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ATP-binding cassette sub-family G member 5

ABCG5 and ABCG8 form an obligate heterodimer that mediates Mg(2+)- and ATP-dependent sterol transport across the cell membrane^1,2,3. Plays an essential role in the selective transport of dietary plant sterols and cholesterol in and out of the enterocytes and in the selective sterol excretion by the liver into bile^4,5,6,7,8. Required for normal sterol homeostasis^9,10. The heterodimer with ABCG8 has ATPase activity^11,12.

AlphaFold DB , UniProt , Accession Q99PE8, Species MOUSE (Mus musculus, Mouse), Gene Abcg5, Length 652 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	38.9	Very low	256 Å²	256	153.4 Å²	153.4	100%	1.261	88%	0.879	S	S	*	*				0	104.3	0	-75.1	169.6	169.9	0	0	108.3
2	G	52.3	Low	39	Very low	82 Å²	82	149.7 Å²	149.7	85%	0.845	88%	0.88	S	S	*	*			cis	-147.4	139.1	-7.6	0	0	0	0	0	108.7
3	E	34	Very low	38.8	Very low	193 Å²	193	157.9 Å²	157.9	90%	0.902	89%	0.887	S	S	*	*			trans	-82.1	151.2	168.5	-66	-177.8	139.2	0	0	109.9
4	L	46.7	Very low	38.6	Very low	175 Å²	175	151.8 Å²	151.8	92%	0.916	88%	0.877	S	S	*	*			trans	-150.5	124.4	153	-102.7	162.8	0	0	0	109.5
5	P	38.4	Very low	38.6	Very low	116 Å²	116	150.6 Å²	150.6	75%	0.753	88%	0.876	S	S	*	*			trans	-103.1	174.1	-171.6	38.8	-32.2	0	0	0	114.8
6	F	32.5	Very low	38.2	Very low	196 Å²	196	151.6 Å²	151.6	86%	0.86	87%	0.87	S	S	*	*			trans	-36.3	143.8	174.9	-95.1	-103.7	0	0	0	117.8
7	L	41	Very low	38.4	Very low	170 Å²	170	152.9 Å²	152.9	89%	0.89	87%	0.871	S	S	*	*			trans	-156.8	117.9	153.4	-105.7	151.7	0	0	0	110.8
8	S	33.6	Very low	38	Very low	99 Å²	99	152.1 Å²	152.1	69%	0.692	86%	0.864	S	S	*	*			trans	-90.8	157.2	159.2	-35.1	0	0	0	0	108.9
9	P	40.5	Very low	37.9	Very low	123 Å²	123	157.3 Å²	157.3	80%	0.799	87%	0.868	S	S	*	*				-149.6	158.8	118.8	31.1	-10.6	0	0	0	117.3
10	E	35.7	Very low	37.6	Very low	197 Å²	197	152.8 Å²	152.8	92%	0.921	86%	0.859	S	S	*	*			trans	-11.7	143.1	162.6	-58.8	-179.8	142.5	0	0	122.9
11	G	34.2	Very low	37.3	Very low	80 Å²	80	151 Å²	151	83%	0.825	86%	0.857	S	S	*	*				113.2	111.6	111.3	0	0	0	0	0	119.8
12	A	39.6	Very low	37	Very low	109 Å²	109	146.7 Å²	146.7	90%	0.901	84%	0.838	S	S	*	*			trans	-168.6	129.2	142.5	0	0	0	0	0	113.8
13	R	36.2	Very low	35.9	Very low	257 Å²	257	148.4 Å²	148.4	97%	0.97	84%	0.837	S	S	*	*			trans	-68.3	164.4	175.5	-62.2	165.6	174.2	176.1	-2.9	112.1
14	G	35.9	Very low	35.6	Very low	72 Å²	72	143.5 Å²	143.5	74%	0.742	82%	0.824	S	S	*	*			cis	173.4	-159.4	13.3	0	0	0	0	0	106.9
15	P	39	Very low	34.8	Very low	134 Å²	134	142.4 Å²	142.4	87%	0.87	82%	0.819	S	S	*	*			cis	-134	179	-6.2	40.1	-20	0	0	0	116.1
16	H	31.7	Very low	34.4	Very low	166 Å²	166	146.4 Å²	146.4	77%	0.769	83%	0.827	S	S	*	*			trans	-65.8	152	-176	-76.3	-99.1	0	0	0	118.1
17	I	41.7	Very low	34.1	Very low	175 Å²	175	145.6 Å²	145.6	90%	0.897	83%	0.826	S	S	*	*			trans	-133.8	122.3	143.7	-64.6	-179	0	0	0	109.6
18	N	31.8	Very low	33.4	Very low	137 Å²	137	141.1 Å²	141.1	73%	0.733	82%	0.821	S	S	*	*			trans	-81.1	146.1	175.7	-91.6	-24	0	0	0	112.4
19	R	35.4	Very low	33	Very low	251 Å²	251	141.5 Å²	141.5	95%	0.947	82%	0.824	S	S	*	*				-178.5	114	127.6	-104.6	174.8	-179.4	-175	0.9	113.2
20	G	33.2	Very low	32.4	Very low	67 Å²	67	142 Å²	142	69%	0.691	82%	0.824	S	S	*	*				74.9	95.3	122.1	0	0	0	0	0	120.3
21	S	30.5	Very low	32.1	Very low	116 Å²	116	138.6 Å²	138.6	81%	0.811	82%	0.817	S	S	*	*			trans	40.8	102.6	132.8	64.1	0	0	0	0	119.9
22	L	33.7	Very low	31.7	Very low	165 Å²	165	138.4 Å²	138.4	86%	0.864	82%	0.815	S	S	*	*			trans	-149	96.7	142.4	-110.9	128.3	0	0	0	109.4	S24	L22-S24 PolarHBondContact O-N 3.3Å
23	S	27.8	Very low	31.7	Very low	119 Å²	119	139.2 Å²	139.2	83%	0.832	81%	0.809	S	S	*	*			trans	-76.2	106.7	163.6	50	0	0	0	0	108.7
24	S	28.3	Very low	32.5	Very low	90 Å²	90	135.4 Å²	135.4	63%	0.629	80%	0.802	S	S	*	*			trans	171.3	136	148.5	38	0	0	0	0	110.8	L22	L22-S24 PolarHBondContact O-N 3.3Å
25	L	29.3	Very low	33.7	Very low	152 Å²	152	134.5 Å²	134.5	80%	0.796	79%	0.788	S	S	*	*			trans	67.4	80.9	158.4	-72.3	143.9	0	0	0	117.9
26	E	30.3	Very low	35.4	Very low	199 Å²	199	135 Å²	135	93%	0.93	77%	0.772	S	S	*	*			trans	-133.4	95.6	144.8	-83.4	-170.8	147.6	0	0	109.9	G28	E26-G28 PolarHBondContact O-N 3.19Å
27	Q	27.1	Very low	38	Very low	179 Å²	179	128 Å²	128	84%	0.836	74%	0.74	S	S	*	*			trans	-60.8	111.6	158.6	-78.9	164.9	-34.1	0	0	107.7	S29	Q27-S29 PolarHBondContact O-N 3.3Å; Q27-S29 VanDerWaalsContact O-N 3.08Å
28	G	25.8	Very low	40.2	Very low	76 Å²	76	120.3 Å²	120.3	78%	0.784	70%	0.702	S	S	*	*			trans	-59.8	110.5	169.8	0	0	0	0	0	109.9	E26 V30	E26-G28 PolarHBondContact O-N 3.19Å; G28-V30 PolarHBondContact O-N 3.01Å
29	S	25.9	Very low	43	Very low	107 Å²	107	113.8 Å²	113.8	75%	0.748	67%	0.667	S	S	*	*			trans	-63.4	122.2	175.3	43	0	0	0	0	110.4	Q27 T31	Q27-S29 PolarHBondContact O-N 3.3Å; Q27-S29 VanDerWaalsContact O-N 3.08Å; S29-T31 PolarHBondContact O-N 3.01Å
30	V	27.9	Very low	45.7	Very low	135 Å²	135	102 Å²	102	82%	0.818	62%	0.623	S	S	*	*			trans	-60.1	106.1	166.8	176.2	0	0	0	0	107.5	G28 G32	G28-V30 PolarHBondContact O-N 3.01Å; V30-G32 PolarHBondContact O-N 3.21Å
31	T	29.2	Very low	48.5	Very low	125 Å²	125	98.8 Å²	98.8	77%	0.767	59%	0.59	S	S	*	*			trans	-62.2	119.4	170.9	40.1	0	0	0	0	108.7	S29 T33	S29-T31 PolarHBondContact O-N 3.01Å; T31-T33 PolarHBondContact O-N 3.32Å; T31-T33 VanDerWaalsContact O-N 3.14Å
32	G	26	Very low	51.5	Low	76 Å²	76	94.2 Å²	94.2	78%	0.784	56%	0.556	S	S	*	*			trans	-56.9	114.7	-175	0	0	0	0	0	112.1	V30 E34	V30-G32 PolarHBondContact O-N 3.21Å; G32-E34 PolarHBondContact O-N 2.64Å
33	T	40	Very low	54.2	Low	126 Å²	126	90 Å²	90	77%	0.773	53%	0.532	S	S	*	.			trans	-70.1	109.2	170.3	-0.9	0	0	0	0	107.3	T31 A35	T31-T33 PolarHBondContact O-N 3.32Å; T31-T33 VanDerWaalsContact O-N 3.14Å; T33-A35 PolarHBondContact O-N 3.42Å
34	E	53.1	Low	57.2	Low	177 Å²	177	84.4 Å²	84.4	83%	0.827	49%	0.493	S	S	*	.			trans	-50.2	130.5	172.1	-72.9	-175.9	156.2	0	0	109.3	G32 R36	G32-E34 PolarHBondContact O-N 2.64Å; E34-R36 PolarHBondContact O-N 3.18Å
35	A	59.4	Low	60.2	Low	53 Å²	53	80.7 Å²	80.7	44%	0.438	47%	0.467	S	S	.	.			trans	-62.9	112.3	-175.2	0	0	0	0	0	109.5	T33 L352	T33-A35 PolarHBondContact O-N 3.42Å; A35-L352 HydrophobicContact CB-CD1 3.65Å; A35-L352 HydrophobicContact CB-CD2 3.8Å; A35-L352 HydrophobicContact CB-CG 3.6Å
36	R	76.4	Confident	63.1	Low	143 Å²	143	73.8 Å²	73.8	54%	0.54	43%	0.43	S	S	.	.			trans	-80.5	141.2	178.5	-66.2	-178.9	176.1	176.1	-4.5	110.4	E34 E78 L352	E34-R36 PolarHBondContact O-N 3.18Å; R36-E78 IonicContact NH1-OE2 2.8Å; R36-L352 WeakPolarHBondContact O-CD1 3.38Å
37	H	84.7	Confident	65.9	Low	20 Å²	20	65.7 Å²	65.7	9%	0.093	40%	0.396	C	S	.	.			trans	-59.5	145.9	168.6	-65	-64.4	0	0	0	110.5	E78 S79 N117 D243 I245	H37-E78 CarbonylContact O-C 3.48Å; H37-E78 WeakPolarHBondContact O-CA 3.38Å; H37-S79 PolarHBondContact O-N 3.05Å; H37-N117 WeakPolarHBondContact CA-OD1 3.41Å; H37-N117 WeakPolarHBondContact CB-OD1 3.31Å; H37-N117 PolarHBondContact ND1-ND2 2.86Å; H37-N117 PolarHBondContact ND1-OD1 3.27Å; H37-D243 IonicContact CD2-OD2 3.82Å; H37-I245 HydrophobicContact CB-CD1 4.34Å
38	S	88.4	Confident	68.6	Low	14 Å²	14	58.2 Å²	58.2	10%	0.098	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.8	179.5	54.7	0	0	0	0	111.1	V116 N117	S38-V116 WeakPolarHBondContact O-CA 3.47Å; S38-N117 PolarHBondContact N-OD1 2.95Å; S38-N117 PolarHBondContact O-N 2.86Å
39	L	90.9	Very high	70.9	Confident	0 Å²	0	57 Å²	57	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	117.6	172.4	171.2	72.6	0	0	0	108.1	Y76 I77 V114 F115 V116 F130 V214 I245 I247	L39-Y76 WeakPolarHBondContact O-CA 3.11Å; L39-I77 HydrophobicContact CB-CG2 3.7Å; L39-I77 HydrophobicContact CD2-CG2 3.88Å; L39-I77 HydrophobicContact CG-CG2 4.13Å; L39-I77 PolarHBondContact N-O 3.37Å; L39-I77 PolarHBondContact O-N 3.49Å; L39-V114 HydrophobicContact CD1-CG1 3.87Å; L39-F115 CarbonylContact C-O 3.48Å; L39-F115 WeakPolarHBondContact CA-O 3.3Å; L39-V116 HydrophobicContact CD1-CG2 3.82Å; L39-F130 HydrophobicContact CD1-CE1 3.86Å; L39-F130 HydrophobicContact CD1-CZ 3.76Å; L39-F130 HydrophobicContact CD2-CE1 4.14Å; L39-V214 HydrophobicContact CD2-CG1 4.13Å; L39-I245 HydrophobicContact CB-CD1 3.91Å; L39-I245 HydrophobicContact CD2-CG2 4.34Å; L39-I247 HydrophobicContact CD2-CD1 3.57Å
40	G	91.3	Very high	72.9	Confident	2 Å²	2	56.8 Å²	56.8	2%	0.021	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.7	174.4	0	0	0	0	0	110.4	L75 F115	G40-L75 CarbonylContact C-O 2.91Å; G40-L75 WeakPolarHBondContact CA-O 3.08Å; G40-F115 PolarHBondContact N-O 2.88Å; G40-F115 PolarHBondContact O-N 2.99Å
41	V	92.6	Very high	74.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128.4	174.1	176.7	0	0	0	0	106.1	V44 S74 L75 I100 V114 I343	V41-V44 HydrophobicContact CG1-CB 3.84Å; V41-V44 HydrophobicContact CG1-CG2 3.33Å; V41-S74 CarbonylContact O-C 3.59Å; V41-S74 WeakPolarHBondContact O-CA 3.07Å; V41-L75 HydrophobicContact CB-CD1 3.77Å; V41-L75 HydrophobicContact CB-CG 3.79Å; V41-L75 HydrophobicContact CG1-CG 4.49Å; V41-L75 HydrophobicContact CG2-CD1 3.43Å; V41-L75 VanDerWaalsContact CG2-CD1 3.43Å; V41-L75 HydrophobicContact CG2-CG 3.93Å; V41-L75 PolarHBondContact N-O 3.04Å; V41-L75 PolarHBondContact O-N 3.32Å; V41-I100 HydrophobicContact CG2-CD1 4.05Å; V41-I100 HydrophobicContact CG2-CG1 4.03Å; V41-V114 HydrophobicContact CG2-CG1 4.29Å; V41-V114 HydrophobicContact CG2-CG2 4.38Å; V41-I343 WeakPolarHBondContact O-CD1 3.49Å
42	L	92.8	Very high	76.1	Confident	20 Å²	20	54.9 Å²	54.9	11%	0.105	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.4	-174.9	-175.5	69.1	0	0	0	110.7	V44 G112 E113 F115 L340	L42-V44 PolarHBondContact O-N 3.25Å; L42-V44 VanDerWaalsContact O-N 3.16Å; L42-G112 WeakPolarHBondContact O-CA 3.31Å; L42-E113 PolarHBondContact N-O 3.05Å; L42-E113 PolarHBondContact O-N 3Å; L42-F115 HydrophobicContact CB-CE2 4.17Å; L42-L340 HydrophobicContact CD1-CD1 3.33Å
43	H	91.1	Very high	77.5	Confident	77 Å²	77	53.4 Å²	53.4	36%	0.356	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.7	38.6	170.1	-64.2	-58.7	0	0	0	114	S45 D72 V73 S74 G112	H43-S45 PolarHBondContact O-N 2.99Å; H43-D72 WeakPolarHBondContact CA-OD1 3.46Å; H43-D72 WeakPolarHBondContact CB-OD1 3.14Å; H43-D72 IonicContact CE1-OD1 3.72Å; H43-D72 IonicContact CE1-OD2 2.76Å; H43-D72 IonicContact CG-OD1 2.64Å; H43-D72 VanDerWaalsContact ND1-CG 3.32Å; H43-D72 IonicContact ND1-OD1 3.74Å; H43-D72 PolarHBondContact ND1-OD1 2.64Å; H43-D72 IonicContact ND1-OD2 3.73Å; H43-D72 PolarHBondContact ND1-OD2 3.38Å; H43-V73 PolarHBondContact N-O 2.64Å; H43-S74 PolarHBondContact N-OG 3.28Å; H43-G112 WeakPolarHBondContact O-CA 3.27Å
44	V	90.8	Very high	78.5	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	119.1	-176.3	169.3	0	0	0	0	111.2	V41 L42 D72 V73 A99 L110 E111 V114	V41-V44 HydrophobicContact CG1-CB 3.84Å; V41-V44 HydrophobicContact CG1-CG2 3.33Å; L42-V44 PolarHBondContact O-N 3.25Å; L42-V44 VanDerWaalsContact O-N 3.16Å; V44-D72 PolarHBondContact O-N 2.99Å; V44-V73 PolarHBondContact N-O 3.35Å; V44-V73 PolarHBondContact O-N 3.39Å; V44-A99 HydrophobicContact CG1-CB 4.4Å; V44-L110 HydrophobicContact CG1-CD1 3.77Å; V44-E111 VanDerWaalsContact CA-O 3.31Å; V44-E111 WeakPolarHBondContact CA-O 3.03Å; V44-V114 HydrophobicContact CG2-CG2 4.36Å
45	S	91.9	Very high	79	Confident	12 Å²	12	51.2 Å²	51.2	8%	0.084	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	143	175.5	-63.9	0	0	0	0	110.5	H43 L70 D72 L110 E111	H43-S45 PolarHBondContact O-N 2.99Å; S45-L70 WeakPolarHBondContact CA-O 3.31Å; S45-D72 PolarHBondContact OG-N 3.24Å; S45-L110 WeakPolarHBondContact O-CA 3.48Å; S45-E111 PolarHBondContact N-O 3.46Å; S45-E111 PolarHBondContact O-N 3.44Å
46	Y	90.6	Very high	79.6	Confident	7 Å²	7	57.1 Å²	57.1	3%	0.027	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	125.7	178.9	-176.9	-116.2	0	0	0	111.3	V48 I69 L70 T95 L104 R105 T109 L110	Y46-V48 HydrophobicContact CD1-CG2 4.02Å; Y46-V48 HydrophobicContact CE1-CG2 3.21Å; Y46-I69 HydrophobicContact CD1-CB 4.43Å; Y46-I69 HydrophobicContact CD1-CD1 4.5Å; Y46-I69 HydrophobicContact CE1-CD1 4.47Å; Y46-I69 PolarHBondContact O-N 3.35Å; Y46-L70 PolarHBondContact N-O 3.21Å; Y46-L70 PolarHBondContact O-N 3Å; Y46-L70 VanDerWaalsContact O-N 3.13Å; Y46-T95 HydrophobicContact CD1-CG2 3.81Å; Y46-T95 HydrophobicContact CE1-CG2 4.21Å; Y46-L104 HydrophobicContact CD1-CD1 4.05Å; Y46-L104 HydrophobicContact CD1-CD2 4.03Å; Y46-L104 HydrophobicContact CD2-CD1 3.57Å; Y46-L104 HydrophobicContact CE1-CD1 4.18Å; Y46-L104 HydrophobicContact CE1-CD2 3.62Å; Y46-L104 HydrophobicContact CE1-CG 4.45Å; Y46-L104 HydrophobicContact CE2-CB 4.26Å; Y46-L104 HydrophobicContact CE2-CD1 3.71Å; Y46-L104 HydrophobicContact CE2-CD2 4.34Å; Y46-L104 HydrophobicContact CE2-CG 4.35Å; Y46-L104 HydrophobicContact CG-CD1 3.73Å; Y46-R105 PolarHBondContact OH-O 3.09Å; Y46-T109 WeakPolarHBondContact CA-O 3.49Å; Y46-T109 WeakPolarHBondContact CD2-O 3.49Å; Y46-L110 HydrophobicContact CD2-CB 4.27Å; Y46-L110 HydrophobicContact CD2-CD1 4.4Å
47	S	87.7	Confident	79.4	Confident	29 Å²	29	53.9 Å²	53.9	20%	0.203	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.9	173.7	43.2	0	0	0	0	112	R67 G108 T109	S47-R67 WeakPolarHBondContact CA-O 3.35Å; S47-G108 CarbonylContact O-C 3.5Å; S47-G108 WeakPolarHBondContact O-CA 3.48Å; S47-T109 PolarHBondContact N-O 3.44Å; S47-T109 VanDerWaalsContact N-O 3.08Å; S47-T109 PolarHBondContact O-N 3.01Å; S47-T109 PolarHBondContact OG-OG1 3.4Å
48	V	83.3	Confident	78.6	Confident	21 Å²	21	59.1 Å²	59.1	13%	0.127	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.4	177.1	178	0	0	0	0	109.4	Y46 D66 R67 I69	Y46-V48 HydrophobicContact CD1-CG2 4.02Å; Y46-V48 HydrophobicContact CE1-CG2 3.21Å; V48-D66 WeakPolarHBondContact O-CA 3.32Å; V48-R67 PolarHBondContact N-O 2.94Å; V48-R67 PolarHBondContact O-N 3.41Å; V48-I69 HydrophobicContact CB-CD1 4.15Å; V48-I69 HydrophobicContact CG2-CD1 3.44Å; V48-I69 VanDerWaalsContact CG2-CD1 3.44Å; V48-I69 HydrophobicContact CG2-CG1 4.3Å
49	S	74.2	Confident	77.5	Confident	50 Å²	50	66.9 Å²	66.9	35%	0.35	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	111.4	171.5	67.7	0	0	0	0	109.8	D66 T107	S49-D66 VanDerWaalsContact CA-OD1 3.3Å; S49-D66 WeakPolarHBondContact CA-OD1 3.48Å; S49-D66 WeakPolarHBondContact CB-OD1 2.96Å; S49-T107 PolarHBondContact OG-O 2.83Å
50	N	68.3	Low	76.1	Confident	104 Å²	104	67.8 Å²	67.8	56%	0.556	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	139.1	173.9	-89.5	-21.5	0	0	0	110.4	W65	N50-W65 PolarHBondContact N-O 2.99Å; N50-W65 PolarHBondContact O-N 2.97Å
51	R	65.4	Low	74.5	Confident	166 Å²	166	69 Å²	69	63%	0.626	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	131.5	170.5	-64.9	-176	-173.7	-163.3	2.5	109.1	C61 K64	R51-C61 WeakPolarHBondContact CD-O 3.46Å; R51-K64 HydrophobicContact CG-CG 4.47Å
52	V	60.1	Low	72.9	Confident	53 Å²	53	76.3 Å²	76.3	32%	0.321	38%	0.375	S	S	.	.			trans	-83.2	125.1	-179	-176.1	0	0	0	0	110	S60 C61 Q63 W65	V52-S60 CarbonylContact O-C 3.57Å; V52-S60 WeakPolarHBondContact O-CB 3.26Å; V52-S60 PolarHBondContact O-OG 3.3Å; V52-C61 PolarHBondContact O-N 3Å; V52-Q63 HydrophobicContact CB-CB 4.43Å; V52-Q63 PolarHBondContact N-O 3.41Å; V52-W65 HydrophobicContact CG2-CB 4.06Å; V52-W65 HydrophobicContact CG2-CD2 3.92Å; V52-W65 HydrophobicContact CG2-CG 3.57Å
53	G	55.6	Low	71.4	Confident	45 Å²	45	80.8 Å²	80.8	46%	0.464	40%	0.396	S	S	.	.	S	Bend	trans	91.6	171.1	169.3	0	0	0	0	0	115.7
54	P	60.1	Low	70.1	Confident	49 Å²	49	83.4 Å²	83.4	32%	0.318	41%	0.406	S	S	.	.			trans	-71.1	149.4	-172.1	28.7	-34.1	0	0	0	111.8	W56 N57	P54-W56 HydrophobicContact CB-CD2 3.56Å; P54-W56 HydrophobicContact CB-CE3 3.72Å; P54-W56 HydrophobicContact CB-CG 4.33Å; P54-W56 HydrophobicContact CB-CH2 3.41Å; P54-W56 VanDerWaalsContact CB-CH2 3.41Å; P54-W56 HydrophobicContact CB-CZ2 3.24Å; P54-W56 HydrophobicContact CB-CZ3 3.64Å; P54-W56 HydrophobicContact CG-CD2 4.05Å; P54-W56 VanDerWaalsContact CG-CE2 3.44Å; P54-W56 HydrophobicContact CG-CG 4.49Å; P54-W56 HydrophobicContact CG-CH2 4.25Å; P54-W56 HydrophobicContact CG-CZ2 3.57Å; P54-W56 PolarHBondContact O-N 3.25Å; P54-N57 HydrophobicContact CG-CB 4.36Å; P54-N57 PolarHBondContact O-N 3.18Å
55	W	64.6	Low	69.1	Low	209 Å²	209	91.8 Å²	91.8	79%	0.792	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.5	-175.5	61.9	-92.4	0	0	0	114.3
56	W	71.2	Confident	68.3	Low	176 Å²	176	96.9 Å²	96.9	67%	0.667	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-13.8	177.9	59.2	83.3	0	0	0	114.6	P54	P54-W56 HydrophobicContact CB-CD2 3.56Å; P54-W56 HydrophobicContact CB-CE3 3.72Å; P54-W56 HydrophobicContact CB-CG 4.33Å; P54-W56 HydrophobicContact CB-CH2 3.41Å; P54-W56 VanDerWaalsContact CB-CH2 3.41Å; P54-W56 HydrophobicContact CB-CZ2 3.24Å; P54-W56 HydrophobicContact CB-CZ3 3.64Å; P54-W56 HydrophobicContact CG-CD2 4.05Å; P54-W56 VanDerWaalsContact CG-CE2 3.44Å; P54-W56 HydrophobicContact CG-CG 4.49Å; P54-W56 HydrophobicContact CG-CH2 4.25Å; P54-W56 HydrophobicContact CG-CZ2 3.57Å; P54-W56 PolarHBondContact O-N 3.25Å
