CD2 4.16Å; L72-Y318 HydrophobicContact CD2-CE1 4.16Å; L72-Y318 HydrophobicContact CD2-CE2 4.39Å; L72-Y318 HydrophobicContact CD2-CG 3.93Å; L72-Y318 HydrophobicContact CG-CE1 4.44Å; L72-Y318 WeakPolarHBondContact O-CE1 3.45Å; I75-Y318 HydrophobicContact CB-CD1 4.25Å; I75-Y318 HydrophobicContact CG2-CD1 3.97Å; Q76-Y318 HydrophobicContact CG-CE1 3.72Å; Q76-Y318 PolarHBondContact NE2-OH 3.27Å; P286-Y318 HydrophobicContact CG-CD2 3.91Å; P289-Y318 PolarHBondContact O-N 3.32Å; S316-Y318 VanDerWaalsContact C-N 3.34Å; Y318-L320 VanDerWaalsContact C-N 3.34Å; Y318-L320 PolarHBondContact O-N 2.91Å; Y318-H321 PolarHBondContact O-N 3.37Å; Y318-H322 AromaticContact CD2-CE1 3.74Å; Y318-H322 AromaticContact CD2-ND1 3.79Å; Y318-H322 AromaticContact CE1-ND1 3.99Å; Y318-H322 AromaticContact CE2-CE1 3.28Å; Y318-H322 WeakPolarHBondContact CE2-CE1 3.48Å; Y318-H322 AromaticContact CE2-ND1 3.63Å; Y318-H322 AromaticContact CZ-CE1 3.64Å; Y318-H322 AromaticContact CZ-ND1 3.73Å; Y318-H322 PolarHBondContact O-N 3.29Å; Y318-H322 PolarHBondContact O-ND1 2.91Å
319	G	94.6	Very high	93	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-36	177.9	0	0	0	0	0	113.2	S316 I317 H322 N323	S316-G319 PolarHBondContact OG-N 3.32Å; I317-G319 PolarHBondContact O-N 2.88Å; G319-H322 CarbonylContact O-C 3.55Å; G319-H322 PolarHBondContact O-N 2.82Å; G319-N323 WeakPolarHBondContact O-CB 3.29Å; G319-N323 PolarHBondContact O-N 2.94Å; G319-N323 VanDerWaalsContact O-N 3.07Å
320	L	95.5	Very high	92.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-45.6	173.7	176.5	73.9	0	0	0	111.9	Y100 P102 M105 S316 I317 Y318 H322 N323 W327 H347 L350	Y100-L320 WeakPolarHBondContact O-CD1 3.24Å; P102-L320 HydrophobicContact CB-CD1 4.3Å; P102-L320 HydrophobicContact CG-CD1 3.78Å; M105-L320 HydrophobicContact CE-CB 4.04Å; M105-L320 HydrophobicContact CE-CD2 4.3Å; M105-L320 HydrophobicContact CG-CD1 4.12Å; M105-L320 HydrophobicContact CG-CD2 4.14Å; S316-L320 VanDerWaalsContact O-CB 3.3Å; S316-L320 WeakPolarHBondContact O-CB 3.31Å; S316-L320 PolarHBondContact O-N 3.47Å; I317-L320 WeakPolarHBondContact O-CB 3.46Å; I317-L320 PolarHBondContact O-N 3.35Å; Y318-L320 VanDerWaalsContact C-N 3.34Å; Y318-L320 PolarHBondContact O-N 2.91Å; L320-H322 PolarHBondContact O-N 3.39Å; L320-N323 VanDerWaalsContact O-CB 3.32Å; L320-N323 WeakPolarHBondContact O-CB 3.44Å; L320-N323 PolarHBondContact O-N 2.93Å; L320-W327 PolarHBondContact O-NE1 2.93Å; L320-H347 WeakPolarHBondContact CD2-O 3.26Å; L320-L350 HydrophobicContact CD2-CB 4.18Å; L320-L350 HydrophobicContact CD2-CD1 3.75Å; L320-L350 HydrophobicContact CD2-CG 4.06Å
321	H	95.3	Very high	92	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-71.3	-18.5	-180	-69.2	-175.8	0	0	0	113.6	L282 R283 I317 Y318 W327 F349 L350	L282-H321 PolarHBondContact O-ND1 3.36Å; R283-H321 WeakPolarHBondContact CA-ND1 3.25Å; R283-H321 HydrophobicContact CG-CB 3.83Å; R283-H321 PolarHBondContact NH1-O 2.92Å; R283-H321 VanDerWaalsContact NH1-O 3.1Å; R283-H321 WeakPolarHBondContact O-CB 3.24Å; R283-H321 PolarHBondContact O-ND1 3.12Å; R283-H321 VanDerWaalsContact O-ND1 3.14Å; I317-H321 VanDerWaalsContact CG2-CE1 3.43Å; I317-H321 WeakPolarHBondContact CG2-CE1 3.25Å; I317-H321 WeakPolarHBondContact O-CB 3.38Å; I317-H321 PolarHBondContact O-CD2 2.88Å; I317-H321 VanDerWaalsContact O-CG 3.24Å; I317-H321 PolarHBondContact O-N 2.89Å; Y318-H321 PolarHBondContact O-N 3.37Å; H321-W327 VanDerWaalsContact O-CD1 3.22Å; H321-F349 AromaticContact CE1-CD2 3.96Å; H321-F349 AromaticContact NE2-CD2 3.81Å; H321-L350 PolarHBondContact NE2-N 3.25Å