57	N	72.1	Confident	68	Low	76 Å²	76	105.1 Å²	105.1	41%	0.406	50%	0.495	S	S	.	.			trans	-98.4	94.7	175.1	-171	-7.7	0	0	0	109.7	P54 K59 S60 C61	P54-N57 HydrophobicContact CG-CB 4.36Å; P54-N57 PolarHBondContact O-N 3.18Å; N57-K59 PolarHBondContact O-N 3.07Å; N57-K59 PolarHBondContact OD1-N 3.42Å; N57-S60 WeakPolarHBondContact CB-OG 3.4Å; N57-S60 PolarHBondContact O-N 2.89Å; N57-S60 VanDerWaalsContact O-N 3.14Å; N57-S60 PolarHBondContact O-OG 3.3Å; N57-S60 VanDerWaalsContact O-OG 3.11Å; N57-C61 WeakPolarHBondContact O-CB 3.45Å; N57-C61 PolarHBondContact O-N 3.1Å
58	I	67.3	Low	67.9	Low	129 Å²	129	108.3 Å²	108.3	66%	0.662	51%	0.507	S	S	*	.	H	α-helix	trans	-55.8	-37.2	-175.3	-61.2	166.7	0	0	0	111.4	Q62	I58-Q62 WeakPolarHBondContact O-CG 3.47Å; I58-Q62 PolarHBondContact O-N 3.25Å
59	K	66.4	Low	68.2	Low	177 Å²	177	109.6 Å²	109.6	77%	0.77	51%	0.512	S	S	*	.	H	α-helix	trans	-68.5	-39.5	-179.3	-68.4	-171.3	179	-176.9	0	112.6	N57	N57-K59 PolarHBondContact O-N 3.07Å; N57-K59 PolarHBondContact OD1-N 3.42Å
60	S	61.6	Low	69	Low	20 Å²	20	107.2 Å²	107.2	14%	0.14	50%	0.496	C	S	.	.	H	α-helix	trans	-76	-40.5	177	71.8	0	0	0	0	111	V52 N57 Q62 Q63	V52-S60 CarbonylContact O-C 3.57Å; V52-S60 WeakPolarHBondContact O-CB 3.26Å; V52-S60 PolarHBondContact O-OG 3.3Å; N57-S60 WeakPolarHBondContact CB-OG 3.4Å; N57-S60 PolarHBondContact O-N 2.89Å; N57-S60 VanDerWaalsContact O-N 3.14Å; N57-S60 PolarHBondContact O-OG 3.3Å; N57-S60 VanDerWaalsContact O-OG 3.11Å; S60-Q62 PolarHBondContact O-N 3.28Å; S60-Q63 WeakPolarHBondContact O-CB 3.49Å; S60-Q63 PolarHBondContact O-N 3.42Å
61	C	57.3	Low	70.1	Confident	28 Å²	28	105.1 Å²	105.1	19%	0.189	48%	0.482	C	S	.	.	H	α-helix	trans	-60	-21.7	-178.7	-167.5	0	0	0	0	113.5	R51 V52 N57	R51-C61 WeakPolarHBondContact CD-O 3.46Å; V52-C61 PolarHBondContact O-N 3Å; N57-C61 WeakPolarHBondContact O-CB 3.45Å; N57-C61 PolarHBondContact O-N 3.1Å
62	Q	59.6	Low	71.4	Confident	152 Å²	152	99.6 Å²	99.6	71%	0.71	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-24	173.2	-75.6	-177.1	-15.5	0	0	114.1	I58 S60 K64	I58-Q62 WeakPolarHBondContact O-CG 3.47Å; I58-Q62 PolarHBondContact O-N 3.25Å; S60-Q62 PolarHBondContact O-N 3.28Å; Q62-K64 PolarHBondContact O-N 2.99Å; Q62-K64 VanDerWaalsContact O-N 3.1Å
63	Q	59.5	Low	72.9	Confident	114 Å²	114	97.1 Å²	97.1	53%	0.533	45%	0.45	S	S	.	.			trans	-73.8	105.1	174.8	-71.4	-173.2	-15.5	0	0	109.3	V52 S60	V52-Q63 HydrophobicContact CB-CB 4.43Å; V52-Q63 PolarHBondContact N-O 3.41Å; S60-Q63 WeakPolarHBondContact O-CB 3.49Å; S60-Q63 PolarHBondContact O-N 3.42Å
64	K	64.9	Low	74.8	Confident	133 Å²	133	95 Å²	95	58%	0.578	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.6	167.1	-68	-175.7	-178.2	-179.8	0	108.6	R51 Q62	R51-K64 HydrophobicContact CG-CG 4.47Å; Q62-K64 PolarHBondContact O-N 2.99Å; Q62-K64 VanDerWaalsContact O-N 3.1Å
65	W	68.4	Low	76.4	Confident	177 Å²	177	92.7 Å²	92.7	67%	0.67	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	115.4	169.6	-82.4	27.4	0	0	0	107.6	N50 V52	N50-W65 PolarHBondContact N-O 2.99Å; N50-W65 PolarHBondContact O-N 2.97Å; V52-W65 HydrophobicContact CG2-CB 4.06Å; V52-W65 HydrophobicContact CG2-CD2 3.92Å; V52-W65 HydrophobicContact CG2-CG 3.57Å
66	D	77	Confident	77.8	Confident	119 Å²	119	83.6 Å²	83.6	64%	0.636	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	116.6	176.2	-64.1	-18.4	0	0	0	107.8	V48 S49	V48-D66 WeakPolarHBondContact O-CA 3.32Å; S49-D66 VanDerWaalsContact CA-OD1 3.3Å; S49-D66 WeakPolarHBondContact CA-OD1 3.48Å; S49-D66 WeakPolarHBondContact CB-OD1 2.96Å
67	R	83	Confident	78.9	Confident	181 Å²	181	75.2 Å²	75.2	68%	0.683	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.9	176.8	-175.6	177.3	178.6	178.2	0.5	108.4	S47 V48 I69	S47-R67 WeakPolarHBondContact CA-O 3.35Å; V48-R67 PolarHBondContact N-O 2.94Å; V48-R67 PolarHBondContact O-N 3.41Å; R67-I69 PolarHBondContact O-N 3.24Å
68	Q	86.5	Confident	79.8	Confident	95 Å²	95	74.1 Å²	74.1	44%	0.444	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	120.5	170	-164.8	172.3	10.9	0	0	109.1	L70 K71	Q68-L70 VanDerWaalsContact CG-O 3.31Å; Q68-L70 WeakPolarHBondContact CG-O 3.25Å; Q68-L70 PolarHBondContact NE2-O 3.48Å; Q68-K71 HydrophobicContact CG-CG 3.87Å
69	I	88.8	Confident	80.9	Confident	48 Å²	48	68.1 Å²	68.1	25%	0.246	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-35.4	-177.7	-56.2	-179.6	0	0	0	110.8	Y46 V48 R67 T95 G270	Y46-I69 HydrophobicContact CD1-CB 4.43Å; Y46-I69 HydrophobicContact CD1-CD1 4.5Å; Y46-I69 HydrophobicContact CE1-CD1 4.47Å; Y46-I69 PolarHBondContact O-N 3.35Å; V48-I69 HydrophobicContact CB-CD1 4.15Å; V48-I69 HydrophobicContact CG2-CD1 3.44Å; V48-I69 VanDerWaalsContact CG2-CD1 3.44Å; V48-I69 HydrophobicContact CG2-CG1 4.3Å; R67-I69 PolarHBondContact O-N 3.24Å; I69-T95 HydrophobicContact CB-CG2 4.5Å; I69-T95 HydrophobicContact CG2-CG2 3.9Å; I69-G270 WeakPolarHBondContact O-CA 3.49Å
70	L	91.8	Very high	82.1	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	139.8	174.8	-63.4	172.7	0	0	0	109.7	S45 Y46 Q68 T95 L96 A99 L267	S45-L70 WeakPolarHBondContact CA-O 3.31Å; Y46-L70 PolarHBondContact N-O 3.21Å; Y46-L70 PolarHBondContact O-N 3Å; Y46-L70 VanDerWaalsContact O-N 3.13Å; Q68-L70 VanDerWaalsContact CG-O 3.31Å; Q68-L70 WeakPolarHBondContact CG-O 3.25Å; Q68-L70 PolarHBondContact NE2-O 3.48Å; L70-T95 HydrophobicContact CD1-CG2 4.13Å; L70-T95 HydrophobicContact CG-CG2 4.29Å; L70-L96 HydrophobicContact CD1-CB 4.18Å; L70-L96 HydrophobicContact CD1-CD1 4.22Å; L70-L96 HydrophobicContact CD2-CB 4.07Å; L70-A99 HydrophobicContact CD1-CB 4.13Å; L70-L267 HydrophobicContact CD2-CD2 4.19Å
71	K	91.9	Very high	83.6	Confident	60 Å²	60	61.8 Å²	61.8	26%	0.261	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	108.1	-175.3	-69	170.8	171.7	179.2	0	109.6	Q68 V73 G270 E271	Q68-K71 HydrophobicContact CG-CG 3.87Å; K71-V73 PolarHBondContact O-N 2.64Å; K71-G270 PolarHBondContact N-O 2.86Å; K71-E271 HydrophobicContact CB-CG 3.82Å; K71-E271 HydrophobicContact CD-CG 3.57Å; K71-E271 WeakPolarHBondContact CD-OE1 3.44Å; K71-E271 WeakPolarHBondContact CE-OE1 3.47Å; K71-E271 HydrophobicContact CG-CG 4.35Å; K71-E271 IonicContact NZ-OE1 3.26Å; K71-E271 PolarHBondContact NZ-OE1 3.24Å
72	D	91.1	Very high	85.4	Confident	51 Å²	51	60.5 Å²	60.5	27%	0.273	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.1	50	165	-159.2	34.1	0	0	0	115.3	H43 V44 S45 K331	H43-D72 WeakPolarHBondContact CA-OD1 3.46Å; H43-D72 WeakPolarHBondContact CB-OD1 3.14Å; H43-D72 IonicContact CE1-OD1 3.72Å; H43-D72 IonicContact CE1-OD2 2.76Å; H43-D72 IonicContact CG-OD1 2.64Å; H43-D72 VanDerWaalsContact ND1-CG 3.32Å; H43-D72 IonicContact ND1-OD1 3.74Å; H43-D72 PolarHBondContact ND1-OD1 2.64Å; H43-D72 IonicContact ND1-OD2 3.73Å; H43-D72 PolarHBondContact ND1-OD2 3.38Å; V44-D72 PolarHBondContact O-N 2.99Å; S45-D72 PolarHBondContact OG-N 3.24Å; D72-K331 IonicContact OD2-NZ 2.64Å
73	V	93.1	Very high	87.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.5	-175.7	-178.6	0	0	0	0	110.5	H43 V44 K71 L96 L267 G270 L272	H43-V73 PolarHBondContact N-O 2.64Å; V44-V73 PolarHBondContact N-O 3.35Å; V44-V73 PolarHBondContact O-N 3.39Å; K71-V73 PolarHBondContact O-N 2.64Å; V73-L96 HydrophobicContact CB-CD1 4.25Å; V73-L96 HydrophobicContact CG1-CD1 3.9Å; V73-L96 HydrophobicContact CG1-CD2 4.03Å; V73-L267 HydrophobicContact CG2-CD1 4.08Å; V73-G270 WeakPolarHBondContact CG2-O 3.19Å; V73-L272 HydrophobicContact CG1-CB 4.31Å; V73-L272 HydrophobicContact CG1-CD2 4.41Å
74	S	94	Very high	88.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.8	175.3	-61	0	0	0	0	111.3	V41 H43 L272	V41-S74 CarbonylContact O-C 3.59Å; V41-S74 WeakPolarHBondContact O-CA 3.07Å; H43-S74 PolarHBondContact N-OG 3.28Å; S74-L272 WeakPolarHBondContact O-CD2 3.38Å
75	L	94.2	Very high	90.3	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	157.5	-179.9	60	76.8	0	0	0	112.4	G40 V41 M83 L96 I100	G40-L75 CarbonylContact C-O 2.91Å; G40-L75 WeakPolarHBondContact CA-O 3.08Å; V41-L75 HydrophobicContact CB-CD1 3.77Å; V41-L75 HydrophobicContact CB-CG 3.79Å; V41-L75 HydrophobicContact CG1-CG 4.49Å; V41-L75 HydrophobicContact CG2-CD1 3.43Å; V41-L75 VanDerWaalsContact CG2-CD1 3.43Å; V41-L75 HydrophobicContact CG2-CG 3.93Å; V41-L75 PolarHBondContact N-O 3.04Å; V41-L75 PolarHBondContact O-N 3.32Å; L75-M83 HydrophobicContact CB-CE 4.47Å; L75-M83 HydrophobicContact CD1-SD 4.43Å; L75-M83 HydrophobicContact CD2-SD 4.29Å; L75-L96 HydrophobicContact CD2-CD2 4.41Å; L75-I100 HydrophobicContact CD2-CD1 4.19Å
76	Y	94	Very high	91.4	Very high	17 Å²	17	33.4 Å²	33.4	7%	0.067	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	134	-179.8	-177	-105.9	0	0	0	111.4	L39 E78 K263 N342 I343 A346	L39-Y76 WeakPolarHBondContact O-CA 3.11Å; Y76-E78 HydrophobicContact CE1-CG 3.69Å; Y76-K263 WeakPolarHBondContact O-CD 3.31Å; Y76-K263 PolarHBondContact O-NZ 2.84Å; Y76-N342 HydrophobicContact CD1-CB 3.64Å; Y76-N342 HydrophobicContact CD2-CB 4.36Å; Y76-N342 HydrophobicContact CE1-CB 3.7Å; Y76-N342 HydrophobicContact CE2-CB 4.39Å; Y76-N342 HydrophobicContact CG-CB 4Å; Y76-I343 HydrophobicContact CD2-CG1 3.86Å; Y76-I343 HydrophobicContact CG-CG1 4.28Å; Y76-A346 HydrophobicContact CE2-CB 3.94Å
77	I	93.9	Very high	92	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	145.5	177.2	-168.5	172.1	0	0	0	111.4	L39 Q81 M83 I245 I247	L39-I77 HydrophobicContact CB-CG2 3.7Å; L39-I77 HydrophobicContact CD2-CG2 3.88Å; L39-I77 HydrophobicContact CG-CG2 4.13Å; L39-I77 PolarHBondContact N-O 3.37Å; L39-I77 PolarHBondContact O-N 3.49Å; I77-Q81 HydrophobicContact CD1-CB 4.25Å; I77-Q81 HydrophobicContact CG1-CB 3.86Å; I77-M83 HydrophobicContact CB-CE 3.87Å; I77-M83 HydrophobicContact CD1-CB 3.37Å; I77-M83 HydrophobicContact CD1-CE 4.35Å; I77-M83 HydrophobicContact CG1-CB 4.49Å; I77-M83 HydrophobicContact CG1-CE 4.43Å; I77-I245 HydrophobicContact CB-CG2 4.39Å; I77-I245 HydrophobicContact CD1-CG2 3.81Å; I77-I245 HydrophobicContact CG1-CG2 4.08Å; I77-I245 HydrophobicContact CG2-CG2 3.47Å; I77-I245 VanDerWaalsContact CG2-CG2 3.47Å; I77-I247 HydrophobicContact CD1-CG1 4.27Å
78	E	92	Very high	92.1	Very high	54 Å²	54	20.6 Å²	20.6	25%	0.252	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	159.3	176.9	-62.9	179.2	-178.3	0	0	111.8	R36 H37 Y76 Q81	R36-E78 IonicContact NH1-OE2 2.8Å; H37-E78 CarbonylContact O-C 3.48Å; H37-E78 WeakPolarHBondContact O-CA 3.38Å; Y76-E78 HydrophobicContact CE1-CG 3.69Å; E78-Q81 HydrophobicContact CB-CG 4.47Å; E78-Q81 VanDerWaalsContact O-CB 3.3Å; E78-Q81 WeakPolarHBondContact O-CB 3.45Å; E78-Q81 PolarHBondContact O-N 3.11Å; E78-Q81 VanDerWaalsContact O-N 3.17Å
79	S	90.9	Very high	92	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.014	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	139.4	171.8	-155.1	0	0	0	0	111	H37 Q81 D243 R244	H37-S79 PolarHBondContact O-N 3.05Å; S79-Q81 VanDerWaalsContact C-N 3.34Å; S79-D243 WeakPolarHBondContact CB-OD1 3.24Å; S79-D243 WeakPolarHBondContact OG-CA 3.14Å; S79-D243 PolarHBondContact OG-O 3.01Å; S79-D243 PolarHBondContact OG-OD1 2.75Å; S79-R244 PolarHBondContact OG-N 2.7Å
80	G	90.9	Very high	91.7	Very high	27 Å²	27	21.6 Å²	21.6	28%	0.278	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	-17.3	-171.7	0	0	0	0	0	113.5	A240 R244	G80-A240 WeakPolarHBondContact CA-O 3.33Å; G80-R244 PolarHBondContact N-O 3.39Å
81	Q	93.6	Very high	91.6	Very high	38 Å²	38	21.7 Å²	21.7	18%	0.178	14%	0.143	C	C	.	.			trans	-100.6	144.9	-174.5	-59.8	-179.6	-29.5	0	0	112.8	I77 E78 S79 V246 D262	I77-Q81 HydrophobicContact CD1-CB 4.25Å; I77-Q81 HydrophobicContact CG1-CB 3.86Å; E78-Q81 HydrophobicContact CB-CG 4.47Å; E78-Q81 VanDerWaalsContact O-CB 3.3Å; E78-Q81 WeakPolarHBondContact O-CB 3.45Å; E78-Q81 PolarHBondContact O-N 3.11Å; E78-Q81 VanDerWaalsContact O-N 3.17Å; S79-Q81 VanDerWaalsContact C-N 3.34Å; Q81-V246 PolarHBondContact O-N 3.15Å; Q81-D262 VanDerWaalsContact CA-OD2 3.28Å; Q81-D262 WeakPolarHBondContact CA-OD2 3.44Å; Q81-D262 HydrophobicContact CB-CB 4.02Å; Q81-D262 HydrophobicContact CG-CB 4.21Å
82	I	95	Very high	91.4	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.8	166.9	-174.4	173.3	0	0	0	110.6	L236 A240 V246 V248 H260 F261 D262 K263	I82-L236 HydrophobicContact CD1-CB 3.92Å; I82-A240 HydrophobicContact CB-CB 4.22Å; I82-V246 CarbonylContact C-O 3.54Å; I82-V246 WeakPolarHBondContact CA-O 3.17Å; I82-V246 HydrophobicContact CB-CB 4.43Å; I82-V246 HydrophobicContact CD1-CG1 4.33Å; I82-V246 HydrophobicContact CG1-CB 4.2Å; I82-V246 HydrophobicContact CG1-CG1 4.14Å; I82-V248 HydrophobicContact CD1-CG2 4.22Å; I82-V248 HydrophobicContact CG1-CG2 4.34Å; I82-H260 VanDerWaalsContact CG2-O 3.24Å; I82-H260 WeakPolarHBondContact CG2-O 3.24Å; I82-F261 HydrophobicContact CD1-CD1 4.06Å; I82-F261 HydrophobicContact CD1-CE1 3.95Å; I82-F261 HydrophobicContact CG1-CD1 4.04Å; I82-F261 HydrophobicContact CG1-CE1 4.31Å; I82-F261 HydrophobicContact CG2-CD1 4.25Å; I82-D262 WeakPolarHBondContact CG2-OD2 3.36Å; I82-D262 PolarHBondContact N-OD2 3.4Å; I82-D262 PolarHBondContact O-N 3.13Å; I82-D262 VanDerWaalsContact O-N 3.16Å; I82-K263 PolarHBondContact O-N 2.9Å; I82-K263 VanDerWaalsContact O-N 3.15Å
83	M	95.4	Very high	91.4	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.1	176.5	175	-179.6	-75.9	0	0	110.8	L75 I77 I85 V246 I247 V248 K263	L75-M83 HydrophobicContact CB-CE 4.47Å; L75-M83 HydrophobicContact CD1-SD 4.43Å; L75-M83 HydrophobicContact CD2-SD 4.29Å; I77-M83 HydrophobicContact CB-CE 3.87Å; I77-M83 HydrophobicContact CD1-CB 3.37Å; I77-M83 HydrophobicContact CD1-CE 4.35Å; I77-M83 HydrophobicContact CG1-CB 4.49Å; I77-M83 HydrophobicContact CG1-CE 4.43Å; M83-I85 HydrophobicContact CG-CG1 4.48Å; M83-V246 PolarHBondContact N-O 3.29Å; M83-I247 HydrophobicContact CB-CG1 4.4Å; M83-I247 WeakPolarHBondContact O-CA 3.45Å; M83-V248 PolarHBondContact O-N 3.16Å; M83-K263 CarbonylContact C-O 3.58Å; M83-K263 VanDerWaalsContact CA-O 3.29Å; M83-K263 WeakPolarHBondContact CA-O 3.42Å; M83-K263 HydrophobicContact CB-CB 4.28Å; M83-K263 HydrophobicContact CE-CB 4.16Å; M83-K263 HydrophobicContact CE-CD 3.97Å; M83-K263 HydrophobicContact CG-CB 4.33Å
84	C	95.2	Very high	91.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.6	174	-172.7	0	0	0	0	110.4	V248 F261 K263 I264 A265	C84-V248 CarbonylContact C-O 3.39Å; C84-V248 WeakPolarHBondContact CA-O 3.22Å; C84-F261 HydrophobicContact CB-CB 4.3Å; C84-F261 HydrophobicContact CB-CD1 3.53Å; C84-F261 HydrophobicContact CB-CD2 4.04Å; C84-F261 HydrophobicContact CB-CE1 3.74Å; C84-F261 HydrophobicContact CB-CE2 4.21Å; C84-F261 HydrophobicContact CB-CG 3.68Å; C84-F261 HydrophobicContact CB-CZ 4.08Å; C84-K263 PolarHBondContact N-O 2.61Å; C84-I264 HydrophobicContact CB-CG1 4.47Å; C84-I264 CarbonylContact O-C 3.54Å; C84-I264 WeakPolarHBondContact O-CA 3.41Å; C84-A265 PolarHBondContact O-N 3.27Å
85	I	94.9	Very high	91.1	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114.3	172.5	-58.1	173.3	0	0	0	108.3	M83 K93 L96 L97 I247 V248 T249 I250 A265	M83-I85 HydrophobicContact CG-CG1 4.48Å; I85-K93 HydrophobicContact CG2-CB 4.41Å; I85-K93 HydrophobicContact CG2-CG 4.16Å; I85-L96 HydrophobicContact CD1-CD2 4.2Å; I85-L97 HydrophobicContact CD1-CD2 4.03Å; I85-I247 HydrophobicContact CD1-CG2 3.53Å; I85-I247 HydrophobicContact CG1-CG2 4.09Å; I85-V248 PolarHBondContact N-O 3.02Å; I85-T249 HydrophobicContact CB-CG2 3.91Å; I85-T249 HydrophobicContact CD1-CG2 4.42Å; I85-T249 HydrophobicContact CG2-CG2 4.2Å; I85-T249 WeakPolarHBondContact O-CA 3.25Å; I85-I250 PolarHBondContact O-N 3.47Å; I85-I250 VanDerWaalsContact O-N 3.1Å; I85-A265 CarbonylContact C-O 3.53Å; I85-A265 WeakPolarHBondContact CA-O 3.36Å; I85-A265 HydrophobicContact CG1-CB 4.43Å
86	L	93.2	Very high	91	Very high	4 Å²	4	21 Å²	21	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	157.6	179.2	-63.1	173	0	0	0	111	I250 P253 I264 A265 I266 L267 F299 M303	L86-I250 HydrophobicContact CD2-CB 4.22Å; L86-P253 HydrophobicContact CD2-CG 3.73Å; L86-I264 HydrophobicContact CD1-CG2 3.62Å; L86-I264 HydrophobicContact CG-CG2 4.35Å; L86-A265 PolarHBondContact N-O 2.95Å; L86-I266 HydrophobicContact CB-CG1 4.39Å; L86-L267 PolarHBondContact O-N 3.14Å; L86-F299 HydrophobicContact CD1-CD1 3.34Å; L86-F299 HydrophobicContact CD1-CE1 3.6Å; L86-F299 HydrophobicContact CD1-CG 4.43Å; L86-M303 HydrophobicContact CB-CE 4.41Å; L86-M303 HydrophobicContact CD2-CE 4.1Å
87	G	89.2	Confident	91	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	14%	0.143	C	C	.	.			trans	160.1	159.6	178.5	0	0	0	0	0	112	K93 L267	G87-K93 WeakPolarHBondContact O-CE 3.4Å; G87-K93 PolarHBondContact O-NZ 3.05Å; G87-L267 VanDerWaalsContact CA-O 3.3Å; G87-L267 WeakPolarHBondContact CA-O 3.37Å