322	H	93.5	Very high	92	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.037	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	17.7	174.5	-65.5	80.7	0	0	0	112.9	Q76 L284 Y318 G319 L320 P324 L330	Q76-H322 HydrophobicContact CG-CB 4.38Å; Q76-H322 PolarHBondContact NE2-CD2 3.47Å; Q76-H322 VanDerWaalsContact NE2-CD2 3.35Å; L284-H322 PolarHBondContact O-CE1 3.29Å; L284-H322 VanDerWaalsContact O-CE1 3.27Å; Y318-H322 AromaticContact CD2-CE1 3.74Å; Y318-H322 AromaticContact CD2-ND1 3.79Å; Y318-H322 AromaticContact CE1-ND1 3.99Å; Y318-H322 AromaticContact CE2-CE1 3.28Å; Y318-H322 WeakPolarHBondContact CE2-CE1 3.48Å; Y318-H322 AromaticContact CE2-ND1 3.63Å; Y318-H322 AromaticContact CZ-CE1 3.64Å; Y318-H322 AromaticContact CZ-ND1 3.73Å; Y318-H322 PolarHBondContact O-N 3.29Å; Y318-H322 PolarHBondContact O-ND1 2.91Å; G319-H322 CarbonylContact O-C 3.55Å; G319-H322 PolarHBondContact O-N 2.82Å; L320-H322 PolarHBondContact O-N 3.39Å; H322-P324 WeakPolarHBondContact O-CD 3.45Å; H322-L330 WeakPolarHBondContact O-CD1 3.41Å; H322-L330 WeakPolarHBondContact O-CD2 3.32Å
323	N	93.6	Very high	92.1	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.208	C	C	.	.			trans	-77.2	114.8	-180	-172.1	-23.6	0	0	0	110.8	V79 Y100 G319 L320 K325 V326 W327	V79-N323 HydrophobicContact CG1-CB 4.03Å; Y100-N323 PolarHBondContact O-ND2 3.47Å; G319-N323 WeakPolarHBondContact O-CB 3.29Å; G319-N323 PolarHBondContact O-N 2.94Å; G319-N323 VanDerWaalsContact O-N 3.07Å; L320-N323 VanDerWaalsContact O-CB 3.32Å; L320-N323 WeakPolarHBondContact O-CB 3.44Å; L320-N323 PolarHBondContact O-N 2.93Å; N323-K325 PolarHBondContact O-N 3.29Å; N323-K325 VanDerWaalsContact O-N 3.14Å; N323-K325 WeakPolarHBondContact OD1-CB 3.39Å; N323-K325 PolarHBondContact OD1-N 2.91Å; N323-V326 HydrophobicContact CB-CB 4.39Å; N323-V326 HydrophobicContact CB-CG2 4.16Å; N323-V326 PolarHBondContact O-N 3.47Å; N323-W327 PolarHBondContact O-N 2.89Å
324	P	91.5	Very high	92	Very high	62 Å²	62	42 Å²	42	40%	0.403	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-18.7	-175.9	27.1	-34.5	0	0	0	113.5	K80 H322 V326 L330	K80-P324 HydrophobicContact CG-CG 4.49Å; H322-P324 WeakPolarHBondContact O-CD 3.45Å; P324-V326 PolarHBondContact O-N 3.29Å; P324-L330 HydrophobicContact CB-CD1 4.17Å
325	K	89.9	Confident	92	Very high	145 Å²	145	41 Å²	41	63%	0.63	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-24.8	173.2	-63.6	-177.2	178	-177.2	0	112.7	N323	N323-K325 PolarHBondContact O-N 3.29Å; N323-K325 VanDerWaalsContact O-N 3.14Å; N323-K325 WeakPolarHBondContact OD1-CB 3.39Å; N323-K325 PolarHBondContact OD1-N 2.91Å