88	S	84.1	Confident	90.8	Very high	31 Å²	31	22 Å²	22	22%	0.217	15%	0.153	C	C	.	.			trans	-67.1	168.2	178.3	60.7	0	0	0	0	112.8	G90 S91 K93	S88-G90 PolarHBondContact O-N 2.9Å; S88-S91 WeakPolarHBondContact O-CB 3.05Å; S88-S91 PolarHBondContact O-N 2.74Å; S88-S91 PolarHBondContact O-OG 2.97Å; S88-S91 VanDerWaalsContact O-OG 3.11Å; S88-K93 PolarHBondContact O-NZ 3.02Å
89	S	85.2	Confident	90.6	Very high	90 Å²	90	19.5 Å²	19.5	63%	0.629	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	130.7	172	-41.4	0	0	0	0	110	S91 H251	S89-S91 VanDerWaalsContact C-N 3.33Å; S89-S91 PolarHBondContact O-N 3.4Å; S89-H251 PolarHBondContact OG-NE2 2.74Å; S89-H251 VanDerWaalsContact OG-NE2 3.16Å
90	G	82.9	Confident	90.6	Very high	74 Å²	74	19.4 Å²	19.4	76%	0.763	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.7	6.3	-177.6	0	0	0	0	0	115.5	S88 G92	S88-G90 PolarHBondContact O-N 2.9Å; G90-G92 PolarHBondContact O-N 3.29Å
91	S	87.9	Confident	90.4	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.014	13%	0.129	C	C	.	.	S	Bend	trans	-73.3	-8	178.7	76.1	0	0	0	0	115.4	S88 S89 K93 L267 G270	S88-S91 WeakPolarHBondContact O-CB 3.05Å; S88-S91 PolarHBondContact O-N 2.74Å; S88-S91 PolarHBondContact O-OG 2.97Å; S88-S91 VanDerWaalsContact O-OG 3.11Å; S89-S91 VanDerWaalsContact C-N 3.33Å; S89-S91 PolarHBondContact O-N 3.4Å; S91-K93 WeakPolarHBondContact OG-CG 3.42Å; S91-L267 WeakPolarHBondContact CB-O 3.49Å; S91-L267 VanDerWaalsContact O-CD2 3.29Å; S91-L267 WeakPolarHBondContact O-CD2 3.33Å; S91-L267 PolarHBondContact OG-O 3.32Å; S91-G270 WeakPolarHBondContact O-CA 3.47Å; S91-G270 PolarHBondContact O-N 3.36Å
92	G	88.4	Confident	89.9	Confident	8 Å²	8	18.1 Å²	18.1	8%	0.082	14%	0.137	C	C	.	.	S	Bend	trans	102.1	5.2	178.8	0	0	0	0	0	115.6	G90 T94 T95 L96	G90-G92 PolarHBondContact O-N 3.29Å; G92-T94 PolarHBondContact O-N 3.31Å; G92-T95 CarbonylContact O-C 3.42Å; G92-T95 WeakPolarHBondContact O-CA 3.11Å; G92-T95 WeakPolarHBondContact O-CB 3.07Å; G92-T95 PolarHBondContact O-N 3.32Å; G92-T95 VanDerWaalsContact O-N 3.13Å; G92-L96 PolarHBondContact O-N 3.19Å
93	K	91.5	Very high	89.2	Confident	8 Å²	8	20 Å²	20	4%	0.035	14%	0.144	C	C	.	.	H	α-helix	trans	-52.1	-57.3	-177.4	-60.4	-172.9	-62.1	-72.2	0	113.9	I85 G87 S88 S91 T95 L96 L97 T249	I85-K93 HydrophobicContact CG2-CB 4.41Å; I85-K93 HydrophobicContact CG2-CG 4.16Å; G87-K93 WeakPolarHBondContact O-CE 3.4Å; G87-K93 PolarHBondContact O-NZ 3.05Å; S88-K93 PolarHBondContact O-NZ 3.02Å; S91-K93 WeakPolarHBondContact OG-CG 3.42Å; K93-T95 VanDerWaalsContact C-N 3.28Å; K93-T95 PolarHBondContact O-N 3.46Å; K93-L96 WeakPolarHBondContact O-CB 3.31Å; K93-L96 PolarHBondContact O-N 3.39Å; K93-L97 PolarHBondContact O-N 2.81Å; K93-T249 HydrophobicContact CB-CG2 3.82Å
94	T	90.1	Very high	88.3	Confident	47 Å²	47	21.5 Å²	21.5	29%	0.288	15%	0.152	S	C	.	.	H	α-helix	trans	-62.4	-38.9	178	-52.1	0	0	0	0	110.8	G92 L96 L97 D98 D218	G92-T94 PolarHBondContact O-N 3.31Å; T94-L96 VanDerWaalsContact C-N 3.32Å; T94-L96 PolarHBondContact O-N 3.1Å; T94-L97 PolarHBondContact O-N 3.46Å; T94-D98 WeakPolarHBondContact O-CB 3.42Å; T94-D98 PolarHBondContact O-N 2.86Å; T94-D218 WeakPolarHBondContact CG2-OD2 3.29Å; T94-D218 PolarHBondContact OG1-OD1 3.02Å; T94-D218 VanDerWaalsContact OG1-OD1 3.13Å; T94-D218 PolarHBondContact OG1-OD2 3.29Å
95	T	90.4	Very high	86.9	Confident	33 Å²	33	28.8 Å²	28.8	20%	0.202	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-37	176.2	-48.3	0	0	0	0	112.1	Y46 I69 L70 G92 K93 D98 A99 L104	Y46-T95 HydrophobicContact CD1-CG2 3.81Å; Y46-T95 HydrophobicContact CE1-CG2 4.21Å; I69-T95 HydrophobicContact CB-CG2 4.5Å; I69-T95 HydrophobicContact CG2-CG2 3.9Å; L70-T95 HydrophobicContact CD1-CG2 4.13Å; L70-T95 HydrophobicContact CG-CG2 4.29Å; G92-T95 CarbonylContact O-C 3.42Å; G92-T95 WeakPolarHBondContact O-CA 3.11Å; G92-T95 WeakPolarHBondContact O-CB 3.07Å; G92-T95 PolarHBondContact O-N 3.32Å; G92-T95 VanDerWaalsContact O-N 3.13Å; K93-T95 VanDerWaalsContact C-N 3.28Å; K93-T95 PolarHBondContact O-N 3.46Å; T95-D98 PolarHBondContact O-N 2.68Å; T95-A99 WeakPolarHBondContact O-CB 3.24Å; T95-A99 PolarHBondContact O-N 3.23Å; T95-L104 HydrophobicContact CG2-CD2 3.8Å
96	L	93	Very high	85.5	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-67.5	-45.8	175.3	178.5	62.4	0	0	0	111.3	L70 V73 L75 I85 G92 K93 T94 D98 A99 I100 L267	L70-L96 HydrophobicContact CD1-CB 4.18Å; L70-L96 HydrophobicContact CD1-CD1 4.22Å; L70-L96 HydrophobicContact CD2-CB 4.07Å; V73-L96 HydrophobicContact CB-CD1 4.25Å; V73-L96 HydrophobicContact CG1-CD1 3.9Å; V73-L96 HydrophobicContact CG1-CD2 4.03Å; L75-L96 HydrophobicContact CD2-CD2 4.41Å; I85-L96 HydrophobicContact CD1-CD2 4.2Å; G92-L96 PolarHBondContact O-N 3.19Å; K93-L96 WeakPolarHBondContact O-CB 3.31Å; K93-L96 PolarHBondContact O-N 3.39Å; T94-L96 VanDerWaalsContact C-N 3.32Å; T94-L96 PolarHBondContact O-N 3.1Å; L96-D98 VanDerWaalsContact C-N 3.31Å; L96-D98 PolarHBondContact O-N 2.81Å; L96-A99 WeakPolarHBondContact O-CB 3.26Å; L96-A99 PolarHBondContact O-N 3.36Å; L96-A99 VanDerWaalsContact O-N 3.16Å; L96-I100 HydrophobicContact CD1-CD1 3.98Å; L96-I100 HydrophobicContact CD1-CG1 4.33Å; L96-I100 HydrophobicContact CG-CD1 3.98Å; L96-I100 VanDerWaalsContact O-CG1 3.31Å; L96-I100 WeakPolarHBondContact O-CG1 3.3Å; L96-I100 PolarHBondContact O-N 3.49Å; L96-L267 HydrophobicContact CB-CD2 4.43Å; L96-L267 HydrophobicContact CD2-CD1 4.44Å; L96-L267 HydrophobicContact CD2-CD2 4.34Å
97	L	93.1	Very high	84.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.5	-41.9	173.3	-73.4	-172.9	0	0	0	112	I85 K93 T94 A99 I100 S101 Y132 M216 D218 I247 T249	I85-L97 HydrophobicContact CD1-CD2 4.03Å; K93-L97 PolarHBondContact O-N 2.81Å; T94-L97 PolarHBondContact O-N 3.46Å; L97-A99 VanDerWaalsContact C-N 3.27Å; L97-A99 PolarHBondContact O-N 3.05Å; L97-I100 PolarHBondContact O-N 2.97Å; L97-S101 VanDerWaalsContact O-CB 3.28Å; L97-S101 WeakPolarHBondContact O-CB 3.49Å; L97-S101 PolarHBondContact O-N 2.97Å; L97-S101 PolarHBondContact O-OG 3.2Å; L97-Y132 HydrophobicContact CB-CE2 4.04Å; L97-M216 HydrophobicContact CD2-CB 4.23Å; L97-M216 HydrophobicContact CD2-CG 3.97Å; L97-M216 HydrophobicContact CD2-SD 4.01Å; L97-D218 HydrophobicContact CD1-CB 4.04Å; L97-I247 HydrophobicContact CD2-CB 4.43Å; L97-I247 HydrophobicContact CD2-CG2 3.65Å; L97-T249 HydrophobicContact CD1-CG2 3.32Å; L97-T249 HydrophobicContact CD2-CG2 4.33Å; L97-T249 HydrophobicContact CG-CG2 3.62Å
98	D	89.5	Confident	83.6	Confident	38 Å²	38	40.4 Å²	40.4	20%	0.203	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-32.4	176.7	-71.1	-13.8	0	0	0	111.7	T94 T95 L96 S101 G102 R103 L104 Y132	T94-D98 WeakPolarHBondContact O-CB 3.42Å; T94-D98 PolarHBondContact O-N 2.86Å; T95-D98 PolarHBondContact O-N 2.68Å; L96-D98 VanDerWaalsContact C-N 3.31Å; L96-D98 PolarHBondContact O-N 2.81Å; D98-S101 WeakPolarHBondContact CA-OG 3.39Å; D98-S101 PolarHBondContact O-OG 3.18Å; D98-G102 PolarHBondContact O-N 2.87Å; D98-G102 VanDerWaalsContact O-N 3.17Å; D98-R103 HydrophobicContact CB-CB 4.19Å; D98-R103 PolarHBondContact O-N 3.34Å; D98-L104 HydrophobicContact CB-CD2 4.03Å; D98-L104 HydrophobicContact CB-CG 4.18Å; D98-L104 PolarHBondContact O-N 2.71Å; D98-Y132 WeakPolarHBondContact OD1-CE2 3.33Å; D98-Y132 VanDerWaalsContact OD1-CZ 3.29Å; D98-Y132 PolarHBondContact OD1-OH 3.33Å
99	A	88.7	Confident	83.6	Confident	2 Å²	2	42.8 Å²	42.8	2%	0.017	25%	0.25	C	C	.	.	H	α-helix	trans	-66.9	-50.6	174.9	0	0	0	0	0	111.3	V44 L70 T95 L96 L97 S101 G102 L104 L110	V44-A99 HydrophobicContact CG1-CB 4.4Å; L70-A99 HydrophobicContact CD1-CB 4.13Å; T95-A99 WeakPolarHBondContact O-CB 3.24Å; T95-A99 PolarHBondContact O-N 3.23Å; L96-A99 WeakPolarHBondContact O-CB 3.26Å; L96-A99 PolarHBondContact O-N 3.36Å; L96-A99 VanDerWaalsContact O-N 3.16Å; L97-A99 VanDerWaalsContact C-N 3.27Å; L97-A99 PolarHBondContact O-N 3.05Å; A99-S101 VanDerWaalsContact C-N 3.28Å; A99-S101 PolarHBondContact O-N 2.94Å; A99-G102 PolarHBondContact O-N 2.87Å; A99-L104 HydrophobicContact CB-CD1 3.37Å; A99-L104 HydrophobicContact CB-CG 4.11Å; A99-L110 HydrophobicContact CB-CD1 4.11Å
100	I	89.7	Confident	83.6	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-33.3	-178.8	-63.3	166.3	0	0	0	110.7	V41 L75 L96 L97 F126 F130 M216	V41-I100 HydrophobicContact CG2-CD1 4.05Å; V41-I100 HydrophobicContact CG2-CG1 4.03Å; L75-I100 HydrophobicContact CD2-CD1 4.19Å; L96-I100 HydrophobicContact CD1-CD1 3.98Å; L96-I100 HydrophobicContact CD1-CG1 4.33Å; L96-I100 HydrophobicContact CG-CD1 3.98Å; L96-I100 VanDerWaalsContact O-CG1 3.31Å; L96-I100 WeakPolarHBondContact O-CG1 3.3Å; L96-I100 PolarHBondContact O-N 3.49Å; L97-I100 PolarHBondContact O-N 2.97Å; I100-F126 WeakPolarHBondContact O-CD1 3.39Å; I100-F126 VanDerWaalsContact O-CE1 3.23Å; I100-F126 WeakPolarHBondContact O-CE1 3.19Å; I100-F130 HydrophobicContact CG2-CE1 4.11Å; I100-F130 HydrophobicContact CG2-CE2 4.49Å; I100-F130 HydrophobicContact CG2-CZ 3.92Å; I100-F130 WeakPolarHBondContact O-CD2 3.37Å; I100-F130 WeakPolarHBondContact O-CE2 3.46Å; I100-M216 HydrophobicContact CB-SD 4.01Å; I100-M216 HydrophobicContact CG2-CE 4.31Å; I100-M216 HydrophobicContact CG2-SD 3.82Å
101	S	87.5	Confident	83.9	Confident	4 Å²	4	43 Å²	43	3%	0.028	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-4.8	177.2	63.8	0	0	0	0	115.1	L97 D98 A99 R103	L97-S101 VanDerWaalsContact O-CB 3.28Å; L97-S101 WeakPolarHBondContact O-CB 3.49Å; L97-S101 PolarHBondContact O-N 2.97Å; L97-S101 PolarHBondContact O-OG 3.2Å; D98-S101 WeakPolarHBondContact CA-OG 3.39Å; D98-S101 PolarHBondContact O-OG 3.18Å; A99-S101 VanDerWaalsContact C-N 3.28Å; A99-S101 PolarHBondContact O-N 2.94Å; S101-R103 VanDerWaalsContact C-N 3.26Å; S101-R103 PolarHBondContact O-N 3.1Å; S101-R103 WeakPolarHBondContact OG-CG 3.13Å
102	G	83.1	Confident	83.8	Confident	34 Å²	34	45 Å²	45	35%	0.351	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	69	20.9	-176.6	0	0	0	0	0	114.2	D98 A99	D98-G102 PolarHBondContact O-N 2.87Å; D98-G102 VanDerWaalsContact O-N 3.17Å; A99-G102 PolarHBondContact O-N 2.87Å
103	R	79.7	Confident	83.8	Confident	42 Å²	42	48 Å²	48	16%	0.158	26%	0.255	C	S	.	.			trans	-86.4	-11.4	177.3	-73.4	-173.6	154.5	-174.7	-4.1	114	D98 S101 R105 Q455 D456	D98-R103 HydrophobicContact CB-CB 4.19Å; D98-R103 PolarHBondContact O-N 3.34Å; S101-R103 VanDerWaalsContact C-N 3.26Å; S101-R103 PolarHBondContact O-N 3.1Å; S101-R103 WeakPolarHBondContact OG-CG 3.13Å; R103-R105 PolarHBondContact O-N 3.46Å; R103-Q455 PolarHBondContact NH2-O 2.86Å; R103-D456 IonicContact CZ-OD1 2.69Å; R103-D456 IonicContact NH1-OD1 3.57Å; R103-D456 IonicContact NH2-OD1 2.64Å; R103-D456 PolarHBondContact NH2-OD1 2.9Å
104	L	77.1	Confident	83.7	Confident	31 Å²	31	48 Å²	48	16%	0.162	26%	0.255	C	S	.	.	S	Bend	trans	-55.2	139.5	179.2	-79.5	176.4	0	0	0	112.5	Y46 T95 D98 A99 L110	Y46-L104 HydrophobicContact CD1-CD1 4.05Å; Y46-L104 HydrophobicContact CD1-CD2 4.03Å; Y46-L104 HydrophobicContact CD2-CD1 3.57Å; Y46-L104 HydrophobicContact CE1-CD1 4.18Å; Y46-L104 HydrophobicContact CE1-CD2 3.62Å; Y46-L104 HydrophobicContact CE1-CG 4.45Å; Y46-L104 HydrophobicContact CE2-CB 4.26Å; Y46-L104 HydrophobicContact CE2-CD1 3.71Å; Y46-L104 HydrophobicContact CE2-CD2 4.34Å; Y46-L104 HydrophobicContact CE2-CG 4.35Å; Y46-L104 HydrophobicContact CG-CD1 3.73Å; T95-L104 HydrophobicContact CG2-CD2 3.8Å; D98-L104 HydrophobicContact CB-CD2 4.03Å; D98-L104 HydrophobicContact CB-CG 4.18Å; D98-L104 PolarHBondContact O-N 2.71Å; A99-L104 HydrophobicContact CB-CD1 3.37Å; A99-L104 HydrophobicContact CB-CG 4.11Å; L104-L110 HydrophobicContact CD1-CD1 4.08Å
105	R	65.9	Low	83.6	Confident	152 Å²	152	46.4 Å²	46.4	57%	0.574	24%	0.244	S	C	*	.			trans	-58.7	131.6	173.1	-80.2	-165.4	-167.3	177.9	7.8	111.2	Y46 R103 T107 G108 R652	Y46-R105 PolarHBondContact OH-O 3.09Å; R103-R105 PolarHBondContact O-N 3.46Å; R105-T107 PolarHBondContact O-N 3.28Å; R105-G108 PolarHBondContact O-N 3.4Å; R105-R652 CarbonylContact C-O 3.58Å; R105-R652 WeakPolarHBondContact CA-O 3.47Å; R105-R652 WeakPolarHBondContact CB-O 3.23Å; R105-R652 WeakPolarHBondContact CD-OXT 3.28Å; R105-R652 WeakPolarHBondContact CG-O 3.38Å; R105-R652 WeakPolarHBondContact CG-OXT 3.3Å
106	R	65.1	Low	83.4	Confident	166 Å²	166	44.9 Å²	44.9	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-5.7	179.5	-63.7	-174.9	178.7	-170.9	1.5	113.8	G108 S651 R652	R106-G108 PolarHBondContact O-N 3.16Å; R106-S651 PolarHBondContact N-O 3.03Å; R106-R652 HydrophobicContact CB-CG 4.2Å; R106-R652 PolarHBondContact N-O 3.19Å
107	T	67.9	Low	83	Confident	65 Å²	65	45 Å²	45	40%	0.399	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-9.5	175.4	50.2	0	0	0	0	114.6	S49 R105 R652	S49-T107 PolarHBondContact OG-O 2.83Å; R105-T107 PolarHBondContact O-N 3.28Å; T107-R652 WeakPolarHBondContact CG2-O 3.12Å; T107-R652 PolarHBondContact N-O 3.08Å; T107-R652 PolarHBondContact OG1-O 3.33Å
108	G	75.8	Confident	82.2	Confident	20 Å²	20	45.4 Å²	45.4	21%	0.206	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	165.5	177.3	0	0	0	0	0	114.3	S47 R105 R106	S47-G108 CarbonylContact O-C 3.5Å; S47-G108 WeakPolarHBondContact O-CA 3.48Å; R105-G108 PolarHBondContact O-N 3.4Å; R106-G108 PolarHBondContact O-N 3.16Å
109	T	83.9	Confident	81.9	Confident	81 Å²	81	45.1 Å²	45.1	50%	0.497	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121	169.8	45.8	0	0	0	0	108.7	Y46 S47	Y46-T109 WeakPolarHBondContact CA-O 3.49Å; Y46-T109 WeakPolarHBondContact CD2-O 3.49Å; S47-T109 PolarHBondContact N-O 3.44Å; S47-T109 VanDerWaalsContact N-O 3.08Å; S47-T109 PolarHBondContact O-N 3.01Å; S47-T109 PolarHBondContact OG-OG1 3.4Å
110	L	85.1	Confident	81.7	Confident	51 Å²	51	50.4 Å²	50.4	27%	0.267	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	117.7	169.4	-179.7	70.5	0	0	0	107.3	V44 S45 Y46 A99 L104	V44-L110 HydrophobicContact CG1-CD1 3.77Å; S45-L110 WeakPolarHBondContact O-CA 3.48Å; Y46-L110 HydrophobicContact CD2-CB 4.27Å; Y46-L110 HydrophobicContact CD2-CD1 4.4Å; A99-L110 HydrophobicContact CB-CD1 4.11Å; L104-L110 HydrophobicContact CD1-CD1 4.08Å
111	E	88.3	Confident	81.4	Confident	118 Å²	118	50.8 Å²	50.8	55%	0.551	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	158.2	171.7	-62.9	175.3	179.7	0	0	108.8	V44 S45	V44-E111 VanDerWaalsContact CA-O 3.31Å; V44-E111 WeakPolarHBondContact CA-O 3.03Å; S45-E111 PolarHBondContact N-O 3.46Å; S45-E111 PolarHBondContact O-N 3.44Å
112	G	86.4	Confident	81.1	Confident	42 Å²	42	59.1 Å²	59.1	43%	0.433	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	91.9	174.5	-174.5	0	0	0	0	0	113.8	L42 H43	L42-G112 WeakPolarHBondContact O-CA 3.31Å; H43-G112 WeakPolarHBondContact O-CA 3.27Å
113	E	88.4	Confident	80.7	Confident	73 Å²	73	66.7 Å²	66.7	34%	0.341	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.5	-167.8	-66.3	170.8	171.3	0	0	110.4	L42 F115 E120 R347	L42-E113 PolarHBondContact N-O 3.05Å; L42-E113 PolarHBondContact O-N 3Å; E113-F115 HydrophobicContact CB-CD2 4.5Å; E113-F115 HydrophobicContact CB-CE2 3.4Å; E113-F115 VanDerWaalsContact CB-CE2 3.4Å; E113-F115 HydrophobicContact CB-CZ 3.53Å; E113-F115 HydrophobicContact CG-CZ 4.31Å; E113-F115 VanDerWaalsContact OE2-CZ 3.22Å; E113-F115 WeakPolarHBondContact OE2-CZ 2.95Å; E113-E120 HydrophobicContact CB-CG 4.4Å; E113-R347 IonicContact OE2-CZ 3.86Å; E113-R347 IonicContact OE2-NH2 2.85Å; E113-R347 PolarHBondContact OE2-NH2 2.91Å
114	V	89.9	Confident	80.5	Confident	8 Å²	8	71.3 Å²	71.3	5%	0.048	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	123.7	175.7	-178.7	0	0	0	0	108.9	L39 V41 V44 L121 F126 F130	L39-V114 HydrophobicContact CD1-CG1 3.87Å; V41-V114 HydrophobicContact CG2-CG1 4.29Å; V41-V114 HydrophobicContact CG2-CG2 4.38Å; V44-V114 HydrophobicContact CG2-CG2 4.36Å; V114-L121 PolarHBondContact O-N 3.28Å; V114-F126 HydrophobicContact CB-CE1 4.27Å; V114-F126 HydrophobicContact CB-CZ 4.24Å; V114-F126 HydrophobicContact CG2-CE1 4.22Å; V114-F126 HydrophobicContact CG2-CZ 4.33Å; V114-F130 HydrophobicContact CG1-CZ 4.26Å
115	F	88.1	Confident	80.7	Confident	12 Å²	12	72.2 Å²	72.2	5%	0.053	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.5	-179	-63.3	-82.1	0	0	0	110.7	L39 G40 L42 E113 C119 E120 I343 R347	L39-F115 CarbonylContact C-O 3.48Å; L39-F115 WeakPolarHBondContact CA-O 3.3Å; G40-F115 PolarHBondContact N-O 2.88Å; G40-F115 PolarHBondContact O-N 2.99Å; L42-F115 HydrophobicContact CB-CE2 4.17Å; E113-F115 HydrophobicContact CB-CD2 4.5Å; E113-F115 HydrophobicContact CB-CE2 3.4Å; E113-F115 VanDerWaalsContact CB-CE2 3.4Å; E113-F115 HydrophobicContact CB-CZ 3.53Å; E113-F115 HydrophobicContact CG-CZ 4.31Å; E113-F115 VanDerWaalsContact OE2-CZ 3.22Å; E113-F115 WeakPolarHBondContact OE2-CZ 2.95Å; F115-C119 CarbonylContact C-O 3.56Å; F115-C119 WeakPolarHBondContact CA-O 3.47Å; F115-E120 HydrophobicContact CD1-CB 4.27Å; F115-E120 HydrophobicContact CE1-CB 3.74Å; F115-E120 HydrophobicContact CE1-CG 4.14Å; F115-E120 HydrophobicContact CZ-CB 4.33Å; F115-E120 HydrophobicContact CZ-CG 4.22Å; F115-I343 HydrophobicContact CD2-CG2 4.28Å; F115-R347 HydrophobicContact CD1-CG 3.92Å; F115-R347 HydrophobicContact CE1-CG 4.14Å; F115-R347 HydrophobicContact CG-CG 4.35Å; F115-R347 VanDerWaalsContact CZ-NE 3.26Å