326	V	90.4	Very high	91.9	Very high	40 Å²	40	44.3 Å²	44.3	24%	0.242	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-36.2	-173	-176.6	0	0	0	0	110.6	P102 N323 P324 A348	P102-V326 HydrophobicContact CG-CG1 4.49Å; P102-V326 HydrophobicContact CG-CG2 3.53Å; N323-V326 HydrophobicContact CB-CB 4.39Å; N323-V326 HydrophobicContact CB-CG2 4.16Å; N323-V326 PolarHBondContact O-N 3.47Å; P324-V326 PolarHBondContact O-N 3.29Å; V326-A348 HydrophobicContact CG1-CB 3.43Å; V326-A348 VanDerWaalsContact CG1-CB 3.43Å
327	W	91.5	Very high	91.7	Very high	7 Å²	7	45.9 Å²	45.9	3%	0.027	24%	0.244	C	C	.	.			trans	-124.4	109.1	-173.3	-57.5	103.3	0	0	0	109.9	R283 L320 H321 N323 L330 R337 F338 F349	R283-W327 VanDerWaalsContact CD-CH2 3.5Å; R283-W327 VanDerWaalsContact CD-CZ3 3.47Å; R283-W327 HydrophobicContact CG-CH2 4.09Å; R283-W327 HydrophobicContact CG-CZ2 3.94Å; L320-W327 PolarHBondContact O-NE1 2.93Å; H321-W327 VanDerWaalsContact O-CD1 3.22Å; N323-W327 PolarHBondContact O-N 2.89Å; W327-L330 HydrophobicContact CB-CD2 3.67Å; W327-L330 WeakPolarHBondContact O-CD2 3.27Å; W327-R337 HydrophobicContact CZ3-CB 4.25Å; W327-F338 AromaticContact CH2-CE1 3.86Å; W327-F338 HydrophobicContact CH2-CE1 3.86Å; W327-F338 HydrophobicContact CH2-CE2 4.36Å; W327-F338 AromaticContact CH2-CZ 3.52Å; W327-F338 HydrophobicContact CH2-CZ 3.52Å; W327-F338 HydrophobicContact CZ3-CZ 4.06Å; W327-F349 HydrophobicContact CH2-CB 4.35Å; W327-F349 HydrophobicContact CH2-CD2 4.33Å; W327-F349 HydrophobicContact CZ2-CB 4.09Å; W327-F349 HydrophobicContact CZ2-CD2 4.25Å
328	P	88.5	Confident	91.5	Very high	81 Å²	81	46.6 Å²	46.6	53%	0.526	25%	0.247	S	C	.	.	S	Bend	trans	-75	149.7	172.8	29.6	-33	0	0	0	110.7	R337	P328-R337 PolarHBondContact O-NH1 3.15Å; P328-R337 PolarHBondContact O-NH2 2.99Å
329	N	87.1	Confident	91.3	Very high	125 Å²	125	47 Å²	47	67%	0.668	26%	0.255	S	S	*	.	S	Bend	trans	53.5	64.3	178	-56	-30.4	0	0	0	113.1	E331 V332 R337	N329-E331 VanDerWaalsContact C-N 3.3Å; N329-E331 PolarHBondContact O-N 3.25Å; N329-V332 HydrophobicContact CB-CB 4.32Å; N329-V332 HydrophobicContact CB-CG2 4.01Å; N329-V332 PolarHBondContact O-N 3.35Å; N329-V332 VanDerWaalsContact O-N 3.14Å; N329-R337 PolarHBondContact O-NH2 2.93Å
330	L	84.9	Confident	90.9	Very high	24 Å²	24	52.6 Å²	52.6	13%	0.126	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-36.8	-166.2	-63.5	174.7	0	0	0	115.4	R283 L284 H322 P324 W327	R283-L330 PolarHBondContact NH1-O 3.48Å; R283-L330 PolarHBondContact NH2-O 3.35Å; L284-L330 WeakPolarHBondContact CD2-O 3.43Å; H322-L330 WeakPolarHBondContact O-CD1 3.41Å; H322-L330 WeakPolarHBondContact O-CD2 3.32Å; P324-L330 HydrophobicContact CB-CD1 4.17Å; W327-L330 HydrophobicContact CB-CD2 3.67Å; W327-L330 WeakPolarHBondContact O-CD2 3.27Å
331	E	80.4	Confident	90.2	Very high	159 Å²	159	56.7 Å²	56.7	74%	0.743	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-10.6	-174.5	-65.9	170.5	-163.5	0	0	112.9	N329 F333	N329-E331 VanDerWaalsContact C-N 3.3Å; N329-E331 PolarHBondContact O-N 3.25Å; E331-F333 PolarHBondContact O-N 2.9Å