116	V	86.3	Confident	81.4	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.5	169.1	-174.2	0	0	0	0	108.1	S38 L39 G118 C119 L121 F130 P356	S38-V116 WeakPolarHBondContact O-CA 3.47Å; L39-V116 HydrophobicContact CD1-CG2 3.82Å; V116-G118 PolarHBondContact O-N 2.69Å; V116-G118 VanDerWaalsContact O-N 3.16Å; V116-C119 PolarHBondContact N-O 2.92Å; V116-C119 PolarHBondContact O-N 3.08Å; V116-L121 HydrophobicContact CG2-CD1 4.45Å; V116-L121 HydrophobicContact CG2-CD2 4.35Å; V116-F130 HydrophobicContact CG2-CZ 4.09Å; V116-P356 HydrophobicContact CG1-CG 4.12Å
117	N	84.1	Confident	82	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.027	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	40.3	-175.4	-56.6	-24.6	0	0	0	113	H37 S38 C119 L352 P353	H37-N117 WeakPolarHBondContact CA-OD1 3.41Å; H37-N117 WeakPolarHBondContact CB-OD1 3.31Å; H37-N117 PolarHBondContact ND1-ND2 2.86Å; H37-N117 PolarHBondContact ND1-OD1 3.27Å; S38-N117 PolarHBondContact N-OD1 2.95Å; S38-N117 PolarHBondContact O-N 2.86Å; N117-C119 VanDerWaalsContact C-N 3.26Å; N117-C119 PolarHBondContact O-N 3.32Å; N117-L352 HydrophobicContact CB-CB 4.35Å; N117-P353 PolarHBondContact ND2-O 3.12Å
118	G	76.3	Confident	82.5	Confident	9 Å²	9	63 Å²	63	9%	0.093	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	78	-3.4	-179.6	0	0	0	0	0	116	V116 A346	V116-G118 PolarHBondContact O-N 2.69Å; V116-G118 VanDerWaalsContact O-N 3.16Å; G118-A346 WeakPolarHBondContact CA-O 3.29Å
119	C	82.6	Confident	82.9	Confident	32 Å²	32	62 Å²	62	22%	0.216	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.3	174.6	-65.6	0	0	0	0	110.7	F115 V116 N117 L121 T354	F115-C119 CarbonylContact C-O 3.56Å; F115-C119 WeakPolarHBondContact CA-O 3.47Å; V116-C119 PolarHBondContact N-O 2.92Å; V116-C119 PolarHBondContact O-N 3.08Å; N117-C119 VanDerWaalsContact C-N 3.26Å; N117-C119 PolarHBondContact O-N 3.32Å; C119-L121 PolarHBondContact O-N 3.36Å; C119-T354 WeakPolarHBondContact CB-O 3.43Å
120	E	85.1	Confident	83.2	Confident	113 Å²	113	58.6 Å²	58.6	53%	0.528	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.5	170.3	-167.2	-165.5	156.6	0	0	109.7	E113 F115	E113-E120 HydrophobicContact CB-CG 4.4Å; F115-E120 HydrophobicContact CD1-CB 4.27Å; F115-E120 HydrophobicContact CE1-CB 3.74Å; F115-E120 HydrophobicContact CE1-CG 4.14Å; F115-E120 HydrophobicContact CZ-CB 4.33Å; F115-E120 HydrophobicContact CZ-CG 4.22Å
121	L	82.5	Confident	83.4	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.037	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-81.7	123	-176.5	-158	69.1	0	0	0	110.5	V114 V116 C119 Q125 F126 C129 F130 V355	V114-L121 PolarHBondContact O-N 3.28Å; V116-L121 HydrophobicContact CG2-CD1 4.45Å; V116-L121 HydrophobicContact CG2-CD2 4.35Å; C119-L121 PolarHBondContact O-N 3.36Å; L121-Q125 HydrophobicContact CD1-CB 3.68Å; L121-Q125 HydrophobicContact CG-CB 4.05Å; L121-F126 HydrophobicContact CB-CE2 4.09Å; L121-F126 HydrophobicContact CB-CZ 4.17Å; L121-F126 HydrophobicContact CD2-CB 4.26Å; L121-F126 HydrophobicContact CD2-CD1 3.68Å; L121-F126 HydrophobicContact CD2-CD2 3.89Å; L121-F126 HydrophobicContact CD2-CE1 3.91Å; L121-F126 HydrophobicContact CD2-CE2 4.11Å; L121-F126 HydrophobicContact CD2-CG 3.69Å; L121-F126 HydrophobicContact CD2-CZ 4.12Å; L121-F126 HydrophobicContact CG-CD2 4.07Å; L121-F126 HydrophobicContact CG-CE2 4.13Å; L121-F126 HydrophobicContact CG-CG 4.35Å; L121-F126 HydrophobicContact CG-CZ 4.45Å; L121-F126 WeakPolarHBondContact O-CE2 3.25Å; L121-C129 HydrophobicContact CD1-CB 4.26Å; L121-C129 HydrophobicContact CD2-CB 4.34Å; L121-F130 HydrophobicContact CD2-CD2 4.12Å; L121-F130 HydrophobicContact CD2-CE2 3.36Å; L121-F130 HydrophobicContact CD2-CZ 4.15Å; L121-V355 HydrophobicContact CD1-CG1 3.92Å; L121-V355 HydrophobicContact CD1-CG2 4.3Å
122	R	80.5	Confident	83.6	Confident	180 Å²	180	50.9 Å²	50.9	68%	0.679	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-74.7	150.5	172.6	-63.5	-177.1	-179.5	179.3	0.5	110	D124 Q125 F126	R122-D124 PolarHBondContact O-N 2.93Å; R122-Q125 HydrophobicContact CB-CG 4.27Å; R122-Q125 WeakPolarHBondContact O-CB 3.36Å; R122-Q125 PolarHBondContact O-N 2.96Å; R122-F126 WeakPolarHBondContact O-CD2 3.44Å
123	R	76.1	Confident	84	Confident	193 Å²	193	49 Å²	49	73%	0.728	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-48.2	-36.9	179	-71.3	-172.6	178.7	174.4	0.1	114.2	Q125 F126	R123-Q125 VanDerWaalsContact C-N 3.31Å; R123-Q125 PolarHBondContact O-N 3.16Å; R123-F126 VanDerWaalsContact CA-CD2 3.49Å
124	D	74.8	Confident	84.1	Confident	139 Å²	139	47.1 Å²	47.1	74%	0.743	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-76.4	-16.9	-179.1	-53.9	-36.8	0	0	0	113.5	R122	R122-D124 PolarHBondContact O-N 2.93Å
125	Q	80.9	Confident	84.1	Confident	49 Å²	49	51.2 Å²	51.2	23%	0.229	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-95.3	-10	-176.1	-63.7	172.1	-24.7	0	0	113.4	L121 R122 R123 Q127 D128 C129	L121-Q125 HydrophobicContact CD1-CB 3.68Å; L121-Q125 HydrophobicContact CG-CB 4.05Å; R122-Q125 HydrophobicContact CB-CG 4.27Å; R122-Q125 WeakPolarHBondContact O-CB 3.36Å; R122-Q125 PolarHBondContact O-N 2.96Å; R123-Q125 VanDerWaalsContact C-N 3.31Å; R123-Q125 PolarHBondContact O-N 3.16Å; Q125-Q127 PolarHBondContact O-N 3.01Å; Q125-D128 PolarHBondContact O-N 3Å; Q125-C129 PolarHBondContact O-N 2.9Å; Q125-C129 VanDerWaalsContact O-N 3.15Å
126	F	81	Confident	84	Confident	13 Å²	13	54.2 Å²	54.2	6%	0.057	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-50.6	-178.7	-83.1	-97.1	0	0	0	112.5	I100 V114 L121 R122 R123 D128 C129 F130	I100-F126 WeakPolarHBondContact O-CD1 3.39Å; I100-F126 VanDerWaalsContact O-CE1 3.23Å; I100-F126 WeakPolarHBondContact O-CE1 3.19Å; V114-F126 HydrophobicContact CB-CE1 4.27Å; V114-F126 HydrophobicContact CB-CZ 4.24Å; V114-F126 HydrophobicContact CG2-CE1 4.22Å; V114-F126 HydrophobicContact CG2-CZ 4.33Å; L121-F126 HydrophobicContact CB-CE2 4.09Å; L121-F126 HydrophobicContact CB-CZ 4.17Å; L121-F126 HydrophobicContact CD2-CB 4.26Å; L121-F126 HydrophobicContact CD2-CD1 3.68Å; L121-F126 HydrophobicContact CD2-CD2 3.89Å; L121-F126 HydrophobicContact CD2-CE1 3.91Å; L121-F126 HydrophobicContact CD2-CE2 4.11Å; L121-F126 HydrophobicContact CD2-CG 3.69Å; L121-F126 HydrophobicContact CD2-CZ 4.12Å; L121-F126 HydrophobicContact CG-CD2 4.07Å; L121-F126 HydrophobicContact CG-CE2 4.13Å; L121-F126 HydrophobicContact CG-CG 4.35Å; L121-F126 HydrophobicContact CG-CZ 4.45Å; L121-F126 WeakPolarHBondContact O-CE2 3.25Å; R122-F126 WeakPolarHBondContact O-CD2 3.44Å; R123-F126 VanDerWaalsContact CA-CD2 3.49Å; F126-D128 VanDerWaalsContact C-N 3.25Å; F126-D128 PolarHBondContact O-N 2.94Å; F126-C129 PolarHBondContact O-N 3.22Å; F126-F130 HydrophobicContact CD1-CD2 4.16Å; F126-F130 AromaticContact CD1-CE2 3.82Å; F126-F130 HydrophobicContact CD1-CE2 3.82Å; F126-F130 HydrophobicContact CE1-CE2 4.28Å; F126-F130 VanDerWaalsContact O-CD2 3.28Å; F126-F130 WeakPolarHBondContact O-CD2 3.41Å; F126-F130 PolarHBondContact O-N 3.48Å; F126-F130 VanDerWaalsContact O-N 3.11Å
127	Q	77.3	Confident	84	Confident	102 Å²	102	54.5 Å²	54.5	48%	0.477	26%	0.261	S	S	.	.	H	α-helix	trans	-65.5	-31	-178	-67.6	-175.2	-3.3	0	0	112.6	Q125	Q125-Q127 PolarHBondContact O-N 3.01Å
128	D	78.8	Confident	84.2	Confident	75 Å²	75	56.2 Å²	56.2	40%	0.401	27%	0.271	S	S	.	.	H	α-helix	trans	-80.5	-20.7	-179.2	-60	-30.9	0	0	0	112.7	Q125 F126 F357 K358	Q125-D128 PolarHBondContact O-N 3Å; F126-D128 VanDerWaalsContact C-N 3.25Å; F126-D128 PolarHBondContact O-N 2.94Å; D128-F357 HydrophobicContact CB-CD1 3.75Å; D128-F357 HydrophobicContact CB-CE1 4.29Å; D128-K358 WeakPolarHBondContact O-CB 3.38Å; D128-K358 PolarHBondContact O-N 3.04Å
129	C	84.7	Confident	85	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-93.2	-38.1	-179	-170.4	0	0	0	0	112.5	L121 Q125 F126 V355	L121-C129 HydrophobicContact CD1-CB 4.26Å; L121-C129 HydrophobicContact CD2-CB 4.34Å; Q125-C129 PolarHBondContact O-N 2.9Å; Q125-C129 VanDerWaalsContact O-N 3.15Å; F126-C129 PolarHBondContact O-N 3.22Å; C129-V355 HydrophobicContact CB-CG1 3.87Å
130	F	89.2	Confident	85.4	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.035	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	143.3	-170.9	-65.3	-69.3	0	0	0	113	L39 I100 V114 V116 L121 F126 V214 M216	L39-F130 HydrophobicContact CD1-CE1 3.86Å; L39-F130 HydrophobicContact CD1-CZ 3.76Å; L39-F130 HydrophobicContact CD2-CE1 4.14Å; I100-F130 HydrophobicContact CG2-CE1 4.11Å; I100-F130 HydrophobicContact CG2-CE2 4.49Å; I100-F130 HydrophobicContact CG2-CZ 3.92Å; I100-F130 WeakPolarHBondContact O-CD2 3.37Å; I100-F130 WeakPolarHBondContact O-CE2 3.46Å; V114-F130 HydrophobicContact CG1-CZ 4.26Å; V116-F130 HydrophobicContact CG2-CZ 4.09Å; L121-F130 HydrophobicContact CD2-CD2 4.12Å; L121-F130 HydrophobicContact CD2-CE2 3.36Å; L121-F130 HydrophobicContact CD2-CZ 4.15Å; F126-F130 HydrophobicContact CD1-CD2 4.16Å; F126-F130 AromaticContact CD1-CE2 3.82Å; F126-F130 HydrophobicContact CD1-CE2 3.82Å; F126-F130 HydrophobicContact CE1-CE2 4.28Å; F126-F130 VanDerWaalsContact O-CD2 3.28Å; F126-F130 WeakPolarHBondContact O-CD2 3.41Å; F126-F130 PolarHBondContact O-N 3.48Å; F126-F130 VanDerWaalsContact O-N 3.11Å; F130-V214 HydrophobicContact CD1-CB 3.81Å; F130-V214 HydrophobicContact CD1-CG1 3.53Å; F130-V214 HydrophobicContact CE1-CB 4.14Å; F130-V214 HydrophobicContact CE1-CG1 3.65Å; F130-M216 HydrophobicContact CB-CE 3.43Å; F130-M216 VanDerWaalsContact CB-CE 3.43Å; F130-M216 HydrophobicContact CD1-CE 3.32Å; F130-M216 HydrophobicContact CD2-CE 4.1Å; F130-M216 HydrophobicContact CE1-CE 4.04Å; F130-M216 HydrophobicContact CG-CE 3.35Å
131	S	90.9	Very high	85.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	138.6	164.6	-153.9	0	0	0	0	110.8	Q207 P212 V214 M216 K358	S131-Q207 VanDerWaalsContact OG-CB 3.28Å; S131-Q207 WeakPolarHBondContact OG-CB 3.19Å; S131-Q207 PolarHBondContact OG-OE1 3.15Å; S131-Q207 VanDerWaalsContact OG-OE1 3.1Å; S131-P212 VanDerWaalsContact CB-CB 3.45Å; S131-V214 PolarHBondContact N-O 3.49Å; S131-M216 PolarHBondContact O-N 2.94Å; S131-K358 WeakPolarHBondContact OG-CE 3.08Å; S131-K358 PolarHBondContact OG-NZ 2.94Å; S131-K358 VanDerWaalsContact OG-NZ 3.11Å
132	Y	92.3	Very high	86.1	Confident	8 Å²	8	51 Å²	51	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	128.1	-174.7	-161.2	-71.5	0	0	0	110.8	L97 D98 L134 Q207 M216 D218	L97-Y132 HydrophobicContact CB-CE2 4.04Å; D98-Y132 WeakPolarHBondContact OD1-CE2 3.33Å; D98-Y132 VanDerWaalsContact OD1-CZ 3.29Å; D98-Y132 PolarHBondContact OD1-OH 3.33Å; Y132-L134 HydrophobicContact CD1-CD2 4.07Å; Y132-L134 HydrophobicContact CD1-CG 4.1Å; Y132-L134 HydrophobicContact CE1-CD2 3.7Å; Y132-L134 HydrophobicContact CE1-CG 4.14Å; Y132-Q207 WeakPolarHBondContact O-CG 3.38Å; Y132-M216 CarbonylContact C-O 3.55Å; Y132-M216 WeakPolarHBondContact CA-O 3.28Å; Y132-M216 HydrophobicContact CD2-CB 4.09Å; Y132-D218 HydrophobicContact CE1-CB 4.09Å
133	V	93.6	Very high	86.8	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.5	170.4	-179.3	0	0	0	0	107.9	I204 Q207 M216 L217 D218	V133-I204 HydrophobicContact CG2-CG1 4.44Å; V133-Q207 HydrophobicContact CG2-CB 4.31Å; V133-Q207 HydrophobicContact CG2-CG 3.82Å; V133-M216 PolarHBondContact N-O 3.34Å; V133-L217 HydrophobicContact CB-CB 4.25Å; V133-L217 HydrophobicContact CB-CD2 3.95Å; V133-L217 HydrophobicContact CB-CG 3.89Å; V133-L217 HydrophobicContact CG1-CD2 4.27Å; V133-L217 HydrophobicContact CG2-CD2 3.88Å; V133-L217 HydrophobicContact CG2-CG 3.96Å; V133-D218 PolarHBondContact O-N 3.15Å
134	L	91.8	Very high	87.7	Confident	32 Å²	32	33.6 Å²	33.6	17%	0.168	18%	0.181	C	C	.	.			trans	-76.8	157.9	-178	-71.3	160.7	0	0	0	112.1	Y132 S136 R200 Q452	Y132-L134 HydrophobicContact CD1-CD2 4.07Å; Y132-L134 HydrophobicContact CD1-CG 4.1Å; Y132-L134 HydrophobicContact CE1-CD2 3.7Å; Y132-L134 HydrophobicContact CE1-CG 4.14Å; L134-S136 VanDerWaalsContact C-N 3.27Å; L134-S136 PolarHBondContact O-N 3.03Å; L134-R200 PolarHBondContact O-NH1 3.41Å; L134-Q452 HydrophobicContact CD1-CB 4.24Å; L134-Q452 HydrophobicContact CD1-CG 3.6Å
135	Q	89.6	Confident	88.7	Confident	94 Å²	94	27 Å²	27	44%	0.439	15%	0.145	S	C	.	.	S	Bend	trans	-54.6	-41.7	174.1	-172.5	-174.1	27.6	0	0	112.3	R200 D218 E219	Q135-R200 VanDerWaalsContact O-CZ 3.31Å; Q135-R200 PolarHBondContact O-NH1 2.98Å; Q135-R200 PolarHBondContact O-NH2 3.15Å; Q135-D218 VanDerWaalsContact CA-O 3.32Å; Q135-D218 WeakPolarHBondContact CA-O 3.39Å; Q135-E219 HydrophobicContact CG-CB 4.09Å; Q135-E219 PolarHBondContact NE2-OE2 3.4Å
136	S	85.7	Confident	89.5	Confident	75 Å²	75	27.9 Å²	27.9	52%	0.524	15%	0.146	S	C	.	.	S	Bend	trans	-108.6	129.5	177.7	66.5	0	0	0	0	112.5	L134	L134-S136 VanDerWaalsContact C-N 3.27Å; L134-S136 PolarHBondContact O-N 3.03Å
137	D	86.3	Confident	90.2	Very high	8 Å²	8	28.1 Å²	28.1	4%	0.043	15%	0.148	C	C	.	.			trans	-92.3	112.4	176.9	-52.6	-45.1	0	0	0	110.8	F139 R199 R200 S203	D137-F139 HydrophobicContact CB-CD2 4.31Å; D137-F139 HydrophobicContact CB-CE2 3.78Å; D137-F139 HydrophobicContact CB-CZ 4.48Å; D137-R199 HydrophobicContact CB-CG 4.43Å; D137-R199 PolarHBondContact O-NE 3.16Å; D137-R199 PolarHBondContact O-NH2 2.93Å; D137-R200 VanDerWaalsContact CG-NH1 3.26Å; D137-R200 IonicContact OD1-CZ 3.74Å; D137-R200 IonicContact OD1-NH1 2.7Å; D137-R200 PolarHBondContact OD1-NH1 2.88Å; D137-R200 WeakPolarHBondContact OD2-CA 3.24Å; D137-R200 WeakPolarHBondContact OD2-CD 3.43Å; D137-R200 IonicContact OD2-CZ 2.74Å; D137-R200 IonicContact OD2-NE 2.61Å; D137-R200 PolarHBondContact OD2-NE 3.16Å; D137-R200 IonicContact OD2-NH1 2.78Å; D137-R200 PolarHBondContact OD2-NH1 2.84Å; D137-R200 VanDerWaalsContact OD2-NH1 3.13Å; D137-S203 VanDerWaalsContact CG-CB 3.47Å; D137-S203 WeakPolarHBondContact OD1-CB 3.42Å; D137-S203 PolarHBondContact OD1-OG 2.93Å
138	V	88.6	Confident	91.1	Very high	41 Å²	41	23.3 Å²	23.3	25%	0.248	13%	0.125	C	C	.	.			trans	-106.8	113.8	174.9	-168.4	0	0	0	0	110.4	A448 V449 Q452	V138-A448 HydrophobicContact CG1-CB 4.31Å; V138-V449 HydrophobicContact CB-CG2 4.43Å; V138-V449 HydrophobicContact CG1-CG2 3.7Å; V138-Q452 VanDerWaalsContact CB-OE1 3.29Å; V138-Q452 VanDerWaalsContact N-OE1 3.11Å
139	F	92.2	Very high	91.9	Very high	10 Å²	10	19.7 Å²	19.7	4%	0.044	11%	0.106	C	C	.	.			trans	-120.3	161.8	175.3	-64	-65.7	0	0	0	111.8	D137 S141 T148 I186 R199 V202 M445	D137-F139 HydrophobicContact CB-CD2 4.31Å; D137-F139 HydrophobicContact CB-CE2 3.78Å; D137-F139 HydrophobicContact CB-CZ 4.48Å; F139-S141 PolarHBondContact O-N 3.41Å; F139-T148 HydrophobicContact CD1-CG2 3.89Å; F139-T148 HydrophobicContact CE1-CG2 4.33Å; F139-I186 HydrophobicContact CB-CD1 4.12Å; F139-I186 HydrophobicContact CB-CG2 4.01Å; F139-I186 HydrophobicContact CD2-CG2 4.27Å; F139-I186 HydrophobicContact CG-CD1 4.26Å; F139-I186 HydrophobicContact CG-CG2 4.46Å; F139-R199 HydrophobicContact CD2-CG 4.04Å; F139-R199 HydrophobicContact CE2-CG 4.05Å; F139-V202 HydrophobicContact CE1-CG1 4.3Å; F139-V202 HydrophobicContact CE2-CB 4.42Å; F139-V202 HydrophobicContact CE2-CG1 4.2Å; F139-V202 HydrophobicContact CZ-CB 4.43Å; F139-V202 HydrophobicContact CZ-CG1 3.94Å; F139-M445 WeakPolarHBondContact O-CE 3.37Å
140	L	91.8	Very high	92.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.			trans	-74.3	113.9	169	-63.9	178.4	0	0	0	109.4	S142 L143 R375 N379 M445 L446 V449	L140-S142 VanDerWaalsContact C-N 3.29Å; L140-S142 PolarHBondContact O-N 3.08Å; L140-L143 HydrophobicContact CB-CD1 4.02Å; L140-L143 HydrophobicContact CB-CG 4.19Å; L140-L143 HydrophobicContact CD1-CD1 3.82Å; L140-L143 PolarHBondContact O-N 3.34Å; L140-R375 HydrophobicContact CD1-CG 3.97Å; L140-N379 HydrophobicContact CD1-CB 4.25Å; L140-M445 HydrophobicContact CD2-CG 4.48Å; L140-M445 HydrophobicContact CD2-SD 4.4Å; L140-L446 HydrophobicContact CD2-CD1 4.04Å; L140-L446 HydrophobicContact CD2-CG 4.3Å; L140-V449 HydrophobicContact CD2-CG2 4.06Å; L140-V449 HydrophobicContact CG-CG2 4.43Å
141	S	90.1	Very high	92.6	Very high	30 Å²	30	23 Å²	23	21%	0.21	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-24.3	-168.7	54.7	0	0	0	0	115.3	F139 G187	F139-S141 PolarHBondContact O-N 3.41Å; S141-G187 WeakPolarHBondContact CA-O 3.44Å; S141-G187 VanDerWaalsContact CB-C 3.5Å; S141-G187 WeakPolarHBondContact CB-O 3.33Å; S141-G187 WeakPolarHBondContact O-CA 3.14Å; S141-G187 PolarHBondContact O-N 2.85Å
142	S	92.2	Very high	92.7	Very high	12 Å²	12	23.2 Å²	23.2	8%	0.084	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-1	-175.2	79.5	0	0	0	0	114.5	L140 N379 R382	L140-S142 VanDerWaalsContact C-N 3.29Å; L140-S142 PolarHBondContact O-N 3.08Å; S142-N379 VanDerWaalsContact OG-CA 3.24Å; S142-N379 WeakPolarHBondContact OG-CA 3.27Å; S142-N379 PolarHBondContact OG-O 3.39Å; S142-N379 PolarHBondContact OG-OD1 2.92Å; S142-R382 WeakPolarHBondContact O-CD 3.49Å; S142-R382 PolarHBondContact O-NH1 3.25Å
143	L	94.3	Very high	92.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	-92.1	155	175.6	-61.3	-176.6	0	0	0	110.8	L140 T148 Y151 I186 R375 R378 N379	L140-L143 HydrophobicContact CB-CD1 4.02Å; L140-L143 HydrophobicContact CB-CG 4.19Å; L140-L143 HydrophobicContact CD1-CD1 3.82Å; L140-L143 PolarHBondContact O-N 3.34Å; L143-T148 WeakPolarHBondContact CB-OG1 3.26Å; L143-Y151 HydrophobicContact CD1-CD2 4.08Å; L143-Y151 HydrophobicContact CD1-CE2 4.21Å; L143-Y151 HydrophobicContact CD2-CE2 4.47Å; L143-I186 PolarHBondContact O-N 2.74Å; L143-R375 HydrophobicContact CD1-CG 3.8Å; L143-R378 HydrophobicContact CD2-CB 4.3Å; L143-R378 HydrophobicContact CD2-CG 4.1Å; L143-N379 HydrophobicContact CD2-CB 4.28Å; L143-N379 HydrophobicContact CG-CB 4.4Å
144	T	95.6	Very high	92.5	Very high	7 Å²	7	23.9 Å²	23.9	4%	0.043	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-80.4	165.4	171.9	68.2	0	0	0	0	111.2	E147 T148 D183 Q184	T144-E147 PolarHBondContact O-N 3.36Å; T144-E147 WeakPolarHBondContact OG1-CB 3.35Å; T144-E147 VanDerWaalsContact OG1-CD 3.28Å; T144-E147 WeakPolarHBondContact OG1-CG 3.07Å; T144-E147 PolarHBondContact OG1-N 3.31Å; T144-T148 WeakPolarHBondContact O-CB 3.37Å; T144-T148 PolarHBondContact O-N 2.92Å; T144-T148 PolarHBondContact O-OG1 2.94Å; T144-D183 VanDerWaalsContact CG2-O 3.26Å; T144-D183 WeakPolarHBondContact CG2-O 3.45Å; T144-Q184 WeakPolarHBondContact CA-O 3.16Å; T144-Q184 WeakPolarHBondContact CB-O 3.41Å
145	V	96.4	Very high	92.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-56.4	-53	174.2	175.2	0	0	0	0	110.6	E147 T148 L149 M173 Q184 I186 I194 V202	V145-E147 VanDerWaalsContact C-N 3.3Å; V145-E147 PolarHBondContact O-N 3.44Å; V145-T148 PolarHBondContact O-N 3.28Å; V145-L149 HydrophobicContact CG1-CD1 4Å; V145-L149 WeakPolarHBondContact O-CG 3.27Å; V145-L149 PolarHBondContact O-N 2.98Å; V145-M173 HydrophobicContact CG1-SD 4.28Å; V145-Q184 PolarHBondContact N-O 2.83Å; V145-I186 HydrophobicContact CG2-CG1 4.02Å; V145-I194 HydrophobicContact CG2-CD1 4.07Å; V145-I194 HydrophobicContact CG2-CG2 4.08Å; V145-V202 HydrophobicContact CB-CG2 4.39Å; V145-V202 HydrophobicContact CG1-CG1 4.4Å; V145-V202 HydrophobicContact CG1-CG2 3.6Å; V145-V202 HydrophobicContact CG2-CG2 3.95Å
146	R	96.6	Very high	92.3	Very high	67 Å²	67	18.4 Å²	18.4	25%	0.253	10%	0.099	S	C	.	.	H	α-helix	trans	-57.4	-41.9	178.2	179	-179.2	-71.6	139.2	1.4	112.2	R150 V169 E170 M173 A182 D183	R146-R150 WeakPolarHBondContact O-CB 3.4Å; R146-R150 PolarHBondContact O-N 2.88Å; R146-V169 HydrophobicContact CG-CG1 4.42Å; R146-E170 IonicContact CZ-OE1 2.62Å; R146-E170 IonicContact NE-OE1 3.56Å; R146-E170 PolarHBondContact NE-OE1 2.87Å; R146-E170 IonicContact NH2-OE1 3.62Å; R146-E170 PolarHBondContact NH2-OE1 2.84Å; R146-E170 IonicContact NH2-OE2 3.35Å; R146-M173 HydrophobicContact CB-CE 4.33Å; R146-M173 HydrophobicContact CB-SD 4.2Å; R146-M173 HydrophobicContact CG-CE 4.3Å; R146-A182 HydrophobicContact CB-CB 4.49Å; R146-A182 VanDerWaalsContact CB-O 3.24Å; R146-A182 WeakPolarHBondContact CB-O 3.31Å; R146-A182 PolarHBondContact N-O 3.43Å; R146-D183 IonicContact CZ-OD1 3.11Å; R146-D183 IonicContact CZ-OD2 2.87Å; R146-D183 IonicContact NH1-OD1 3.98Å; R146-D183 PolarHBondContact NH1-OD1 3.35Å; R146-D183 IonicContact NH1-OD2 3.96Å; R146-D183 PolarHBondContact NH1-OD2 3.11Å; R146-D183 IonicContact NH2-OD2 2.65Å
147	E	95.8	Very high	92.2	Very high	19 Å²	19	15.4 Å²	15.4	9%	0.089	8%	0.077	C	C	.	.	H	α-helix	trans	-68.2	-43.4	-179.8	-75.2	168.4	-166.9	0	0	112.5	T144 V145 L149 R150 Y151 R378 R382	T144-E147 PolarHBondContact O-N 3.36Å; T144-E147 WeakPolarHBondContact OG1-CB 3.35Å; T144-E147 VanDerWaalsContact OG1-CD 3.28Å; T144-E147 WeakPolarHBondContact OG1-CG 3.07Å; T144-E147 PolarHBondContact OG1-N 3.31Å; V145-E147 VanDerWaalsContact C-N 3.3Å; V145-E147 PolarHBondContact O-N 3.44Å; E147-L149 VanDerWaalsContact C-N 3.35Å; E147-R150 PolarHBondContact O-N 3.46Å; E147-Y151 HydrophobicContact CB-CD2 4.43Å; E147-Y151 HydrophobicContact CB-CE2 4.24Å; E147-Y151 WeakPolarHBondContact O-CD2 3.38Å; E147-Y151 PolarHBondContact O-N 3.42Å; E147-R378 IonicContact OE1-CZ 3.74Å; E147-R378 IonicContact OE1-NE 3.16Å; E147-R378 IonicContact OE1-NH1 3.86Å; E147-R378 PolarHBondContact OE1-NH1 3.11Å; E147-R378 IonicContact OE1-NH2 2.69Å; E147-R378 PolarHBondContact OE1-NH2 3.37Å; E147-R378 IonicContact OE2-CZ 3.52Å; E147-R378 IonicContact OE2-NE 2.63Å; E147-R378 PolarHBondContact OE2-NE 3.19Å; E147-R378 IonicContact OE2-NH1 3.59Å; E147-R378 IonicContact OE2-NH2 3.43Å; E147-R382 VanDerWaalsContact CD-NH1 3.29Å; E147-R382 IonicContact OE1-CZ 3.89Å; E147-R382 IonicContact OE1-NH1 3.54Å; E147-R382 PolarHBondContact OE1-NH1 3.44Å; E147-R382 IonicContact OE1-NH2 3.89Å; E147-R382 PolarHBondContact OE1-NH2 3.39Å; E147-R382 IonicContact OE2-CZ 3.27Å; E147-R382 IonicContact OE2-NH1 2.66Å; E147-R382 PolarHBondContact OE2-NH1 3.14Å; E147-R382 IonicContact OE2-NH2 2.96Å; E147-R382 PolarHBondContact OE2-NH2 2.99Å
148	T	95.8	Very high	91.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.5	-48.3	178	-59.7	0	0	0	0	110.1	F139 L143 T144 V145 R150 Y151 T152 I186	F139-T148 HydrophobicContact CD1-CG2 3.89Å; F139-T148 HydrophobicContact CE1-CG2 4.33Å; L143-T148 WeakPolarHBondContact CB-OG1 3.26Å; T144-T148 WeakPolarHBondContact O-CB 3.37Å; T144-T148 PolarHBondContact O-N 2.92Å; T144-T148 PolarHBondContact O-OG1 2.94Å; V145-T148 PolarHBondContact O-N 3.28Å; T148-R150 VanDerWaalsContact C-N 3.35Å; T148-R150 PolarHBondContact O-N 2.67Å; T148-Y151 PolarHBondContact O-N 2.69Å; T148-T152 WeakPolarHBondContact O-CG2 3.43Å; T148-T152 PolarHBondContact O-N 3.4Å; T148-T152 PolarHBondContact O-OG1 3.37Å; T148-I186 HydrophobicContact CG2-CD1 4.01Å; T148-I186 WeakPolarHBondContact OG1-CD1 3.46Å
149	L	95.9	Very high	90.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.1	-36.9	176.2	-66.3	178	0	0	0	112.9	V145 E147 T152 A153 V169 M173 V202 A205 A206 L209	V145-L149 HydrophobicContact CG1-CD1 4Å; V145-L149 WeakPolarHBondContact O-CG 3.27Å; V145-L149 PolarHBondContact O-N 2.98Å; E147-L149 VanDerWaalsContact C-N 3.35Å; L149-T152 WeakPolarHBondContact CA-OG1 3.19Å; L149-T152 PolarHBondContact O-OG1 3.18Å; L149-A153 VanDerWaalsContact O-CB 3.24Å; L149-A153 WeakPolarHBondContact O-CB 3.31Å; L149-A153 PolarHBondContact O-N 3.34Å; L149-V169 HydrophobicContact CB-CG1 3.72Å; L149-V169 HydrophobicContact CB-CG2 4.19Å; L149-V169 HydrophobicContact CD1-CG1 4.36Å; L149-M173 HydrophobicContact CD1-CG 3.56Å; L149-M173 HydrophobicContact CD1-SD 4.02Å; L149-V202 HydrophobicContact CD2-CG1 4.42Å; L149-A205 HydrophobicContact CD1-CB 3.96Å; L149-A205 HydrophobicContact CD2-CB 3.62Å; L149-A205 HydrophobicContact CG-CB 4.46Å; L149-A206 HydrophobicContact CD2-CB 4.19Å; L149-L209 HydrophobicContact CB-CD1 4.08Å; L149-L209 HydrophobicContact CD2-CD1 3.89Å; L149-L209 VanDerWaalsContact O-CD1 3.25Å; L149-L209 WeakPolarHBondContact O-CD1 3.31Å
150	R	94.9	Very high	89.3	Confident	69 Å²	69	29.5 Å²	29.5	26%	0.26	16%	0.156	S	C	.	.	H	α-helix	trans	-65.2	-42.4	174.8	-177.7	176.1	176.3	168	2	111.9	R146 E147 T148 A153 M154 N166	R146-R150 WeakPolarHBondContact O-CB 3.4Å; R146-R150 PolarHBondContact O-N 2.88Å; E147-R150 PolarHBondContact O-N 3.46Å; T148-R150 VanDerWaalsContact C-N 3.35Å; T148-R150 PolarHBondContact O-N 2.67Å; R150-A153 PolarHBondContact O-N 2.93Å; R150-M154 HydrophobicContact CG-CE 3.89Å; R150-M154 HydrophobicContact CG-SD 4.24Å; R150-M154 VanDerWaalsContact NE-CE 3.29Å; R150-M154 WeakPolarHBondContact O-CB 3.32Å; R150-M154 VanDerWaalsContact O-CG 3.24Å; R150-M154 WeakPolarHBondContact O-CG 3.13Å; R150-M154 PolarHBondContact O-N 3.04Å; R150-N166 WeakPolarHBondContact CD-OD1 3.22Å; R150-N166 PolarHBondContact NE-OD1 3.49Å; R150-N166 PolarHBondContact NH1-OD1 3.29Å
151	Y	94.3	Very high	88.8	Confident	7 Å²	7	32.6 Å²	32.6	3%	0.027	18%	0.177	C	C	.	.	H	α-helix	trans	-67.7	-41.3	177.3	-73.2	-58.5	0	0	0	112	L143 E147 T148 M154 L155 V371 R374 R375 R378	L143-Y151 HydrophobicContact CD1-CD2 4.08Å; L143-Y151 HydrophobicContact CD1-CE2 4.21Å; L143-Y151 HydrophobicContact CD2-CE2 4.47Å; E147-Y151 HydrophobicContact CB-CD2 4.43Å; E147-Y151 HydrophobicContact CB-CE2 4.24Å; E147-Y151 WeakPolarHBondContact O-CD2 3.38Å; E147-Y151 PolarHBondContact O-N 3.42Å; T148-Y151 PolarHBondContact O-N 2.69Å; Y151-M154 PolarHBondContact O-N 3.45Å; Y151-L155 VanDerWaalsContact O-CG 3.27Å; Y151-L155 WeakPolarHBondContact O-CG 3.25Å; Y151-L155 PolarHBondContact O-N 2.95Å; Y151-V371 HydrophobicContact CD1-CG1 3.88Å; Y151-R374 HydrophobicContact CE1-CB 4.48Å; Y151-R374 HydrophobicContact CE1-CG 4.3Å; Y151-R375 HydrophobicContact CD1-CB 3.88Å; Y151-R375 HydrophobicContact CD1-CG 4.31Å; Y151-R375 HydrophobicContact CD2-CB 4.09Å; Y151-R375 HydrophobicContact CD2-CG 3.7Å; Y151-R375 HydrophobicContact CE1-CB 3.98Å; Y151-R375 HydrophobicContact CE2-CB 4.2Å; Y151-R375 HydrophobicContact CE2-CG 4.08Å; Y151-R375 HydrophobicContact CG-CB 3.96Å; Y151-R375 HydrophobicContact CG-CG 3.86Å; Y151-R378 VanDerWaalsContact OH-CD 3.26Å; Y151-R378 WeakPolarHBondContact OH-CD 3.37Å
152	T	92.9	Very high	88.5	Confident	5 Å²	5	33.4 Å²	33.4	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-41.7	174.9	54.7	0	0	0	0	111.2	T148 L149 M154 L155 A156 L209	T148-T152 WeakPolarHBondContact O-CG2 3.43Å; T148-T152 PolarHBondContact O-N 3.4Å; T148-T152 PolarHBondContact O-OG1 3.37Å; L149-T152 WeakPolarHBondContact CA-OG1 3.19Å; L149-T152 PolarHBondContact O-OG1 3.18Å; T152-M154 PolarHBondContact O-N 2.97Å; T152-L155 PolarHBondContact O-N 2.82Å; T152-L155 VanDerWaalsContact O-N 3.16Å; T152-A156 WeakPolarHBondContact O-CB 3.43Å; T152-A156 PolarHBondContact O-N 2.88Å; T152-L209 WeakPolarHBondContact OG1-CD1 3.14Å
153	A	91.8	Very high	88.4	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-43.6	175.4	0	0	0	0	0	112.2	L149 R150 L155 A156 L157 Y165 V169 L209	L149-A153 VanDerWaalsContact O-CB 3.24Å; L149-A153 WeakPolarHBondContact O-CB 3.31Å; L149-A153 PolarHBondContact O-N 3.34Å; R150-A153 PolarHBondContact O-N 2.93Å; A153-L155 VanDerWaalsContact C-N 3.27Å; A153-L155 PolarHBondContact O-N 3Å; A153-A156 PolarHBondContact O-N 2.94Å; A153-L157 HydrophobicContact CB-CD1 4.43Å; A153-L157 WeakPolarHBondContact O-CB 3.33Å; A153-L157 PolarHBondContact O-N 2.97Å; A153-Y165 HydrophobicContact CB-CD1 3.93Å; A153-Y165 WeakPolarHBondContact O-CE1 3.35Å; A153-V169 HydrophobicContact CB-CG2 4.06Å; A153-L209 HydrophobicContact CB-CD1 4.1Å; A153-L209 HydrophobicContact CB-CD2 4.21Å
154	M	91	Very high	88.1	Confident	25 Å²	25	40.8 Å²	40.8	12%	0.123	22%	0.222	C	C	.	.	H	α-helix	trans	-66.1	-25.8	176.5	-75.2	177.2	173.5	0	0	113.7	R150 Y151 T152 Y165 V371	R150-M154 HydrophobicContact CG-CE 3.89Å; R150-M154 HydrophobicContact CG-SD 4.24Å; R150-M154 VanDerWaalsContact NE-CE 3.29Å; R150-M154 WeakPolarHBondContact O-CB 3.32Å; R150-M154 VanDerWaalsContact O-CG 3.24Å; R150-M154 WeakPolarHBondContact O-CG 3.13Å; R150-M154 PolarHBondContact O-N 3.04Å; Y151-M154 PolarHBondContact O-N 3.45Å; T152-M154 PolarHBondContact O-N 2.97Å; M154-Y165 HydrophobicContact CE-CD2 4.17Å; M154-Y165 HydrophobicContact CG-CD1 4.12Å; M154-Y165 HydrophobicContact CG-CD2 4.09Å; M154-Y165 HydrophobicContact CG-CE1 4.18Å; M154-Y165 HydrophobicContact CG-CE2 4.18Å; M154-Y165 HydrophobicContact CG-CG 4.05Å; M154-V371 HydrophobicContact CB-CG1 3.92Å; M154-V371 HydrophobicContact CB-CG2 4.22Å
155	L	89.9	Confident	87.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-85.9	-30.6	177	-71.1	169.3	0	0	0	112.5	Y151 T152 A153 P363 K368 V371 L372 L458 Y459	Y151-L155 VanDerWaalsContact O-CG 3.27Å; Y151-L155 WeakPolarHBondContact O-CG 3.25Å; Y151-L155 PolarHBondContact O-N 2.95Å; T152-L155 PolarHBondContact O-N 2.82Å; T152-L155 VanDerWaalsContact O-N 3.16Å; A153-L155 VanDerWaalsContact C-N 3.27Å; A153-L155 PolarHBondContact O-N 3Å; L155-P363 VanDerWaalsContact O-CD 3.25Å; L155-P363 WeakPolarHBondContact O-CD 3.38Å; L155-P363 VanDerWaalsContact O-CG 3.3Å; L155-P363 WeakPolarHBondContact O-CG 3.35Å; L155-K368 HydrophobicContact CD2-CB 4.13Å; L155-K368 HydrophobicContact CD2-CG 4.25Å; L155-V371 HydrophobicContact CD2-CB 4.04Å; L155-V371 HydrophobicContact CD2-CG1 3.97Å; L155-V371 HydrophobicContact CG-CG1 3.95Å; L155-L372 HydrophobicContact CD1-CD2 4.01Å; L155-L372 HydrophobicContact CD1-CG 4.47Å; L155-L372 HydrophobicContact CD2-CD2 4.5Å; L155-L372 HydrophobicContact CD2-CG 4.08Å; L155-L458 HydrophobicContact CB-CD2 4.15Å; L155-Y459 HydrophobicContact CD1-CD1 4.03Å; L155-Y459 HydrophobicContact CD1-CE1 4.12Å
156	A	86.3	Confident	87.7	Confident	12 Å²	12	43.4 Å²	43.4	10%	0.099	23%	0.234	C	C	.	.	H	α-helix	trans	-85	-40.5	-177.6	0	0	0	0	0	113.6	T152 A153 Q210 L458	T152-A156 WeakPolarHBondContact O-CB 3.43Å; T152-A156 PolarHBondContact O-N 2.88Å; A153-A156 PolarHBondContact O-N 2.94Å; A156-Q210 HydrophobicContact CB-CG 3.96Å; A156-L458 HydrophobicContact CB-CD2 3.76Å
157	L	83.9	Confident	87.5	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.063	26%	0.255	C	S	.	.			trans	-107.2	130	-168.5	-52.5	163.5	0	0	0	110.7	A153 R159 F164 Y165 K168 T359	A153-L157 HydrophobicContact CB-CD1 4.43Å; A153-L157 WeakPolarHBondContact O-CB 3.33Å; A153-L157 PolarHBondContact O-N 2.97Å; L157-R159 PolarHBondContact O-N 3.3Å; L157-F164 HydrophobicContact CD1-CE1 4.4Å; L157-Y165 HydrophobicContact CB-CE1 4.07Å; L157-Y165 PolarHBondContact O-OH 3.21Å; L157-K168 HydrophobicContact CD1-CD 3.66Å; L157-T359 HydrophobicContact CD2-CG2 3.71Å
158	C	72.5	Confident	87.3	Confident	69 Å²	69	48 Å²	48	47%	0.466	26%	0.255	S	S	.	.			trans	-85.7	83.6	169	-174.6	0	0	0	0	110.7	D361	C158-D361 HydrophobicContact CB-CB 3.81Å; C158-D361 WeakPolarHBondContact CB-O 3.35Å; C158-D361 PolarHBondContact N-O 3.31Å
159	R	70.2	Confident	87.3	Confident	149 Å²	149	48 Å²	48	56%	0.562	26%	0.256	S	S	*	.			trans	-136.5	145.6	170.5	-69.9	-167.6	176.6	178.9	0.4	113	L157 F164 Y165	L157-R159 PolarHBondContact O-N 3.3Å; R159-F164 HydrophobicContact CB-CD1 4.18Å; R159-Y165 PolarHBondContact N-OH 2.79Å; R159-Y165 VanDerWaalsContact O-CE2 3.22Å; R159-Y165 WeakPolarHBondContact O-CE2 3.48Å; R159-Y165 PolarHBondContact O-OH 2.99Å
160	S	63.1	Low	87.3	Confident	137 Å²	137	51 Å²	51	96%	0.958	27%	0.27	S	S	*	.			trans	-82.7	-26.4	-166	-52.6	0	0	0	0	114.9
161	S	81.4	Confident	87.3	Confident	64 Å²	64	50.5 Å²	50.5	45%	0.448	28%	0.28	S	S	.	.			trans	-92.4	126.5	-172	61.9	0	0	0	0	113.1	D163 F164 Y165	S161-D163 PolarHBondContact O-N 2.88Å; S161-F164 WeakPolarHBondContact O-CB 3.42Å; S161-F164 PolarHBondContact O-N 3.44Å; S161-F164 VanDerWaalsContact O-N 3.15Å; S161-F164 VanDerWaalsContact OG-CB 3.27Å; S161-F164 WeakPolarHBondContact OG-CB 3.46Å; S161-Y165 VanDerWaalsContact O-CD2 3.23Å; S161-Y165 WeakPolarHBondContact O-CD2 3.43Å
162	A	84.2	Confident	87.3	Confident	47 Å²	47	50.4 Å²	50.4	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-54.7	-35.3	173.6	0	0	0	0	0	112.5	Y165 N166	A162-Y165 PolarHBondContact O-N 3.13Å; A162-N166 PolarHBondContact O-N 2.9Å; A162-N166 PolarHBondContact O-ND2 3.23Å
163	D	88.9	Confident	87.4	Confident	110 Å²	110	50.2 Å²	50.2	59%	0.588	28%	0.279	S	S	*	.	H	α-helix	trans	-69	-32.4	-179	-61.4	-25	0	0	0	112.9	S161 N166 K167	S161-D163 PolarHBondContact O-N 2.88Å; D163-N166 PolarHBondContact O-N 3.33Å; D163-K167 WeakPolarHBondContact O-CB 3.29Å; D163-K167 WeakPolarHBondContact O-CG 3.08Å; D163-K167 PolarHBondContact O-N 3.11Å
164	F	89.1	Confident	87.5	Confident	58 Å²	58	54.3 Å²	54.3	25%	0.254	30%	0.304	S	S	.	.	H	α-helix	trans	-63.3	-44.8	175.8	178.5	-92.8	0	0	0	111	L157 R159 S161 N166 K167 K168	L157-F164 HydrophobicContact CD1-CE1 4.4Å; R159-F164 HydrophobicContact CB-CD1 4.18Å; S161-F164 WeakPolarHBondContact O-CB 3.42Å; S161-F164 PolarHBondContact O-N 3.44Å; S161-F164 VanDerWaalsContact O-N 3.15Å; S161-F164 VanDerWaalsContact OG-CB 3.27Å; S161-F164 WeakPolarHBondContact OG-CB 3.46Å; F164-N166 PolarHBondContact O-N 3.46Å; F164-K167 PolarHBondContact O-N 3.04Å; F164-K168 HydrophobicContact CE1-CD 4.21Å; F164-K168 HydrophobicContact CZ-CD 4.39Å; F164-K168 WeakPolarHBondContact O-CB 3.3Å; F164-K168 PolarHBondContact O-N 2.95Å
165	Y	89.7	Confident	87.5	Confident	18 Å²	18	55.1 Å²	55.1	7%	0.071	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-46.9	176.5	-62.9	-71	0	0	0	111.6	A153 M154 L157 R159 S161 A162 K167 K168 V169	A153-Y165 HydrophobicContact CB-CD1 3.93Å; A153-Y165 WeakPolarHBondContact O-CE1 3.35Å; M154-Y165 HydrophobicContact CE-CD2 4.17Å; M154-Y165 HydrophobicContact CG-CD1 4.12Å; M154-Y165 HydrophobicContact CG-CD2 4.09Å; M154-Y165 HydrophobicContact CG-CE1 4.18Å; M154-Y165 HydrophobicContact CG-CE2 4.18Å; M154-Y165 HydrophobicContact CG-CG 4.05Å; L157-Y165 HydrophobicContact CB-CE1 4.07Å; L157-Y165 PolarHBondContact O-OH 3.21Å; R159-Y165 PolarHBondContact N-OH 2.79Å; R159-Y165 VanDerWaalsContact O-CE2 3.22Å; R159-Y165 WeakPolarHBondContact O-CE2 3.48Å; R159-Y165 PolarHBondContact O-OH 2.99Å; S161-Y165 VanDerWaalsContact O-CD2 3.23Å; S161-Y165 WeakPolarHBondContact O-CD2 3.43Å; A162-Y165 PolarHBondContact O-N 3.13Å; Y165-K167 PolarHBondContact O-N 2.8Å; Y165-K168 PolarHBondContact O-N 2.86Å; Y165-V169 WeakPolarHBondContact O-CB 3.44Å; Y165-V169 WeakPolarHBondContact O-CG2 3.08Å; Y165-V169 PolarHBondContact O-N 2.73Å