332	V	91.6	Very high	89.5	Confident	75 Å²	75	59.4 Å²	59.4	46%	0.455	35%	0.353	S	S	.	.	S	Bend	trans	-84.5	119.7	-179.9	-178.6	0	0	0	0	109.6	N329 D334	N329-V332 HydrophobicContact CB-CB 4.32Å; N329-V332 HydrophobicContact CB-CG2 4.01Å; N329-V332 PolarHBondContact O-N 3.35Å; N329-V332 VanDerWaalsContact O-N 3.14Å; V332-D334 HydrophobicContact CG1-CB 4.39Å; V332-D334 PolarHBondContact O-N 3.4Å; V332-D334 VanDerWaalsContact O-N 3.14Å
333	F	94.9	Very high	88.3	Confident	35 Å²	35	64.4 Å²	64.4	15%	0.154	40%	0.395	C	S	.	.			trans	-68.4	103	167.8	-172	-87.5	0	0	0	109.7	F239 C277 E280 A281 L284 E331 P335	F239-F333 HydrophobicContact CE1-CD2 4.39Å; F239-F333 HydrophobicContact CE1-CE2 4.28Å; C277-F333 HydrophobicContact CB-CZ 4.27Å; E280-F333 HydrophobicContact CB-CD2 4.46Å; E280-F333 HydrophobicContact CB-CE2 4Å; E280-F333 HydrophobicContact CB-CZ 4.09Å; E280-F333 HydrophobicContact CG-CD1 4.36Å; E280-F333 HydrophobicContact CG-CD2 3.72Å; E280-F333 HydrophobicContact CG-CE1 4.43Å; E280-F333 HydrophobicContact CG-CE2 3.77Å; E280-F333 HydrophobicContact CG-CG 4Å; E280-F333 HydrophobicContact CG-CZ 4.13Å; A281-F333 HydrophobicContact CB-CE2 4.24Å; L284-F333 HydrophobicContact CD1-CB 4.24Å; L284-F333 HydrophobicContact CD1-CD2 3.68Å; L284-F333 HydrophobicContact CD1-CG 4.43Å; E331-F333 PolarHBondContact O-N 2.9Å; F333-P335 HydrophobicContact CD1-CG 4.04Å; F333-P335 HydrophobicContact CE1-CG 3.51Å; F333-P335 HydrophobicContact CZ-CG 4.31Å
334	D	93.3	Very high	87.6	Confident	51 Å²	51	67.1 Å²	67.1	27%	0.273	41%	0.408	S	S	.	.			trans	-130.5	97.1	-179.3	177.2	13.8	0	0	0	111.5	E280 V332 S336 R337	E280-D334 PolarHBondContact OE1-N 3.44Å; V332-D334 HydrophobicContact CG1-CB 4.39Å; V332-D334 PolarHBondContact O-N 3.4Å; V332-D334 VanDerWaalsContact O-N 3.14Å; D334-S336 VanDerWaalsContact CG-OG 3.22Å; D334-S336 PolarHBondContact O-N 3.34Å; D334-S336 VanDerWaalsContact OD1-CB 3.22Å; D334-S336 WeakPolarHBondContact OD1-CB 3.29Å; D334-S336 PolarHBondContact OD1-N 2.92Å; D334-S336 PolarHBondContact OD1-OG 3.33Å; D334-S336 PolarHBondContact OD2-OG 3.44Å; D334-S336 VanDerWaalsContact OD2-OG 3.13Å; D334-R337 HydrophobicContact CB-CG 4.28Å; D334-R337 WeakPolarHBondContact O-CD 3.39Å; D334-R337 VanDerWaalsContact O-CG 3.26Å; D334-R337 WeakPolarHBondContact O-CG 3.31Å; D334-R337 PolarHBondContact O-N 2.97Å
335	P	94.3	Very high	87.2	Confident	10 Å²	10	67.4 Å²	67.4	7%	0.065	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-58.5	-26.4	176.3	-26.7	36.4	0	0	0	113.9	Y273 M276 C277 F333 R337 F338	Y273-P335 HydrophobicContact CE2-CB 4.13Å; Y273-P335 HydrophobicContact CE2-CG 4.44Å; M276-P335 HydrophobicContact CB-CB 3.79Å; M276-P335 WeakPolarHBondContact CB-O 3.38Å; C277-P335 VanDerWaalsContact SG-CG 3.57Å; F333-P335 HydrophobicContact CD1-CG 4.04Å; F333-P335 HydrophobicContact CE1-CG 3.51Å; F333-P335 HydrophobicContact CZ-CG 4.31Å; P335-R337 PolarHBondContact O-N 3.38Å; P335-F338 PolarHBondContact O-N 2.9Å