166	N	92.5	Very high	87.7	Confident	44 Å²	44	55.1 Å²	55.1	24%	0.235	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-46.8	179.8	-65.9	-28.2	0	0	0	111	R150 A162 D163 F164 K168 V169 E170	R150-N166 WeakPolarHBondContact CD-OD1 3.22Å; R150-N166 PolarHBondContact NE-OD1 3.49Å; R150-N166 PolarHBondContact NH1-OD1 3.29Å; A162-N166 PolarHBondContact O-N 2.9Å; A162-N166 PolarHBondContact O-ND2 3.23Å; D163-N166 PolarHBondContact O-N 3.33Å; F164-N166 PolarHBondContact O-N 3.46Å; N166-K168 VanDerWaalsContact C-N 3.33Å; N166-K168 PolarHBondContact O-N 3.41Å; N166-V169 PolarHBondContact O-N 2.9Å; N166-E170 WeakPolarHBondContact O-CB 3.49Å; N166-E170 VanDerWaalsContact O-CG 3.32Å; N166-E170 WeakPolarHBondContact O-CG 3.2Å; N166-E170 PolarHBondContact O-N 2.84Å
167	K	93.5	Very high	88	Confident	157 Å²	157	57.9 Å²	57.9	68%	0.683	33%	0.326	S	S	*	.	H	α-helix	trans	-59.5	-42.8	177.6	-74.4	179.1	179.7	-177.4	0	112.3	D163 F164 Y165 E170 A171	D163-K167 WeakPolarHBondContact O-CB 3.29Å; D163-K167 WeakPolarHBondContact O-CG 3.08Å; D163-K167 PolarHBondContact O-N 3.11Å; F164-K167 PolarHBondContact O-N 3.04Å; Y165-K167 PolarHBondContact O-N 2.8Å; K167-E170 PolarHBondContact O-N 2.74Å; K167-A171 WeakPolarHBondContact O-CB 3.3Å; K167-A171 PolarHBondContact O-N 3.43Å
168	K	92.3	Very high	88.5	Confident	24 Å²	24	57.3 Å²	57.3	10%	0.104	32%	0.323	C	S	.	.	H	α-helix	trans	-66.3	-42.8	177.9	-167	175.1	-168.9	-179.8	0	111.9	L157 F164 Y165 N166 A171 V172 L209 D211	L157-K168 HydrophobicContact CD1-CD 3.66Å; F164-K168 HydrophobicContact CE1-CD 4.21Å; F164-K168 HydrophobicContact CZ-CD 4.39Å; F164-K168 WeakPolarHBondContact O-CB 3.3Å; F164-K168 PolarHBondContact O-N 2.95Å; Y165-K168 PolarHBondContact O-N 2.86Å; N166-K168 VanDerWaalsContact C-N 3.33Å; N166-K168 PolarHBondContact O-N 3.41Å; K168-A171 PolarHBondContact O-N 3.31Å; K168-V172 WeakPolarHBondContact O-CG2 3.46Å; K168-V172 PolarHBondContact O-N 2.78Å; K168-L209 WeakPolarHBondContact CE-O 3.34Å; K168-L209 HydrophobicContact CG-CD2 4.44Å; K168-L209 PolarHBondContact NZ-O 2.83Å; K168-D211 WeakPolarHBondContact CE-OD2 3.29Å; K168-D211 IonicContact NZ-OD1 2.74Å; K168-D211 IonicContact NZ-OD2 3.95Å; K168-D211 PolarHBondContact NZ-OD2 2.82Å
169	V	94.9	Very high	89.5	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-44	176.7	170	0	0	0	0	110.8	R146 L149 A153 Y165 N166 A171 V172 M173 L209	R146-V169 HydrophobicContact CG-CG1 4.42Å; L149-V169 HydrophobicContact CB-CG1 3.72Å; L149-V169 HydrophobicContact CB-CG2 4.19Å; L149-V169 HydrophobicContact CD1-CG1 4.36Å; A153-V169 HydrophobicContact CB-CG2 4.06Å; Y165-V169 WeakPolarHBondContact O-CB 3.44Å; Y165-V169 WeakPolarHBondContact O-CG2 3.08Å; Y165-V169 PolarHBondContact O-N 2.73Å; N166-V169 PolarHBondContact O-N 2.9Å; V169-A171 VanDerWaalsContact C-N 3.35Å; V169-A171 PolarHBondContact O-N 2.89Å; V169-V172 PolarHBondContact O-N 2.9Å; V169-M173 HydrophobicContact CG1-CE 3.81Å; V169-M173 HydrophobicContact CG1-CG 4.35Å; V169-M173 HydrophobicContact CG1-SD 4.07Å; V169-M173 WeakPolarHBondContact O-CB 2.93Å; V169-M173 VanDerWaalsContact O-CG 3.29Å; V169-M173 WeakPolarHBondContact O-CG 3.35Å; V169-M173 PolarHBondContact O-N 3.16Å; V169-L209 HydrophobicContact CG2-CD2 3.88Å
170	E	96	Very high	90.7	Very high	63 Å²	63	55.3 Å²	55.3	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-39.1	175.3	-69.5	-58.7	145.5	0	0	112.5	R146 N166 K167 M173 T174	R146-E170 IonicContact CZ-OE1 2.62Å; R146-E170 IonicContact NE-OE1 3.56Å; R146-E170 PolarHBondContact NE-OE1 2.87Å; R146-E170 IonicContact NH2-OE1 3.62Å; R146-E170 PolarHBondContact NH2-OE1 2.84Å; R146-E170 IonicContact NH2-OE2 3.35Å; N166-E170 WeakPolarHBondContact O-CB 3.49Å; N166-E170 VanDerWaalsContact O-CG 3.32Å; N166-E170 WeakPolarHBondContact O-CG 3.2Å; N166-E170 PolarHBondContact O-N 2.84Å; K167-E170 PolarHBondContact O-N 2.74Å; E170-M173 HydrophobicContact CG-CE 4.29Å; E170-M173 PolarHBondContact O-N 2.84Å; E170-M173 WeakPolarHBondContact OE1-CE 3.36Å; E170-M173 WeakPolarHBondContact OE2-CE 3.33Å; E170-T174 WeakPolarHBondContact O-CB 3.48Å; E170-T174 PolarHBondContact O-N 3.29Å; E170-T174 PolarHBondContact O-OG1 3.14Å
171	A	94.2	Very high	92.2	Very high	58 Å²	58	48.9 Å²	48.9	48%	0.479	28%	0.275	S	S	.	.	H	α-helix	trans	-61.4	-48.6	175.3	0	0	0	0	0	111.6	K167 K168 V169 T174 E175	K167-A171 WeakPolarHBondContact O-CB 3.3Å; K167-A171 PolarHBondContact O-N 3.43Å; K168-A171 PolarHBondContact O-N 3.31Å; V169-A171 VanDerWaalsContact C-N 3.35Å; V169-A171 PolarHBondContact O-N 2.89Å; A171-T174 PolarHBondContact O-N 3.28Å; A171-E175 WeakPolarHBondContact O-CB 3.46Å; A171-E175 PolarHBondContact O-N 3.05Å
172	V	94.3	Very high	92.8	Very high	6 Å²	6	46 Å²	46	4%	0.036	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-39.5	178.4	173.8	0	0	0	0	111.7	K168 V169 T174 E175 L176 A205 L208 L209	K168-V172 WeakPolarHBondContact O-CG2 3.46Å; K168-V172 PolarHBondContact O-N 2.78Å; V169-V172 PolarHBondContact O-N 2.9Å; V172-T174 VanDerWaalsContact C-N 3.32Å; V172-T174 PolarHBondContact O-N 2.97Å; V172-E175 PolarHBondContact O-N 3.43Å; V172-L176 HydrophobicContact CG1-CD1 4.07Å; V172-L176 PolarHBondContact O-N 3.09Å; V172-A205 HydrophobicContact CG1-CB 3.81Å; V172-L208 HydrophobicContact CG1-CB 4.07Å; V172-L209 HydrophobicContact CB-CD2 4.31Å; V172-L209 HydrophobicContact CG2-CD2 4Å
173	M	95.5	Very high	93.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-38	175.8	-73.8	-172.1	-51.5	0	0	111.8	V145 R146 L149 V169 E170 S177 L178 A182	V145-M173 HydrophobicContact CG1-SD 4.28Å; R146-M173 HydrophobicContact CB-CE 4.33Å; R146-M173 HydrophobicContact CB-SD 4.2Å; R146-M173 HydrophobicContact CG-CE 4.3Å; L149-M173 HydrophobicContact CD1-CG 3.56Å; L149-M173 HydrophobicContact CD1-SD 4.02Å; V169-M173 HydrophobicContact CG1-CE 3.81Å; V169-M173 HydrophobicContact CG1-CG 4.35Å; V169-M173 HydrophobicContact CG1-SD 4.07Å; V169-M173 WeakPolarHBondContact O-CB 2.93Å; V169-M173 VanDerWaalsContact O-CG 3.29Å; V169-M173 WeakPolarHBondContact O-CG 3.35Å; V169-M173 PolarHBondContact O-N 3.16Å; E170-M173 HydrophobicContact CG-CE 4.29Å; E170-M173 PolarHBondContact O-N 2.84Å; E170-M173 WeakPolarHBondContact OE1-CE 3.36Å; E170-M173 WeakPolarHBondContact OE2-CE 3.33Å; M173-S177 PolarHBondContact O-N 2.86Å; M173-S177 VanDerWaalsContact O-N 3.12Å; M173-L178 HydrophobicContact CB-CB 4.26Å; M173-L178 HydrophobicContact CG-CB 4.39Å; M173-L178 PolarHBondContact O-N 3Å; M173-A182 HydrophobicContact CE-CB 3.97Å; M173-A182 HydrophobicContact SD-CB 3.79Å
174	T	94.5	Very high	93.6	Very high	86 Å²	86	48.4 Å²	48.4	53%	0.528	26%	0.257	S	S	.	.	H	α-helix	trans	-68.7	-42.7	176.3	-55.8	0	0	0	0	111.1	E170 A171 V172 L176 S177 S179	E170-T174 WeakPolarHBondContact O-CB 3.48Å; E170-T174 PolarHBondContact O-N 3.29Å; E170-T174 PolarHBondContact O-OG1 3.14Å; A171-T174 PolarHBondContact O-N 3.28Å; V172-T174 VanDerWaalsContact C-N 3.32Å; V172-T174 PolarHBondContact O-N 2.97Å; T174-L176 VanDerWaalsContact C-N 3.3Å; T174-L176 PolarHBondContact O-N 3.21Å; T174-S177 PolarHBondContact O-N 3.27Å; T174-S179 WeakPolarHBondContact CA-OG 3.38Å
175	E	91.6	Very high	93.7	Very high	43 Å²	43	50.6 Å²	50.6	20%	0.201	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-39.2	176.5	-179.8	168.2	-159.5	0	0	112.4	A171 V172 L239 R242	A171-E175 WeakPolarHBondContact O-CB 3.46Å; A171-E175 PolarHBondContact O-N 3.05Å; V172-E175 PolarHBondContact O-N 3.43Å; E175-L239 HydrophobicContact CG-CD2 4.43Å; E175-R242 WeakPolarHBondContact OE1-CD 3.4Å; E175-R242 IonicContact OE1-CZ 3.95Å; E175-R242 IonicContact OE1-NE 3.4Å; E175-R242 IonicContact OE1-NH1 2.74Å; E175-R242 PolarHBondContact OE1-NH1 3.28Å; E175-R242 IonicContact OE2-NH1 3.17Å
176	L	93.3	Very high	93.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	8.8	179.4	-62.7	173.2	0	0	0	114.1	V172 T174 L178 R201 I204 A205 L208 L235 L239	V172-L176 HydrophobicContact CG1-CD1 4.07Å; V172-L176 PolarHBondContact O-N 3.09Å; T174-L176 VanDerWaalsContact C-N 3.3Å; T174-L176 PolarHBondContact O-N 3.21Å; L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 HydrophobicContact CB-CD1 4.04Å; L176-L178 HydrophobicContact CB-CG 4.21Å; L176-L178 HydrophobicContact CD1-CD1 4.38Å; L176-L178 PolarHBondContact O-N 3.5Å; L176-R201 WeakPolarHBondContact CD1-O 3.38Å; L176-R201 WeakPolarHBondContact O-CD 3.39Å; L176-I204 HydrophobicContact CD1-CG2 4.45Å; L176-I204 HydrophobicContact CD2-CG2 4.17Å; L176-A205 HydrophobicContact CD1-CB 3.29Å; L176-L208 HydrophobicContact CD1-CD1 3.9Å; L176-L208 HydrophobicContact CD2-CD1 3.85Å; L176-L208 HydrophobicContact CG-CD1 4.06Å; L176-L235 HydrophobicContact CB-CD2 4.48Å; L176-L235 HydrophobicContact CD2-CD1 3.95Å; L176-L235 HydrophobicContact CD2-CD2 3.46Å; L176-L235 VanDerWaalsContact CD2-CD2 3.46Å; L176-L235 HydrophobicContact CD2-CG 3.79Å; L176-L239 HydrophobicContact CD2-CD1 4.31Å
177	S	92.4	Very high	93.8	Very high	70 Å²	70	48 Å²	48	49%	0.49	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	48.9	-177.5	-56.2	0	0	0	0	112.9	M173 T174 H180	M173-S177 PolarHBondContact O-N 2.86Å; M173-S177 VanDerWaalsContact O-N 3.12Å; T174-S177 PolarHBondContact O-N 3.27Å; S177-H180 PolarHBondContact O-CE1 3.14Å; S177-H180 PolarHBondContact O-ND1 2.96Å
178	L	94.3	Very high	93.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.239	C	C	.	.			trans	-107.8	-0.6	177.5	-74	172.5	0	0	0	112.9	M173 L176 H180 V181 A182 E198 R201 V202 A205	M173-L178 HydrophobicContact CB-CB 4.26Å; M173-L178 HydrophobicContact CG-CB 4.39Å; M173-L178 PolarHBondContact O-N 3Å; L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 HydrophobicContact CB-CD1 4.04Å; L176-L178 HydrophobicContact CB-CG 4.21Å; L176-L178 HydrophobicContact CD1-CD1 4.38Å; L176-L178 PolarHBondContact O-N 3.5Å; L178-H180 PolarHBondContact O-N 2.93Å; L178-V181 HydrophobicContact CB-CG2 4.43Å; L178-V181 HydrophobicContact CD2-CG2 3.86Å; L178-V181 WeakPolarHBondContact O-CG2 3.37Å; L178-V181 PolarHBondContact O-N 3.19Å; L178-V181 VanDerWaalsContact O-N 3.09Å; L178-A182 PolarHBondContact O-N 3.17Å; L178-A182 VanDerWaalsContact O-N 3.16Å; L178-E198 HydrophobicContact CD2-CB 4.32Å; L178-R201 HydrophobicContact CD1-CB 3.98Å; L178-R201 HydrophobicContact CD2-CB 3.92Å; L178-R201 HydrophobicContact CG-CB 4.1Å; L178-V202 HydrophobicContact CD1-CG2 3.86Å; L178-V202 HydrophobicContact CD2-CG2 4.13Å; L178-A205 HydrophobicContact CD1-CB 4.2Å
179	S	93.5	Very high	92.6	Very high	56 Å²	56	49.2 Å²	49.2	39%	0.392	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-59.3	-32.1	-174.5	-40.4	0	0	0	0	112.9	T174 V181 A182	T174-S179 WeakPolarHBondContact CA-OG 3.38Å; S179-V181 VanDerWaalsContact C-N 3.33Å; S179-V181 PolarHBondContact O-N 3Å; S179-A182 WeakPolarHBondContact O-CB 3.35Å
180	H	94.7	Very high	91.8	Very high	119 Å²	119	56 Å²	56	55%	0.551	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-71.2	-24.6	179.1	65.4	-65.3	0	0	0	113.6	S177 L178 E198	S177-H180 PolarHBondContact O-CE1 3.14Å; S177-H180 PolarHBondContact O-ND1 2.96Å; L178-H180 PolarHBondContact O-N 2.93Å; H180-E198 IonicContact CD2-OE1 3.95Å; H180-E198 IonicContact CE1-OE1 3.42Å; H180-E198 IonicContact NE2-OE1 3.51Å; H180-E198 PolarHBondContact NE2-OE1 3.06Å
181	V	94.9	Very high	90.7	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.018	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-108.7	8.8	178.2	-72.6	0	0	0	0	113.5	L178 S179 D183 Q184 I194	L178-V181 HydrophobicContact CB-CG2 4.43Å; L178-V181 HydrophobicContact CD2-CG2 3.86Å; L178-V181 WeakPolarHBondContact O-CG2 3.37Å; L178-V181 PolarHBondContact O-N 3.19Å; L178-V181 VanDerWaalsContact O-N 3.09Å; S179-V181 VanDerWaalsContact C-N 3.33Å; S179-V181 PolarHBondContact O-N 3Å; V181-D183 VanDerWaalsContact C-N 3.28Å; V181-D183 PolarHBondContact O-N 3Å; V181-D183 VanDerWaalsContact O-N 3.14Å; V181-Q184 PolarHBondContact O-N 3.28Å; V181-I194 HydrophobicContact CB-CG2 4.24Å
182	A	94.7	Very high	90.2	Very high	2 Å²	2	60.2 Å²	60.2	2%	0.017	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-40	-172	0	0	0	0	0	113.9	R146 M173 L178 S179	R146-A182 HydrophobicContact CB-CB 4.49Å; R146-A182 VanDerWaalsContact CB-O 3.24Å; R146-A182 WeakPolarHBondContact CB-O 3.31Å; R146-A182 PolarHBondContact N-O 3.43Å; M173-A182 HydrophobicContact CE-CB 3.97Å; M173-A182 HydrophobicContact SD-CB 3.79Å; L178-A182 PolarHBondContact O-N 3.17Å; L178-A182 VanDerWaalsContact O-N 3.16Å; S179-A182 WeakPolarHBondContact O-CB 3.35Å
183	D	94.8	Very high	89.9	Confident	107 Å²	107	62 Å²	62	57%	0.572	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	4	-178.9	-69.5	-49.4	0	0	0	114.8	T144 R146 V181	T144-D183 VanDerWaalsContact CG2-O 3.26Å; T144-D183 WeakPolarHBondContact CG2-O 3.45Å; R146-D183 IonicContact CZ-OD1 3.11Å; R146-D183 IonicContact CZ-OD2 2.87Å; R146-D183 IonicContact NH1-OD1 3.98Å; R146-D183 PolarHBondContact NH1-OD1 3.35Å; R146-D183 IonicContact NH1-OD2 3.96Å; R146-D183 PolarHBondContact NH1-OD2 3.11Å; R146-D183 IonicContact NH2-OD2 2.65Å; V181-D183 VanDerWaalsContact C-N 3.28Å; V181-D183 PolarHBondContact O-N 3Å; V181-D183 VanDerWaalsContact O-N 3.14Å
184	Q	94	Very high	89.8	Confident	101 Å²	101	63 Å²	63	47%	0.472	35%	0.354	S	S	.	.	S	Bend	trans	-81.2	149.2	175.2	-62.6	-169.6	5.9	0	0	110.8	T144 V145 V181 I194	T144-Q184 WeakPolarHBondContact CA-O 3.16Å; T144-Q184 WeakPolarHBondContact CB-O 3.41Å; V145-Q184 PolarHBondContact N-O 2.83Å; V181-Q184 PolarHBondContact O-N 3.28Å; Q184-I194 HydrophobicContact CB-CG2 4.4Å
185	M	93.2	Very high	89.6	Confident	104 Å²	104	61.6 Å²	61.6	51%	0.512	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-68.3	136.1	174.8	-64.6	-174	-174.7	0	0	109.8	G187 G193	M185-G187 PolarHBondContact O-N 3.13Å; M185-G193 WeakPolarHBondContact O-CA 3.31Å
186	I	93.7	Very high	89.5	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.015	35%	0.352	C	S	.	.			trans	-61.4	-38.7	177.9	-65.7	175.8	0	0	0	110.5	F139 L143 V145 T148 I194 V202	F139-I186 HydrophobicContact CB-CD1 4.12Å; F139-I186 HydrophobicContact CB-CG2 4.01Å; F139-I186 HydrophobicContact CD2-CG2 4.27Å; F139-I186 HydrophobicContact CG-CD1 4.26Å; F139-I186 HydrophobicContact CG-CG2 4.46Å; L143-I186 PolarHBondContact O-N 2.74Å; V145-I186 HydrophobicContact CG2-CG1 4.02Å; T148-I186 HydrophobicContact CG2-CD1 4.01Å; T148-I186 WeakPolarHBondContact OG1-CD1 3.46Å; I186-I194 HydrophobicContact CB-CD1 4.4Å; I186-I194 HydrophobicContact CG1-CD1 4.29Å; I186-I194 HydrophobicContact CG2-CD1 4.05Å; I186-I194 HydrophobicContact CG2-CG1 4.37Å; I186-I194 PolarHBondContact O-N 3.05Å; I186-V202 HydrophobicContact CD1-CG1 4.49Å
187	G	89.5	Confident	89.3	Confident	5 Å²	5	61.6 Å²	61.6	5%	0.052	35%	0.353	C	S	.	.			trans	69.5	-167.5	179.5	0	0	0	0	0	113.5	S141 M185	S141-G187 WeakPolarHBondContact CA-O 3.44Å; S141-G187 VanDerWaalsContact CB-C 3.5Å; S141-G187 WeakPolarHBondContact CB-O 3.33Å; S141-G187 WeakPolarHBondContact O-CA 3.14Å; S141-G187 PolarHBondContact O-N 2.85Å; M185-G187 PolarHBondContact O-N 3.13Å
188	S	83.9	Confident	89.3	Confident	40 Å²	40	60.1 Å²	60.1	28%	0.28	34%	0.338	S	S	.	.			trans	-130.9	167.7	174.5	-175.1	0	0	0	0	108.7	N190 F191	S188-N190 PolarHBondContact O-N 3.42Å; S188-F191 CarbonylContact C-O 3.51Å; S188-F191 PolarHBondContact N-O 2.8Å; S188-F191 CarbonylContact O-C 3.19Å; S188-F191 VanDerWaalsContact O-C 3.3Å; S188-F191 PolarHBondContact O-N 3.47Å
189	Y	76.2	Confident	89.3	Confident	166 Å²	166	61.2 Å²	61.2	65%	0.651	34%	0.342	S	S	*	.	S	Bend	trans	-60.3	-32	175.8	-65.6	-78.5	0	0	0	112.3
190	N	78.3	Confident	89.2	Confident	145 Å²	145	59.2 Å²	59.2	78%	0.775	33%	0.326	S	S	*	.	S	Bend	trans	-89.5	-23.7	179.8	-61.7	-8.5	0	0	0	113.7	S188	S188-N190 PolarHBondContact O-N 3.42Å
191	F	73.8	Confident	89.2	Confident	135 Å²	135	55.1 Å²	55.1	59%	0.592	31%	0.306	S	S	*	.	S	Bend	trans	-121.6	105.2	-177.9	-64.7	-78	0	0	0	106.1	S188	S188-F191 CarbonylContact C-O 3.51Å; S188-F191 PolarHBondContact N-O 2.8Å; S188-F191 CarbonylContact O-C 3.19Å; S188-F191 VanDerWaalsContact O-C 3.3Å; S188-F191 PolarHBondContact O-N 3.47Å
192	G	82.5	Confident	89.2	Confident	73 Å²	73	55 Å²	55	75%	0.753	31%	0.305	S	S	*	.			trans	-42.5	159.9	-168.3	0	0	0	0	0	116.1
193	G	89.5	Confident	89.2	Confident	44 Å²	44	55.1 Å²	55.1	45%	0.454	31%	0.306	S	S	.	.			trans	178.5	-144.7	-175.1	0	0	0	0	0	109.8	M185	M185-G193 WeakPolarHBondContact O-CA 3.31Å