336	S	91.9	Very high	87	Confident	70 Å²	70	64.5 Å²	64.5	49%	0.49	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-64.5	-17.9	-174.2	77.9	0	0	0	0	113.2	D334 F338 A339	D334-S336 VanDerWaalsContact CG-OG 3.22Å; D334-S336 PolarHBondContact O-N 3.34Å; D334-S336 VanDerWaalsContact OD1-CB 3.22Å; D334-S336 WeakPolarHBondContact OD1-CB 3.29Å; D334-S336 PolarHBondContact OD1-N 2.92Å; D334-S336 PolarHBondContact OD1-OG 3.33Å; D334-S336 PolarHBondContact OD2-OG 3.44Å; D334-S336 VanDerWaalsContact OD2-OG 3.13Å; S336-F338 PolarHBondContact O-N 2.94Å; S336-F338 VanDerWaalsContact O-N 3.13Å; S336-A339 WeakPolarHBondContact O-CB 3.25Å; S336-A339 PolarHBondContact O-N 3.07Å
337	R	91.4	Very high	87.1	Confident	35 Å²	35	64.4 Å²	64.4	13%	0.132	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-54.7	-29.3	170.9	-61.8	174.8	-167.5	-76.4	4.7	113.3	E280 W327 P328 N329 D334 P335 S342	E280-R337 IonicContact OE1-NE 3.37Å; E280-R337 PolarHBondContact OE1-NE 2.98Å; W327-R337 HydrophobicContact CZ3-CB 4.25Å; P328-R337 PolarHBondContact O-NH1 3.15Å; P328-R337 PolarHBondContact O-NH2 2.99Å; N329-R337 PolarHBondContact O-NH2 2.93Å; D334-R337 HydrophobicContact CB-CG 4.28Å; D334-R337 WeakPolarHBondContact O-CD 3.39Å; D334-R337 VanDerWaalsContact O-CG 3.26Å; D334-R337 WeakPolarHBondContact O-CG 3.31Å; D334-R337 PolarHBondContact O-N 2.97Å; P335-R337 PolarHBondContact O-N 3.38Å; R337-S342 VanDerWaalsContact O-CB 3.27Å; R337-S342 WeakPolarHBondContact O-CB 3.39Å; R337-S342 PolarHBondContact O-OG 3.42Å
338	F	92.9	Very high	87.2	Confident	22 Å²	22	64 Å²	64	10%	0.096	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-102.5	13.8	-179.5	-61.8	-77.4	0	0	0	113.5	M276 K279 E280 R283 W327 P335 S336 F349	M276-F338 HydrophobicContact CB-CB 4.3Å; M276-F338 HydrophobicContact CG-CB 3.99Å; K279-F338 HydrophobicContact CB-CB 4.34Å; K279-F338 HydrophobicContact CB-CD1 3.85Å; K279-F338 HydrophobicContact CB-CD2 3.6Å; K279-F338 HydrophobicContact CB-CE1 3.94Å; K279-F338 HydrophobicContact CB-CE2 3.72Å; K279-F338 HydrophobicContact CB-CG 3.65Å; K279-F338 HydrophobicContact CB-CZ 3.86Å; K279-F338 HydrophobicContact CD-CB 3.98Å; K279-F338 HydrophobicContact CD-CD1 3.68Å; K279-F338 HydrophobicContact CD-CE1 4.3Å; K279-F338 HydrophobicContact CD-CG 3.85Å; K279-F338 HydrophobicContact CG-CD1 4.37Å; K279-F338 HydrophobicContact CG-CG 4.43Å; E280-F338 HydrophobicContact CB-CD2 4.28Å; E280-F338 HydrophobicContact CB-CE2 4.03Å; E280-F338 WeakPolarHBondContact OE2-CE2 3.47Å; R283-F338 HydrophobicContact CB-CZ 4.34Å; W327-F338 AromaticContact CH2-CE1 3.86Å; W327-F338 HydrophobicContact CH2-CE1 3.86Å; W327-F338 HydrophobicContact CH2-CE2 4.36Å; W327-F338 AromaticContact CH2-CZ 3.52Å; W327-F338 HydrophobicContact CH2-CZ 3.52Å; W327-F338 HydrophobicContact CZ3-CZ 4.06Å; P335-F338 PolarHBondContact O-N 2.9Å; S336-F338 PolarHBondContact O-N 2.94Å; S336-F338 VanDerWaalsContact O-N 3.13Å; F338-F349 HydrophobicContact CE1-CB 4.37Å; F338-F349 AromaticContact CE1-CD1 3.95Å; F338-F349 HydrophobicContact CE1-CD1 3.95Å; F338-F349 AromaticContact CE1-CD2 3.89Å; F338-F349 HydrophobicContact CE1-CD2 3.89Å; F338-F349 HydrophobicContact CE1-CE1 4.14Å; F338-F349 HydrophobicContact CE1-CE2 4.09Å; F338-F349 AromaticContact CE1-CG 3.8Å; F338-F349 HydrophobicContact CE1-CG 3.8Å; F338-F349 HydrophobicContact CE1-CZ 4.19Å; F338-F349 AromaticContact CZ-CD2 3.73Å; F338-F349 HydrophobicContact CZ-CD2 3.73Å; F338-F349 AromaticContact CZ-CE2 3.72Å; F338-F349 HydrophobicContact CZ-CE2 3.72Å; F338-F349 HydrophobicContact CZ-CG 4.14Å; F338-F349 HydrophobicContact CZ-CZ 4.11Å
339	A	90.8	Very high	87.5	Confident	33 Å²	33	62.2 Å²	62.2	27%	0.273	38%	0.381	S	S	.	.	S	Bend	trans	-63	149.5	174.4	0	0	0	0	0	111.5	M276 S336 G341 S342	M276-A339 HydrophobicContact CE-CB 4.35Å; M276-A339 HydrophobicContact SD-CB 4.14Å; S336-A339 WeakPolarHBondContact O-CB 3.25Å; S336-A339 PolarHBondContact O-N 3.07Å; A339-G341 PolarHBondContact O-N 3.36Å; A339-S342 WeakPolarHBondContact O-CB 3.33Å; A339-S342 PolarHBondContact O-N 3.35Å; A339-S342 VanDerWaalsContact O-N 3.14Å; A339-S342 PolarHBondContact O-OG 3.32Å
340	P	86.2	Confident	87.8	Confident	119 Å²	119	57 Å²	57	77%	0.773	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	132.6	175.5	-24.2	33.6	0	0	0	111.6
341	G	81.1	Confident	88.2	Confident	85 Å²	85	56.3 Å²	56.3	88%	0.876	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	-0.3	-178.9	0	0	0	0	0	115.1	A339 A343	A339-G341 PolarHBondContact O-N 3.36Å; G341-A343 PolarHBondContact O-N 3.41Å
342	S	79.9	Confident	88.8	Confident	58 Å²	58	56.6 Å²	56.6	41%	0.406	35%	0.349	S	S	.	.			trans	-64.8	121.7	169.9	68.5	0	0	0	0	110.4	R337 A339 Q344	R337-S342 VanDerWaalsContact O-CB 3.27Å; R337-S342 WeakPolarHBondContact O-CB 3.39Å; R337-S342 PolarHBondContact O-OG 3.42Å; A339-S342 WeakPolarHBondContact O-CB 3.33Å; A339-S342 PolarHBondContact O-N 3.35Å; A339-S342 VanDerWaalsContact O-N 3.14Å; A339-S342 PolarHBondContact O-OG 3.32Å; S342-Q344 PolarHBondContact O-N 3.08Å; S342-Q344 VanDerWaalsContact O-N 3.15Å
343	A	68.8	Low	88.7	Confident	112 Å²	112	54.3 Å²	54.3	93%	0.926	34%	0.337	S	S	*	.			trans	-78.9	99.8	178.1	0	0	0	0	0	108.6	G341	G341-A343 PolarHBondContact O-N 3.41Å
344	Q	78.4	Confident	88.4	Confident	62 Å²	62	53.5 Å²	53.5	29%	0.29	34%	0.338	S	S	.	.			trans	-118.7	141.9	176.3	-163.3	169	32.4	0	0	111.7	S342 S346 A348	S342-Q344 PolarHBondContact O-N 3.08Å; S342-Q344 VanDerWaalsContact O-N 3.15Å; Q344-S346 PolarHBondContact O-N 3.12Å; Q344-A348 HydrophobicContact CG-CB 3.66Å
345	H	83.3	Confident	88.2	Confident	68 Å²	68	53.9 Å²	53.9	32%	0.315	36%	0.355	S	S	.	.			trans	-57.1	134	170.7	-174.7	-85.2	0	0	0	110.1	P102 D103 H347 A348	P102-H345 HydrophobicContact CB-CB 4.35Å; P102-H345 WeakPolarHBondContact CB-ND1 3.35Å; D103-H345 IonicContact OD1-CE1 3.19Å; D103-H345 IonicContact OD1-NE2 3.37Å; D103-H345 PolarHBondContact OD1-NE2 3.03Å; H345-H347 PolarHBondContact ND1-N 3.49Å; H345-H347 VanDerWaalsContact ND1-N 3.17Å; H345-H347 PolarHBondContact O-N 2.84Å; H345-A348 HydrophobicContact CB-CB 4.16Å; H345-A348 VanDerWaalsContact O-CB 3.26Å; H345-A348 WeakPolarHBondContact O-CB 3.4Å; H345-A348 PolarHBondContact O-N 3.01Å
346	S	85.3	Confident	87.6	Confident	84 Å²	84	56 Å²	56	59%	0.587	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.8	-171.9	55.6	0	0	0	0	115.3	Q344	Q344-S346 PolarHBondContact O-N 3.12Å