194	I	92.9	Very high	89.2	Confident	20 Å²	20	50 Å²	50	10%	0.103	28%	0.278	C	S	.	.	S	Bend	trans	-70.1	157.9	177.4	65.2	-179.6	0	0	0	111.9	V145 V181 Q184 I186 E198 R199 V202	V145-I194 HydrophobicContact CG2-CD1 4.07Å; V145-I194 HydrophobicContact CG2-CG2 4.08Å; V181-I194 HydrophobicContact CB-CG2 4.24Å; Q184-I194 HydrophobicContact CB-CG2 4.4Å; I186-I194 HydrophobicContact CB-CD1 4.4Å; I186-I194 HydrophobicContact CG1-CD1 4.29Å; I186-I194 HydrophobicContact CG2-CD1 4.05Å; I186-I194 HydrophobicContact CG2-CG1 4.37Å; I186-I194 PolarHBondContact O-N 3.05Å; I194-E198 HydrophobicContact CB-CB 4.17Å; I194-E198 HydrophobicContact CD1-CB 4.49Å; I194-R199 HydrophobicContact CD1-CB 3.88Å; I194-R199 HydrophobicContact CD1-CG 4.49Å; I194-R199 HydrophobicContact CG1-CB 4.06Å; I194-V202 HydrophobicContact CD1-CG2 3.99Å
195	S	90.6	Very high	89.2	Confident	57 Å²	57	45.2 Å²	45.2	40%	0.399	26%	0.256	S	S	.	.			trans	-61.3	155.1	175.6	174.7	0	0	0	0	111.7	G197 E198 R199	S195-G197 VanDerWaalsContact C-N 3.26Å; S195-G197 PolarHBondContact O-N 3.4Å; S195-E198 WeakPolarHBondContact CB-OE2 2.96Å; S195-E198 PolarHBondContact N-OE2 3.18Å; S195-E198 PolarHBondContact O-N 2.77Å; S195-R199 WeakPolarHBondContact O-CB 3.43Å; S195-R199 PolarHBondContact O-N 3.1Å
196	S	88.5	Confident	89.2	Confident	42 Å²	42	40.8 Å²	40.8	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-57.9	-38.6	176.3	54.4	0	0	0	0	112.3	R199 R200	S196-R199 PolarHBondContact O-N 2.77Å; S196-R200 PolarHBondContact O-N 3.49Å
197	G	90.3	Very high	89.2	Confident	2 Å²	2	41 Å²	41	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-44.3	174.4	0	0	0	0	0	113.7	S195 R199 R200 R201	S195-G197 VanDerWaalsContact C-N 3.26Å; S195-G197 PolarHBondContact O-N 3.4Å; G197-R199 VanDerWaalsContact C-N 3.34Å; G197-R200 WeakPolarHBondContact O-CB 3.49Å; G197-R200 PolarHBondContact O-N 3.45Å; G197-R201 WeakPolarHBondContact O-CG 3.1Å; G197-R201 PolarHBondContact O-N 3.16Å
198	E	92.4	Very high	89.3	Confident	38 Å²	38	40.8 Å²	40.8	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-41.5	176.8	-66.4	173	150	0	0	110.6	L178 H180 I194 S195 R200 R201 V202	L178-E198 HydrophobicContact CD2-CB 4.32Å; H180-E198 IonicContact CD2-OE1 3.95Å; H180-E198 IonicContact CE1-OE1 3.42Å; H180-E198 IonicContact NE2-OE1 3.51Å; H180-E198 PolarHBondContact NE2-OE1 3.06Å; I194-E198 HydrophobicContact CB-CB 4.17Å; I194-E198 HydrophobicContact CD1-CB 4.49Å; S195-E198 WeakPolarHBondContact CB-OE2 2.96Å; S195-E198 PolarHBondContact N-OE2 3.18Å; S195-E198 PolarHBondContact O-N 2.77Å; E198-R200 VanDerWaalsContact C-N 3.29Å; E198-R200 PolarHBondContact O-N 3.47Å; E198-R201 WeakPolarHBondContact O-CB 3.32Å; E198-R201 PolarHBondContact O-N 2.76Å; E198-R201 VanDerWaalsContact O-N 3.1Å; E198-V202 WeakPolarHBondContact O-CG2 3.49Å; E198-V202 PolarHBondContact O-N 3.2Å
199	R	93.1	Very high	89.7	Confident	24 Å²	24	38.9 Å²	38.9	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-42.1	173.3	-176.1	177.4	176.5	153.1	-3	112	D137 F139 I194 S195 S196 G197 V202 S203	D137-R199 HydrophobicContact CB-CG 4.43Å; D137-R199 PolarHBondContact O-NE 3.16Å; D137-R199 PolarHBondContact O-NH2 2.93Å; F139-R199 HydrophobicContact CD2-CG 4.04Å; F139-R199 HydrophobicContact CE2-CG 4.05Å; I194-R199 HydrophobicContact CD1-CB 3.88Å; I194-R199 HydrophobicContact CD1-CG 4.49Å; I194-R199 HydrophobicContact CG1-CB 4.06Å; S195-R199 WeakPolarHBondContact O-CB 3.43Å; S195-R199 PolarHBondContact O-N 3.1Å; S196-R199 PolarHBondContact O-N 2.77Å; G197-R199 VanDerWaalsContact C-N 3.34Å; R199-V202 WeakPolarHBondContact O-CB 3.39Å; R199-V202 PolarHBondContact O-N 2.93Å; R199-S203 PolarHBondContact O-N 3.47Å; R199-S203 VanDerWaalsContact O-N 3.13Å
200	R	92.7	Very high	90.1	Very high	13 Å²	13	31.8 Å²	31.8	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-43.4	174.5	-175.1	65.4	73	-177.7	11.1	111.5	L134 Q135 D137 S196 G197 E198 V202 S203 I204 P220 I232	L134-R200 PolarHBondContact O-NH1 3.41Å; Q135-R200 VanDerWaalsContact O-CZ 3.31Å; Q135-R200 PolarHBondContact O-NH1 2.98Å; Q135-R200 PolarHBondContact O-NH2 3.15Å; D137-R200 VanDerWaalsContact CG-NH1 3.26Å; D137-R200 IonicContact OD1-CZ 3.74Å; D137-R200 IonicContact OD1-NH1 2.7Å; D137-R200 PolarHBondContact OD1-NH1 2.88Å; D137-R200 WeakPolarHBondContact OD2-CA 3.24Å; D137-R200 WeakPolarHBondContact OD2-CD 3.43Å; D137-R200 IonicContact OD2-CZ 2.74Å; D137-R200 IonicContact OD2-NE 2.61Å; D137-R200 PolarHBondContact OD2-NE 3.16Å; D137-R200 IonicContact OD2-NH1 2.78Å; D137-R200 PolarHBondContact OD2-NH1 2.84Å; D137-R200 VanDerWaalsContact OD2-NH1 3.13Å; S196-R200 PolarHBondContact O-N 3.49Å; G197-R200 WeakPolarHBondContact O-CB 3.49Å; G197-R200 PolarHBondContact O-N 3.45Å; E198-R200 VanDerWaalsContact C-N 3.29Å; E198-R200 PolarHBondContact O-N 3.47Å; R200-V202 VanDerWaalsContact C-N 3.29Å; R200-V202 PolarHBondContact O-N 2.84Å; R200-S203 VanDerWaalsContact O-CB 3.28Å; R200-S203 WeakPolarHBondContact O-CB 3.46Å; R200-S203 PolarHBondContact O-N 3.31Å; R200-S203 VanDerWaalsContact O-N 3.09Å; R200-I204 PolarHBondContact O-N 2.96Å; R200-I204 VanDerWaalsContact O-N 3.12Å; R200-P220 PolarHBondContact NE-O 3.23Å; R200-I232 HydrophobicContact CB-CD1 4.48Å; R200-I232 HydrophobicContact CG-CD1 4.36Å
201	R	93.9	Very high	90.5	Very high	34 Å²	34	29 Å²	29	13%	0.128	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-37.7	174.2	-65.6	-178	-167.8	172.7	5.2	111.9	L176 L178 G197 E198 S203 I204 A205 I232 L235	L176-R201 WeakPolarHBondContact CD1-O 3.38Å; L176-R201 WeakPolarHBondContact O-CD 3.39Å; L178-R201 HydrophobicContact CD1-CB 3.98Å; L178-R201 HydrophobicContact CD2-CB 3.92Å; L178-R201 HydrophobicContact CG-CB 4.1Å; G197-R201 WeakPolarHBondContact O-CG 3.1Å; G197-R201 PolarHBondContact O-N 3.16Å; E198-R201 WeakPolarHBondContact O-CB 3.32Å; E198-R201 PolarHBondContact O-N 2.76Å; E198-R201 VanDerWaalsContact O-N 3.1Å; R201-S203 VanDerWaalsContact C-N 3.3Å; R201-S203 PolarHBondContact O-N 3.24Å; R201-I204 PolarHBondContact O-N 3.19Å; R201-A205 WeakPolarHBondContact O-CB 3.4Å; R201-A205 PolarHBondContact O-N 2.91Å; R201-I232 HydrophobicContact CG-CD1 3.44Å; R201-I232 VanDerWaalsContact CG-CD1 3.44Å; R201-L235 HydrophobicContact CG-CD2 4.02Å
202	V	95.3	Very high	91.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-34.9	174.7	176.8	0	0	0	0	112.2	F139 V145 L149 L178 I186 I194 E198 R199 R200 A205 A206	F139-V202 HydrophobicContact CE1-CG1 4.3Å; F139-V202 HydrophobicContact CE2-CB 4.42Å; F139-V202 HydrophobicContact CE2-CG1 4.2Å; F139-V202 HydrophobicContact CZ-CB 4.43Å; F139-V202 HydrophobicContact CZ-CG1 3.94Å; V145-V202 HydrophobicContact CB-CG2 4.39Å; V145-V202 HydrophobicContact CG1-CG1 4.4Å; V145-V202 HydrophobicContact CG1-CG2 3.6Å; V145-V202 HydrophobicContact CG2-CG2 3.95Å; L149-V202 HydrophobicContact CD2-CG1 4.42Å; L178-V202 HydrophobicContact CD1-CG2 3.86Å; L178-V202 HydrophobicContact CD2-CG2 4.13Å; I186-V202 HydrophobicContact CD1-CG1 4.49Å; I194-V202 HydrophobicContact CD1-CG2 3.99Å; E198-V202 WeakPolarHBondContact O-CG2 3.49Å; E198-V202 PolarHBondContact O-N 3.2Å; R199-V202 WeakPolarHBondContact O-CB 3.39Å; R199-V202 PolarHBondContact O-N 2.93Å; R200-V202 VanDerWaalsContact C-N 3.29Å; R200-V202 PolarHBondContact O-N 2.84Å; V202-A205 WeakPolarHBondContact O-CB 3.43Å; V202-A205 PolarHBondContact O-N 2.99Å; V202-A206 PolarHBondContact O-N 3.49Å
203	S	93.9	Very high	91.5	Very high	4 Å²	4	22.2 Å²	22.2	3%	0.028	13%	0.129	C	C	.	.	H	α-helix	trans	-64.2	-45.5	173.5	-160.9	0	0	0	0	112.2	D137 R199 R200 R201 A205 A206 Q207	D137-S203 VanDerWaalsContact CG-CB 3.47Å; D137-S203 WeakPolarHBondContact OD1-CB 3.42Å; D137-S203 PolarHBondContact OD1-OG 2.93Å; R199-S203 PolarHBondContact O-N 3.47Å; R199-S203 VanDerWaalsContact O-N 3.13Å; R200-S203 VanDerWaalsContact O-CB 3.28Å; R200-S203 WeakPolarHBondContact O-CB 3.46Å; R200-S203 PolarHBondContact O-N 3.31Å; R200-S203 VanDerWaalsContact O-N 3.09Å; R201-S203 VanDerWaalsContact C-N 3.3Å; R201-S203 PolarHBondContact O-N 3.24Å; S203-A205 VanDerWaalsContact C-N 3.3Å; S203-A205 PolarHBondContact O-N 2.84Å; S203-A206 PolarHBondContact O-N 3.23Å; S203-Q207 PolarHBondContact O-N 3.17Å
204	I	94.5	Very high	91.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-42.3	173.6	-59.5	170.3	0	0	0	109.9	V133 L176 R200 R201 A206 Q207 L208 M215 L217 I232 L236 L239	V133-I204 HydrophobicContact CG2-CG1 4.44Å; L176-I204 HydrophobicContact CD1-CG2 4.45Å; L176-I204 HydrophobicContact CD2-CG2 4.17Å; R200-I204 PolarHBondContact O-N 2.96Å; R200-I204 VanDerWaalsContact O-N 3.12Å; R201-I204 PolarHBondContact O-N 3.19Å; I204-A206 PolarHBondContact O-N 3.4Å; I204-Q207 PolarHBondContact O-N 3.43Å; I204-L208 HydrophobicContact CG2-CD1 4.08Å; I204-L208 HydrophobicContact CG2-CG 4.3Å; I204-L208 WeakPolarHBondContact O-CG 3.35Å; I204-L208 PolarHBondContact O-N 3.17Å; I204-M215 HydrophobicContact CG2-CE 4.07Å; I204-L217 HydrophobicContact CD1-CD2 4.09Å; I204-L217 HydrophobicContact CG1-CD2 3.92Å; I204-I232 HydrophobicContact CD1-CG2 4.37Å; I204-L236 HydrophobicContact CD1-CD2 4.22Å; I204-L239 HydrophobicContact CG2-CD1 3.9Å
205	A	95.2	Very high	91.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.5	-45.5	178.1	0	0	0	0	0	112.3	L149 V172 L176 L178 R201 V202 S203 Q207 L208 L209	L149-A205 HydrophobicContact CD1-CB 3.96Å; L149-A205 HydrophobicContact CD2-CB 3.62Å; L149-A205 HydrophobicContact CG-CB 4.46Å; V172-A205 HydrophobicContact CG1-CB 3.81Å; L176-A205 HydrophobicContact CD1-CB 3.29Å; L178-A205 HydrophobicContact CD1-CB 4.2Å; R201-A205 WeakPolarHBondContact O-CB 3.4Å; R201-A205 PolarHBondContact O-N 2.91Å; V202-A205 WeakPolarHBondContact O-CB 3.43Å; V202-A205 PolarHBondContact O-N 2.99Å; S203-A205 VanDerWaalsContact C-N 3.3Å; S203-A205 PolarHBondContact O-N 2.84Å; A205-Q207 PolarHBondContact O-N 2.84Å; A205-L208 PolarHBondContact O-N 3.47Å; A205-L208 VanDerWaalsContact O-N 3.15Å; A205-L209 WeakPolarHBondContact O-CG 3.04Å; A205-L209 PolarHBondContact O-N 3.41Å; A205-L209 VanDerWaalsContact O-N 3.13Å
206	A	93.6	Very high	91.9	Very high	12 Å²	12	16.5 Å²	16.5	10%	0.099	8%	0.084	C	C	.	.	H	α-helix	trans	-58.2	-36.9	-179.7	0	0	0	0	0	112	L149 V202 S203 I204	L149-A206 HydrophobicContact CD2-CB 4.19Å; V202-A206 PolarHBondContact O-N 3.49Å; S203-A206 PolarHBondContact O-N 3.23Å; I204-A206 PolarHBondContact O-N 3.4Å
207	Q	92.2	Very high	92.2	Very high	7 Å²	7	14.5 Å²	14.5	3%	0.033	7%	0.07	C	C	.	.	H	α-helix	trans	-77.1	-36.5	176.8	-70.7	-42.8	-40.7	0	0	113.2	S131 Y132 V133 S203 I204 A205 L209 Q210 P212 D456	S131-Q207 VanDerWaalsContact OG-CB 3.28Å; S131-Q207 WeakPolarHBondContact OG-CB 3.19Å; S131-Q207 PolarHBondContact OG-OE1 3.15Å; S131-Q207 VanDerWaalsContact OG-OE1 3.1Å; Y132-Q207 WeakPolarHBondContact O-CG 3.38Å; V133-Q207 HydrophobicContact CG2-CB 4.31Å; V133-Q207 HydrophobicContact CG2-CG 3.82Å; S203-Q207 PolarHBondContact O-N 3.17Å; I204-Q207 PolarHBondContact O-N 3.43Å; A205-Q207 PolarHBondContact O-N 2.84Å; Q207-L209 VanDerWaalsContact C-N 3.26Å; Q207-L209 PolarHBondContact O-N 2.83Å; Q207-Q210 PolarHBondContact O-N 2.76Å; Q207-P212 WeakPolarHBondContact O-CD 3.39Å; Q207-D456 PolarHBondContact NE2-OD2 2.78Å
208	L	92.7	Very high	92.4	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-65.9	-25.8	176.5	-75.3	178.4	0	0	0	113.5	V172 L176 I204 A205 Q210 D211 M215 L239	V172-L208 HydrophobicContact CG1-CB 4.07Å; L176-L208 HydrophobicContact CD1-CD1 3.9Å; L176-L208 HydrophobicContact CD2-CD1 3.85Å; L176-L208 HydrophobicContact CG-CD1 4.06Å; I204-L208 HydrophobicContact CG2-CD1 4.08Å; I204-L208 HydrophobicContact CG2-CG 4.3Å; I204-L208 WeakPolarHBondContact O-CG 3.35Å; I204-L208 PolarHBondContact O-N 3.17Å; A205-L208 PolarHBondContact O-N 3.47Å; A205-L208 VanDerWaalsContact O-N 3.15Å; L208-Q210 PolarHBondContact O-N 3.02Å; L208-D211 PolarHBondContact O-N 3.15Å; L208-M215 HydrophobicContact CD2-CE 3.81Å; L208-M215 HydrophobicContact CD2-SD 3.45Å; L208-M215 WeakPolarHBondContact CD2-SD 3.31Å; L208-M215 HydrophobicContact CG-CE 4.09Å; L208-M215 HydrophobicContact CG-SD 4.38Å; L208-L239 HydrophobicContact CD1-CD1 3.98Å; L208-L239 HydrophobicContact CD1-CD2 3.67Å; L208-L239 HydrophobicContact CD2-CD1 4.44Å; L208-L239 HydrophobicContact CD2-CD2 4.06Å
209	L	90.9	Very high	92.4	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.5	176.5	-72.1	167.3	0	0	0	113.8	L149 T152 A153 K168 V169 V172 A205 Q207 D211	L149-L209 HydrophobicContact CB-CD1 4.08Å; L149-L209 HydrophobicContact CD2-CD1 3.89Å; L149-L209 VanDerWaalsContact O-CD1 3.25Å; L149-L209 WeakPolarHBondContact O-CD1 3.31Å; T152-L209 WeakPolarHBondContact OG1-CD1 3.14Å; A153-L209 HydrophobicContact CB-CD1 4.1Å; A153-L209 HydrophobicContact CB-CD2 4.21Å; K168-L209 WeakPolarHBondContact CE-O 3.34Å; K168-L209 HydrophobicContact CG-CD2 4.44Å; K168-L209 PolarHBondContact NZ-O 2.83Å; V169-L209 HydrophobicContact CG2-CD2 3.88Å; V172-L209 HydrophobicContact CB-CD2 4.31Å; V172-L209 HydrophobicContact CG2-CD2 4Å; A205-L209 WeakPolarHBondContact O-CG 3.04Å; A205-L209 PolarHBondContact O-N 3.41Å; A205-L209 VanDerWaalsContact O-N 3.13Å; Q207-L209 VanDerWaalsContact C-N 3.26Å; Q207-L209 PolarHBondContact O-N 2.83Å; L209-D211 VanDerWaalsContact C-N 3.32Å
210	Q	86	Confident	92.3	Very high	17 Å²	17	12.8 Å²	12.8	8%	0.079	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	10.6	176.3	-38.4	-173	4.6	0	0	112.2	A156 Q207 L208 P212 K358	A156-Q210 HydrophobicContact CB-CG 3.96Å; Q207-Q210 PolarHBondContact O-N 2.76Å; L208-Q210 PolarHBondContact O-N 3.02Å; Q210-P212 VanDerWaalsContact C-CD 3.49Å; Q210-K358 HydrophobicContact CB-CD 3.99Å; Q210-K358 HydrophobicContact CB-CG 3.45Å; Q210-K358 VanDerWaalsContact CB-CG 3.45Å; Q210-K358 HydrophobicContact CG-CG 4.46Å; Q210-K358 CarbonylContact O-C 3.49Å; Q210-K358 WeakPolarHBondContact O-CG 3.39Å
211	D	85.9	Confident	92.2	Very high	86 Å²	86	13.1 Å²	13.1	46%	0.46	7%	0.066	S	C	.	.			trans	45.5	51.1	-178.6	-61.4	-38	0	0	0	115.6	K168 L208 L209	K168-D211 WeakPolarHBondContact CE-OD2 3.29Å; K168-D211 IonicContact NZ-OD1 2.74Å; K168-D211 IonicContact NZ-OD2 3.95Å; K168-D211 PolarHBondContact NZ-OD2 2.82Å; L208-D211 PolarHBondContact O-N 3.15Å; L209-D211 VanDerWaalsContact C-N 3.32Å
212	P	89.3	Confident	91.9	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.006	7%	0.071	C	C	.	.			trans	-72.2	137.2	-176.8	30.7	-35.9	0	0	0	112.8	S131 Q207 Q210 M215 R244 K358	S131-P212 VanDerWaalsContact CB-CB 3.45Å; Q207-P212 WeakPolarHBondContact O-CD 3.39Å; Q210-P212 VanDerWaalsContact C-CD 3.49Å; P212-M215 HydrophobicContact CB-CG 4.32Å; P212-M215 HydrophobicContact CG-CG 3.82Å; P212-M215 HydrophobicContact CG-SD 4.17Å; P212-R244 PolarHBondContact O-NH1 3.36Å; P212-K358 HydrophobicContact CB-CD 4.33Å; P212-K358 HydrophobicContact CB-CG 4.15Å
213	K	88.2	Confident	91.4	Very high	64 Å²	64	17.1 Å²	17.1	28%	0.278	11%	0.11	S	C	.	.	S	Bend	trans	-81.4	-23.3	171.2	-68.2	-64.6	-170.5	168.7	0	113.2	D243 R244 I245 P356	K213-D243 WeakPolarHBondContact CD-O 3.34Å; K213-D243 PolarHBondContact NZ-O 3.19Å; K213-D243 IonicContact NZ-OD2 3.65Å; K213-D243 PolarHBondContact NZ-OD2 3.27Å; K213-R244 CarbonylContact O-C 3.58Å; K213-R244 WeakPolarHBondContact O-CA 3.43Å; K213-I245 PolarHBondContact O-N 3.31Å; K213-P356 HydrophobicContact CB-CB 3.93Å; K213-P356 HydrophobicContact CB-CG 4.16Å; K213-P356 HydrophobicContact CG-CB 3.91Å
214	V	92.3	Very high	91.1	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.006	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.3	176	-168.8	0	0	0	0	110.4	L39 F130 S131 I245	L39-V214 HydrophobicContact CD2-CG1 4.13Å; F130-V214 HydrophobicContact CD1-CB 3.81Å; F130-V214 HydrophobicContact CD1-CG1 3.53Å; F130-V214 HydrophobicContact CE1-CB 4.14Å; F130-V214 HydrophobicContact CE1-CG1 3.65Å; S131-V214 PolarHBondContact N-O 3.49Å; V214-I245 WeakPolarHBondContact CA-O 3.25Å; V214-I245 HydrophobicContact CB-CB 4.4Å; V214-I245 HydrophobicContact CG1-CB 4.05Å; V214-I245 HydrophobicContact CG1-CG2 3.94Å; V214-I245 HydrophobicContact CG2-CB 4.19Å; V214-I245 HydrophobicContact CG2-CD1 4.19Å
215	M	94	Very high	90.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.5	179.7	-63	-174.7	67.9	0	0	110.6	I204 L208 P212 L217 I245 V246 I247	I204-M215 HydrophobicContact CG2-CE 4.07Å; L208-M215 HydrophobicContact CD2-CE 3.81Å; L208-M215 HydrophobicContact CD2-SD 3.45Å; L208-M215 WeakPolarHBondContact CD2-SD 3.31Å; L208-M215 HydrophobicContact CG-CE 4.09Å; L208-M215 HydrophobicContact CG-SD 4.38Å; P212-M215 HydrophobicContact CB-CG 4.32Å; P212-M215 HydrophobicContact CG-CG 3.82Å; P212-M215 HydrophobicContact CG-SD 4.17Å; M215-L217 HydrophobicContact CB-CD1 4.25Å; M215-I245 PolarHBondContact N-O 2.76Å; M215-V246 WeakPolarHBondContact O-CA 3.41Å; M215-I247 PolarHBondContact O-N 2.73Å