347	H	92.8	Very high	87	Confident	37 Å²	37	55.3 Å²	55.3	17%	0.171	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	24.7	-179.8	-66.6	69.5	0	0	0	112.8	M105 K106 L320 H345 L350	M105-H347 HydrophobicContact CB-CB 4.49Å; K106-H347 HydrophobicContact CB-CB 4.26Å; L320-H347 WeakPolarHBondContact CD2-O 3.26Å; H345-H347 PolarHBondContact ND1-N 3.49Å; H345-H347 VanDerWaalsContact ND1-N 3.17Å; H345-H347 PolarHBondContact O-N 2.84Å; H347-L350 HydrophobicContact CB-CD1 4.22Å
348	A	92.8	Very high	86.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	-83.1	-23.1	175.7	0	0	0	0	0	113.8	V326 Q344 H345	V326-A348 HydrophobicContact CG1-CB 3.43Å; V326-A348 VanDerWaalsContact CG1-CB 3.43Å; Q344-A348 HydrophobicContact CG-CB 3.66Å; H345-A348 HydrophobicContact CB-CB 4.16Å; H345-A348 VanDerWaalsContact O-CB 3.26Å; H345-A348 WeakPolarHBondContact O-CB 3.4Å; H345-A348 PolarHBondContact O-N 3.01Å
349	F	95.1	Very high	86.5	Confident	43 Å²	43	58.1 Å²	58.1	19%	0.189	38%	0.381	C	S	.	.			trans	-128.6	106.7	-177.8	-178.5	-110.3	0	0	0	109.4	K279 L282 R283 H321 W327 F338 P351	K279-F349 HydrophobicContact CB-CE1 4.26Å; K279-F349 HydrophobicContact CB-CZ 3.91Å; K279-F349 HydrophobicContact CD-CE1 4.48Å; K279-F349 HydrophobicContact CG-CE1 4.03Å; K279-F349 HydrophobicContact CG-CZ 4.11Å; K279-F349 VanDerWaalsContact O-CE2 3.26Å; K279-F349 WeakPolarHBondContact O-CE2 3.37Å; K279-F349 WeakPolarHBondContact O-CZ 3.36Å; L282-F349 HydrophobicContact CB-CE2 4.28Å; L282-F349 HydrophobicContact CB-CZ 4.01Å; R283-F349 HydrophobicContact CB-CD2 4.32Å; R283-F349 HydrophobicContact CB-CE2 3.98Å; H321-F349 AromaticContact CE1-CD2 3.96Å; H321-F349 AromaticContact NE2-CD2 3.81Å; W327-F349 HydrophobicContact CH2-CB 4.35Å; W327-F349 HydrophobicContact CH2-CD2 4.33Å; W327-F349 HydrophobicContact CZ2-CB 4.09Å; W327-F349 HydrophobicContact CZ2-CD2 4.25Å; F338-F349 HydrophobicContact CE1-CB 4.37Å; F338-F349 AromaticContact CE1-CD1 3.95Å; F338-F349 HydrophobicContact CE1-CD1 3.95Å; F338-F349 AromaticContact CE1-CD2 3.89Å; F338-F349 HydrophobicContact CE1-CD2 3.89Å; F338-F349 HydrophobicContact CE1-CE1 4.14Å; F338-F349 HydrophobicContact CE1-CE2 4.09Å; F338-F349 AromaticContact CE1-CG 3.8Å; F338-F349 HydrophobicContact CE1-CG 3.8Å; F338-F349 HydrophobicContact CE1-CZ 4.19Å; F338-F349 AromaticContact CZ-CD2 3.73Å; F338-F349 HydrophobicContact CZ-CD2 3.73Å; F338-F349 AromaticContact CZ-CE2 3.72Å; F338-F349 HydrophobicContact CZ-CE2 3.72Å; F338-F349 HydrophobicContact CZ-CG 4.14Å; F338-F349 HydrophobicContact CZ-CZ 4.11Å; F349-P351 VanDerWaalsContact C-CD 3.49Å; F349-P351 HydrophobicContact CD1-CG 4.17Å; F349-P351 HydrophobicContact CE1-CG 3.56Å; F349-P351 HydrophobicContact CE2-CG 4.03Å; F349-P351 HydrophobicContact CZ-CB 4.34Å; F349-P351 HydrophobicContact CZ-CG 3.49Å; F349-P351 VanDerWaalsContact CZ-CG 3.49Å
350	L	94.6	Very high	86.2	Confident	14 Å²	14	59.5 Å²	59.5	7%	0.073	39%	0.387	C	S	.	.			trans	-134.6	49.8	-171.3	-63.3	174.7	0	0	0	112.6	M105 L109 L320 H321 H347 F352 S353	M105-L350 HydrophobicContact CB-CD1 4.09Å; M105-L350 HydrophobicContact CG-CD1 4.4Å; L109-L350 HydrophobicContact CD1-CD1 3.55Å; L320-L350 HydrophobicContact CD2-CB 4.18Å; L320-L350 HydrophobicContact CD2-CD1 3.75Å; L320-L350 HydrophobicContact CD2-CG 4.06Å; H321-L350 PolarHBondContact NE2-N 3.25Å; H347-L350 HydrophobicContact CB-CD1 4.22Å; L350-F352 PolarHBondContact O-N 3.24Å; L350-F352 VanDerWaalsContact O-N 3.12Å; L350-S353 PolarHBondContact O-N 3.03Å; L350-S353 VanDerWaalsContact O-N 3.16Å
351	P	92.6	Very high	86.2	Confident	11 Å²	11	56 Å²	56	7%	0.071	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.3	-179.6	30.4	-38.9	0	0	0	113.1	L282 F349	L282-P351 HydrophobicContact CB-CB 3.96Å; L282-P351 HydrophobicContact CB-CG 4.38Å; L282-P351 HydrophobicContact CD1-CB 4.3Å; L282-P351 HydrophobicContact CD1-CG 4.31Å; F349-P351 VanDerWaalsContact C-CD 3.49Å; F349-P351 HydrophobicContact CD1-CG 4.17Å; F349-P351 HydrophobicContact CE1-CG 3.56Å; F349-P351 HydrophobicContact CE2-CG 4.03Å; F349-P351 HydrophobicContact CZ-CB 4.34Å; F349-P351 HydrophobicContact CZ-CG 3.49Å; F349-P351 VanDerWaalsContact CZ-CG 3.49Å
352	F	92.4	Very high	86.6	Confident	164 Å²	164	54.2 Å²	54.2	72%	0.719	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	28.8	178.7	-55.8	-66.3	0	0	0	112.6	L282 L350	L282-F352 HydrophobicContact CD1-CE2 3.92Å; L282-F352 HydrophobicContact CD1-CZ 3.91Å; L350-F352 PolarHBondContact O-N 3.24Å; L350-F352 VanDerWaalsContact O-N 3.12Å
353	S	90.3	Very high	87	Confident	27 Å²	27	53.9 Å²	53.9	19%	0.189	33%	0.328	C	S	.	.			trans	61.5	-168.1	-173.7	-176	0	0	0	0	112.1	I291 L350 R357	I291-S353 VanDerWaalsContact CD1-OG 3.3Å; I291-S353 WeakPolarHBondContact CD1-OG 3.45Å; L350-S353 PolarHBondContact O-N 3.03Å; L350-S353 VanDerWaalsContact O-N 3.16Å; S353-R357 PolarHBondContact OG-O 3.43Å; S353-R357 VanDerWaalsContact OG-O 3.08Å
354	G	88.6	Confident	88.3	Confident	18 Å²	18	49.8 Å²	49.8	19%	0.186	29%	0.285	C	S	.	.			trans	-155	174.3	174.2	0	0	0	0	0	112
355	G	88.1	Confident	89.1	Confident	60 Å²	60	48.8 Å²	48.8	62%	0.619	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	-149.1	-178.2	0	0	0	0	0	112.7	R357	G355-R357 VanDerWaalsContact C-N 3.29Å; G355-R357 PolarHBondContact O-N 3.05Å
356	S	82.1	Confident	89.6	Confident	53 Å²	53	47.3 Å²	47.3	37%	0.371	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-14.7	-172.2	61.2	0	0	0	0	114.5	W139	W139-S356 WeakPolarHBondContact CH2-O 3.49Å; W139-S356 WeakPolarHBondContact CZ2-O 3.44Å
357	R	80.1	Confident	90	Very high	56 Å²	56	43.9 Å²	43.9	21%	0.211	25%	0.254	C	S	.	.			trans	-130.2	0	-168.4	-43.7	-157.2	-171.5	-170.9	9.9	115.9	S112 D113 L134 N135 W139 R293 S353 G355	S112-R357 PolarHBondContact O-NH2 2.83Å; D113-R357 PolarHBondContact O-NH2 3.11Å; L134-R357 PolarHBondContact O-NH1 3.37Å; N135-R357 PolarHBondContact OD1-NH1 3.3Å; N135-R357 PolarHBondContact OD1-NH2 3.5Å; W139-R357 HydrophobicContact CH2-CG 4.1Å; W139-R357 HydrophobicContact CZ2-CB 4.18Å; W139-R357 HydrophobicContact CZ2-CG 3.73Å; R293-R357 VanDerWaalsContact NH1-CD 3.33Å; S353-R357 PolarHBondContact OG-O 3.43Å; S353-R357 VanDerWaalsContact OG-O 3.08Å; G355-R357 VanDerWaalsContact C-N 3.29Å; G355-R357 PolarHBondContact O-N 3.05Å

Retrieved 357 of 357 residues in 803.1 ms (Link to these results)

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