216	M	94.7	Very high	90.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.7	171.1	-76.2	178	-78.1	0	0	109.2	L97 I100 F130 S131 Y132 V133 I247	L97-M216 HydrophobicContact CD2-CB 4.23Å; L97-M216 HydrophobicContact CD2-CG 3.97Å; L97-M216 HydrophobicContact CD2-SD 4.01Å; I100-M216 HydrophobicContact CB-SD 4.01Å; I100-M216 HydrophobicContact CG2-CE 4.31Å; I100-M216 HydrophobicContact CG2-SD 3.82Å; F130-M216 HydrophobicContact CB-CE 3.43Å; F130-M216 VanDerWaalsContact CB-CE 3.43Å; F130-M216 HydrophobicContact CD1-CE 3.32Å; F130-M216 HydrophobicContact CD2-CE 4.1Å; F130-M216 HydrophobicContact CE1-CE 4.04Å; F130-M216 HydrophobicContact CG-CE 3.35Å; S131-M216 PolarHBondContact O-N 2.94Å; Y132-M216 CarbonylContact C-O 3.55Å; Y132-M216 WeakPolarHBondContact CA-O 3.28Å; Y132-M216 HydrophobicContact CD2-CB 4.09Å; V133-M216 PolarHBondContact N-O 3.34Å; M216-I247 CarbonylContact C-O 3.6Å; M216-I247 WeakPolarHBondContact CA-O 3.36Å; M216-I247 HydrophobicContact CG-CB 4.14Å; M216-I247 HydrophobicContact CG-CD1 4.3Å
217	L	95.4	Very high	90.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	118.9	179.3	-60.4	97.2	0	0	0	109.6	V133 I204 M215 P220 L236 V246 I247 V248 T249	V133-L217 HydrophobicContact CB-CB 4.25Å; V133-L217 HydrophobicContact CB-CD2 3.95Å; V133-L217 HydrophobicContact CB-CG 3.89Å; V133-L217 HydrophobicContact CG1-CD2 4.27Å; V133-L217 HydrophobicContact CG2-CD2 3.88Å; V133-L217 HydrophobicContact CG2-CG 3.96Å; I204-L217 HydrophobicContact CD1-CD2 4.09Å; I204-L217 HydrophobicContact CG1-CD2 3.92Å; M215-L217 HydrophobicContact CB-CD1 4.25Å; L217-P220 HydrophobicContact CB-CB 4.32Å; L217-P220 HydrophobicContact CB-CG 4.03Å; L217-P220 HydrophobicContact CD2-CB 4.32Å; L217-L236 HydrophobicContact CD1-CD2 3.8Å; L217-L236 HydrophobicContact CD2-CD1 4.22Å; L217-L236 HydrophobicContact CD2-CD2 3.51Å; L217-L236 HydrophobicContact CG-CD2 4.32Å; L217-V246 HydrophobicContact CD1-CG1 3.72Å; L217-I247 PolarHBondContact N-O 3.13Å; L217-V248 HydrophobicContact CD1-CG2 4.27Å; L217-V248 WeakPolarHBondContact O-CA 3.3Å; L217-T249 PolarHBondContact O-N 2.93Å; L217-T249 PolarHBondContact O-OG1 3.14Å
218	D	93.9	Very high	90	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.032	19%	0.186	C	C	.	.	S	Bend	trans	-88.5	112.6	177.7	-166.8	33	0	0	0	110.5	T94 L97 Y132 V133 Q135 T249	T94-D218 WeakPolarHBondContact CG2-OD2 3.29Å; T94-D218 PolarHBondContact OG1-OD1 3.02Å; T94-D218 VanDerWaalsContact OG1-OD1 3.13Å; T94-D218 PolarHBondContact OG1-OD2 3.29Å; L97-D218 HydrophobicContact CD1-CB 4.04Å; Y132-D218 HydrophobicContact CE1-CB 4.09Å; V133-D218 PolarHBondContact O-N 3.15Å; Q135-D218 VanDerWaalsContact CA-O 3.32Å; Q135-D218 WeakPolarHBondContact CA-O 3.39Å; D218-T249 VanDerWaalsContact CA-OG1 3.25Å; D218-T249 WeakPolarHBondContact CA-OG1 3.39Å; D218-T249 PolarHBondContact OD1-OG1 3.39Å
219	E	92.1	Very high	89.9	Confident	22 Å²	22	31.9 Å²	31.9	10%	0.103	19%	0.191	C	C	.	.	S	Bend	trans	49.1	50	174	-73.7	-168.2	-179.3	0	0	115.3	Q135 T221 T222 T249	Q135-E219 HydrophobicContact CG-CB 4.09Å; Q135-E219 PolarHBondContact NE2-OE2 3.4Å; E219-T221 PolarHBondContact O-N 3.34Å; E219-T221 VanDerWaalsContact O-N 3.16Å; E219-T222 HydrophobicContact CB-CG2 3.68Å; E219-T222 HydrophobicContact CG-CG2 4.17Å; E219-T222 PolarHBondContact O-N 3.04Å; E219-T222 VanDerWaalsContact O-N 3.13Å; E219-T222 PolarHBondContact O-OG1 3.03Å; E219-T222 WeakPolarHBondContact OE2-CG2 3.28Å; E219-T249 WeakPolarHBondContact CA-O 3.16Å; E219-T249 PolarHBondContact N-O 2.92Å; E219-T249 VanDerWaalsContact N-O 3.14Å; E219-T249 PolarHBondContact N-OG1 2.91Å
220	P	92.4	Very high	89.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.8	-172.1	29.8	-36.6	0	0	0	114.1	R200 L217 L224 I232 L236 V248 T249	R200-P220 PolarHBondContact NE-O 3.23Å; L217-P220 HydrophobicContact CB-CB 4.32Å; L217-P220 HydrophobicContact CB-CG 4.03Å; L217-P220 HydrophobicContact CD2-CB 4.32Å; P220-L224 WeakPolarHBondContact O-CD1 3.15Å; P220-I232 HydrophobicContact CB-CG2 4.47Å; P220-L236 HydrophobicContact CG-CD1 4.2Å; P220-V248 VanDerWaalsContact CD-CG1 3.46Å; P220-V248 HydrophobicContact CG-CG1 3.37Å; P220-T249 WeakPolarHBondContact CD-O 3.32Å
221	T	90.3	Very high	90.1	Very high	19 Å²	19	36.2 Å²	36.2	12%	0.117	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-10	178.7	54.8	0	0	0	0	113.3	E219 L224 A229 V233	E219-T221 PolarHBondContact O-N 3.34Å; E219-T221 VanDerWaalsContact O-N 3.16Å; T221-L224 PolarHBondContact O-N 3.16Å; T221-A229 HydrophobicContact CG2-CB 4.19Å; T221-V233 HydrophobicContact CG2-CG2 3.81Å
222	T	87.7	Confident	90.4	Very high	40 Å²	40	32.1 Å²	32.1	25%	0.245	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	138.5	-176.5	59.4	0	0	0	0	112.2	E219 L224 H251	E219-T222 HydrophobicContact CB-CG2 3.68Å; E219-T222 HydrophobicContact CG-CG2 4.17Å; E219-T222 PolarHBondContact O-N 3.04Å; E219-T222 VanDerWaalsContact O-N 3.13Å; E219-T222 PolarHBondContact O-OG1 3.03Å; E219-T222 WeakPolarHBondContact OE2-CG2 3.28Å; T222-L224 PolarHBondContact O-N 2.8Å; T222-H251 HydrophobicContact CG2-CB 4.46Å
223	G	84.4	Confident	90.5	Very high	79 Å²	79	32.1 Å²	32.1	81%	0.814	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	73	11.1	-178.4	0	0	0	0	0	115
224	L	87.2	Confident	90.7	Very high	30 Å²	30	33.1 Å²	33.1	16%	0.157	20%	0.198	C	C	.	.	S	Bend	trans	-104.2	153.8	175.8	-58.1	-179	0	0	0	111.1	P220 T221 T222 T228 A229 I232	P220-L224 WeakPolarHBondContact O-CD1 3.15Å; T221-L224 PolarHBondContact O-N 3.16Å; T222-L224 PolarHBondContact O-N 2.8Å; L224-T228 HydrophobicContact CB-CG2 4.42Å; L224-T228 HydrophobicContact CD1-CG2 4.12Å; L224-T228 HydrophobicContact CD2-CG2 4.27Å; L224-A229 HydrophobicContact CB-CB 4.39Å; L224-I232 HydrophobicContact CD1-CG1 3.97Å
225	D	87.7	Confident	90.7	Very high	79 Å²	79	34.3 Å²	34.3	42%	0.422	20%	0.204	S	C	.	.			trans	-70.5	159.2	167.1	63.9	-68.8	0	0	0	111	M227 T228 A229	D225-M227 VanDerWaalsContact C-N 3.31Å; D225-M227 PolarHBondContact O-N 3.48Å; D225-M227 PolarHBondContact OD2-N 3.23Å; D225-T228 PolarHBondContact O-N 3.18Å; D225-T228 WeakPolarHBondContact OD1-CB 3.39Å; D225-T228 PolarHBondContact OD1-OG1 2.99Å; D225-T228 PolarHBondContact OD2-N 3.11Å; D225-T228 VanDerWaalsContact OD2-N 3.11Å; D225-T228 PolarHBondContact OD2-OG1 3.22Å; D225-T228 VanDerWaalsContact OD2-OG1 3.09Å; D225-A229 WeakPolarHBondContact O-CB 2.96Å; D225-A229 PolarHBondContact O-N 3.45Å
226	C	85.8	Confident	90.7	Very high	62 Å²	62	34.2 Å²	34.2	42%	0.419	20%	0.204	S	C	.	.	H	α-helix	trans	-59.7	-39.6	-172.1	-56.8	0	0	0	0	112.9	N230 R254	C226-N230 PolarHBondContact O-N 3.11Å; C226-N230 VanDerWaalsContact O-N 3.15Å; C226-R254 PolarHBondContact SG-NH2 3.43Å
227	M	88.8	Confident	90.7	Very high	133 Å²	133	35 Å²	35	66%	0.655	21%	0.21	S	C	*	.	H	α-helix	trans	-66.9	-48.6	-180	-179.8	177.8	178.3	0	0	110.8	D225 A229 N230 Q231	D225-M227 VanDerWaalsContact C-N 3.31Å; D225-M227 PolarHBondContact O-N 3.48Å; D225-M227 PolarHBondContact OD2-N 3.23Å; M227-A229 VanDerWaalsContact C-N 3.35Å; M227-A229 PolarHBondContact O-N 2.78Å; M227-N230 PolarHBondContact O-N 3.4Å; M227-Q231 WeakPolarHBondContact O-CG 3.41Å; M227-Q231 PolarHBondContact O-N 3.03Å; M227-Q231 VanDerWaalsContact O-N 3.09Å
228	T	89.5	Confident	90.5	Very high	18 Å²	18	38 Å²	38	11%	0.11	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-40.7	177.3	-59.8	0	0	0	0	112	L224 D225 N230 Q231 I232	L224-T228 HydrophobicContact CB-CG2 4.42Å; L224-T228 HydrophobicContact CD1-CG2 4.12Å; L224-T228 HydrophobicContact CD2-CG2 4.27Å; D225-T228 PolarHBondContact O-N 3.18Å; D225-T228 WeakPolarHBondContact OD1-CB 3.39Å; D225-T228 PolarHBondContact OD1-OG1 2.99Å; D225-T228 PolarHBondContact OD2-N 3.11Å; D225-T228 VanDerWaalsContact OD2-N 3.11Å; D225-T228 PolarHBondContact OD2-OG1 3.22Å; D225-T228 VanDerWaalsContact OD2-OG1 3.09Å; T228-N230 VanDerWaalsContact C-N 3.34Å; T228-N230 PolarHBondContact O-N 3.38Å; T228-Q231 PolarHBondContact O-N 3.37Å; T228-I232 HydrophobicContact CG2-CG1 4.44Å; T228-I232 WeakPolarHBondContact O-CG1 3.28Å; T228-I232 PolarHBondContact O-N 3.13Å
229	A	90.5	Very high	90.5	Very high	11 Å²	11	37.8 Å²	37.8	9%	0.091	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-46.1	176.8	0	0	0	0	0	111.5	T221 L224 D225 M227 Q231 I232 V233	T221-A229 HydrophobicContact CG2-CB 4.19Å; L224-A229 HydrophobicContact CB-CB 4.39Å; D225-A229 WeakPolarHBondContact O-CB 2.96Å; D225-A229 PolarHBondContact O-N 3.45Å; M227-A229 VanDerWaalsContact C-N 3.35Å; M227-A229 PolarHBondContact O-N 2.78Å; A229-Q231 PolarHBondContact O-N 2.9Å; A229-I232 PolarHBondContact O-N 3.49Å; A229-V233 PolarHBondContact O-N 3.14Å
230	N	90.6	Very high	90.5	Very high	35 Å²	35	36.8 Å²	36.8	19%	0.187	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-41.9	176.7	-72.7	-4.5	0	0	0	112	C226 M227 T228 I232 V233 L234 E256 L257	C226-N230 PolarHBondContact O-N 3.11Å; C226-N230 VanDerWaalsContact O-N 3.15Å; M227-N230 PolarHBondContact O-N 3.4Å; T228-N230 VanDerWaalsContact C-N 3.34Å; T228-N230 PolarHBondContact O-N 3.38Å; N230-I232 VanDerWaalsContact C-N 3.33Å; N230-I232 PolarHBondContact O-N 3.07Å; N230-V233 PolarHBondContact O-N 3.26Å; N230-L234 WeakPolarHBondContact O-CG 3.23Å; N230-L234 PolarHBondContact O-N 2.66Å; N230-E256 PolarHBondContact ND2-OE2 3.41Å; N230-E256 VanDerWaalsContact ND2-OE2 3.15Å; N230-L257 HydrophobicContact CB-CD2 4.4Å; N230-L257 VanDerWaalsContact OD1-CD2 3.3Å; N230-L257 WeakPolarHBondContact OD1-CD2 3.36Å
231	Q	90.8	Very high	90.5	Very high	73 Å²	73	44.3 Å²	44.3	34%	0.341	25%	0.247	S	C	.	.	H	α-helix	trans	-62.1	-37.9	175.2	-69.4	177.8	1.4	0	0	113	M227 T228 A229 L235	M227-Q231 WeakPolarHBondContact O-CG 3.41Å; M227-Q231 PolarHBondContact O-N 3.03Å; M227-Q231 VanDerWaalsContact O-N 3.09Å; T228-Q231 PolarHBondContact O-N 3.37Å; A229-Q231 PolarHBondContact O-N 2.9Å; Q231-L235 WeakPolarHBondContact O-CB 3.09Å; Q231-L235 PolarHBondContact O-N 3.1Å
232	I	92.2	Very high	90.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-43.5	176.5	-67.4	-65.7	0	0	0	110.8	R200 R201 I204 P220 L224 T228 A229 N230 L235 L236	R200-I232 HydrophobicContact CB-CD1 4.48Å; R200-I232 HydrophobicContact CG-CD1 4.36Å; R201-I232 HydrophobicContact CG-CD1 3.44Å; R201-I232 VanDerWaalsContact CG-CD1 3.44Å; I204-I232 HydrophobicContact CD1-CG2 4.37Å; P220-I232 HydrophobicContact CB-CG2 4.47Å; L224-I232 HydrophobicContact CD1-CG1 3.97Å; T228-I232 HydrophobicContact CG2-CG1 4.44Å; T228-I232 WeakPolarHBondContact O-CG1 3.28Å; T228-I232 PolarHBondContact O-N 3.13Å; A229-I232 PolarHBondContact O-N 3.49Å; N230-I232 VanDerWaalsContact C-N 3.33Å; N230-I232 PolarHBondContact O-N 3.07Å; I232-L235 WeakPolarHBondContact O-CB 3.43Å; I232-L235 PolarHBondContact O-N 2.84Å; I232-L236 HydrophobicContact CG2-CD1 4.09Å; I232-L236 HydrophobicContact CG2-CG 4.48Å; I232-L236 VanDerWaalsContact O-CG 3.31Å; I232-L236 WeakPolarHBondContact O-CG 3.26Å; I232-L236 PolarHBondContact O-N 2.85Å
233	V	92.7	Very high	90.5	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-66	-40.8	179.1	177.5	0	0	0	0	111.6	T221 A229 N230 L235 L236 A237 L257 F261	T221-V233 HydrophobicContact CG2-CG2 3.81Å; A229-V233 PolarHBondContact O-N 3.14Å; N230-V233 PolarHBondContact O-N 3.26Å; V233-L235 VanDerWaalsContact C-N 3.29Å; V233-L235 PolarHBondContact O-N 2.83Å; V233-L236 WeakPolarHBondContact O-CB 3.43Å; V233-L236 PolarHBondContact O-N 3.22Å; V233-L236 VanDerWaalsContact O-N 3.14Å; V233-A237 PolarHBondContact O-N 2.66Å; V233-L257 HydrophobicContact CB-CD2 3.76Å; V233-L257 HydrophobicContact CG1-CD2 3.83Å; V233-L257 HydrophobicContact CG2-CD1 4Å; V233-L257 HydrophobicContact CG2-CD2 4.08Å; V233-F261 HydrophobicContact CG1-CE1 4.07Å; V233-F261 HydrophobicContact CG1-CZ 3.88Å
234	L	92.1	Very high	90.9	Very high	86 Å²	86	47.8 Å²	47.8	45%	0.45	23%	0.233	S	C	.	.	H	α-helix	trans	-59.7	-40.4	173.4	-72.7	173.1	0	0	0	112.2	N230 L236 A237 E238	N230-L234 WeakPolarHBondContact O-CG 3.23Å; N230-L234 PolarHBondContact O-N 2.66Å; L234-L236 VanDerWaalsContact C-N 3.35Å; L234-A237 PolarHBondContact O-N 2.8Å; L234-E238 PolarHBondContact O-N 2.83Å
235	L	92.5	Very high	91.2	Very high	25 Å²	25	46.4 Å²	46.4	13%	0.131	23%	0.226	C	C	.	.	H	α-helix	trans	-64	-40.1	175.2	-172.7	64.5	0	0	0	111.8	L176 R201 Q231 I232 V233 E238 L239	L176-L235 HydrophobicContact CB-CD2 4.48Å; L176-L235 HydrophobicContact CD2-CD1 3.95Å; L176-L235 HydrophobicContact CD2-CD2 3.46Å; L176-L235 VanDerWaalsContact CD2-CD2 3.46Å; L176-L235 HydrophobicContact CD2-CG 3.79Å; R201-L235 HydrophobicContact CG-CD2 4.02Å; Q231-L235 WeakPolarHBondContact O-CB 3.09Å; Q231-L235 PolarHBondContact O-N 3.1Å; I232-L235 WeakPolarHBondContact O-CB 3.43Å; I232-L235 PolarHBondContact O-N 2.84Å; V233-L235 VanDerWaalsContact C-N 3.29Å; V233-L235 PolarHBondContact O-N 2.83Å; L235-E238 WeakPolarHBondContact O-CB 3.2Å; L235-E238 PolarHBondContact O-N 3.25Å; L235-L239 WeakPolarHBondContact O-CG 3.22Å; L235-L239 PolarHBondContact O-N 3.19Å
236	L	94.1	Very high	91.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-39.3	175.7	-68.6	171	0	0	0	112.2	I82 I204 L217 P220 I232 V233 L234 L239 A240 V246 V248	I82-L236 HydrophobicContact CD1-CB 3.92Å; I204-L236 HydrophobicContact CD1-CD2 4.22Å; L217-L236 HydrophobicContact CD1-CD2 3.8Å; L217-L236 HydrophobicContact CD2-CD1 4.22Å; L217-L236 HydrophobicContact CD2-CD2 3.51Å; L217-L236 HydrophobicContact CG-CD2 4.32Å; P220-L236 HydrophobicContact CG-CD1 4.2Å; I232-L236 HydrophobicContact CG2-CD1 4.09Å; I232-L236 HydrophobicContact CG2-CG 4.48Å; I232-L236 VanDerWaalsContact O-CG 3.31Å; I232-L236 WeakPolarHBondContact O-CG 3.26Å; I232-L236 PolarHBondContact O-N 2.85Å; V233-L236 WeakPolarHBondContact O-CB 3.43Å; V233-L236 PolarHBondContact O-N 3.22Å; V233-L236 VanDerWaalsContact O-N 3.14Å; L234-L236 VanDerWaalsContact C-N 3.35Å; L236-L239 HydrophobicContact CD2-CD1 4.32Å; L236-L239 PolarHBondContact O-N 2.8Å; L236-A240 PolarHBondContact O-N 3.41Å; L236-V246 HydrophobicContact CB-CG1 4.33Å; L236-V246 HydrophobicContact CD2-CG1 4.25Å; L236-V248 HydrophobicContact CD1-CG2 3.97Å
237	A	93.3	Very high	92.1	Very high	15 Å²	15	39.7 Å²	39.7	12%	0.124	19%	0.186	C	C	.	.	H	α-helix	trans	-65.7	-37.1	173.7	0	0	0	0	0	112	V233 L234 A240 R241	V233-A237 PolarHBondContact O-N 2.66Å; L234-A237 PolarHBondContact O-N 2.8Å; A237-A240 PolarHBondContact O-N 2.86Å; A237-R241 WeakPolarHBondContact O-CG 3.42Å; A237-R241 PolarHBondContact O-N 3.24Å; A237-R241 VanDerWaalsContact O-N 3.08Å
238	E	92.7	Very high	92.4	Very high	65 Å²	65	33.4 Å²	33.4	30%	0.304	16%	0.155	S	C	.	.	H	α-helix	trans	-63.2	-42.1	171	-178.8	67.7	-141.2	0	0	111.9	L234 L235 A240 R241 R242	L234-E238 PolarHBondContact O-N 2.83Å; L235-E238 WeakPolarHBondContact O-CB 3.2Å; L235-E238 PolarHBondContact O-N 3.25Å; E238-A240 VanDerWaalsContact C-N 3.34Å; E238-A240 PolarHBondContact O-N 3.11Å; E238-R241 PolarHBondContact O-N 2.83Å; E238-R241 IonicContact OE1-NH1 3.81Å; E238-R241 IonicContact OE2-CZ 3.19Å; E238-R241 IonicContact OE2-NH1 3.35Å; E238-R241 PolarHBondContact OE2-NH1 3.46Å; E238-R241 IonicContact OE2-NH2 3.92Å; E238-R241 PolarHBondContact OE2-NH2 3.43Å; E238-R242 WeakPolarHBondContact O-CG 3.42Å; E238-R242 PolarHBondContact O-N 3.15Å; E238-R242 IonicContact OE1-NE 3.67Å
239	L	92.7	Very high	92.6	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-38.6	175.8	-70.6	172.7	0	0	0	112.1	E175 L176 I204 L208 L235 L236 R242 R244	E175-L239 HydrophobicContact CG-CD2 4.43Å; L176-L239 HydrophobicContact CD2-CD1 4.31Å; I204-L239 HydrophobicContact CG2-CD1 3.9Å; L208-L239 HydrophobicContact CD1-CD1 3.98Å; L208-L239 HydrophobicContact CD1-CD2 3.67Å; L208-L239 HydrophobicContact CD2-CD1 4.44Å; L208-L239 HydrophobicContact CD2-CD2 4.06Å; L235-L239 WeakPolarHBondContact O-CG 3.22Å; L235-L239 PolarHBondContact O-N 3.19Å; L236-L239 HydrophobicContact CD2-CD1 4.32Å; L236-L239 PolarHBondContact O-N 2.8Å; L239-R242 PolarHBondContact O-N 3.32Å; L239-R244 WeakPolarHBondContact O-CB 3.47Å
240	A	93.5	Very high	92.6	Very high	1 Å²	1	32 Å²	32	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-60.9	-48.5	174.6	0	0	0	0	0	110.9	G80 I82 L236 A237 E238 R242 D243 R244 V246	G80-A240 WeakPolarHBondContact CA-O 3.33Å; I82-A240 HydrophobicContact CB-CB 4.22Å; L236-A240 PolarHBondContact O-N 3.41Å; A237-A240 PolarHBondContact O-N 2.86Å; E238-A240 VanDerWaalsContact C-N 3.34Å; E238-A240 PolarHBondContact O-N 3.11Å; A240-R242 PolarHBondContact O-N 2.95Å; A240-D243 PolarHBondContact O-N 2.82Å; A240-R244 WeakPolarHBondContact CA-O 3.17Å; A240-R244 PolarHBondContact O-N 2.54Å; A240-R244 VanDerWaalsContact O-N 3.15Å; A240-V246 HydrophobicContact CB-CB 4.3Å; A240-V246 HydrophobicContact CB-CG2 3.83Å
241	R	91.5	Very high	92.1	Very high	157 Å²	157	33.3 Å²	33.3	59%	0.592	15%	0.15	S	C	*	.	H	α-helix	trans	-56.3	-22.6	177.2	-77	-173.7	-82.3	116.4	-1.1	114	A237 E238 D243	A237-R241 WeakPolarHBondContact O-CG 3.42Å; A237-R241 PolarHBondContact O-N 3.24Å; A237-R241 VanDerWaalsContact O-N 3.08Å; E238-R241 PolarHBondContact O-N 2.83Å; E238-R241 IonicContact OE1-NH1 3.81Å; E238-R241 IonicContact OE2-CZ 3.19Å; E238-R241 IonicContact OE2-NH1 3.35Å; E238-R241 PolarHBondContact OE2-NH1 3.46Å; E238-R241 IonicContact OE2-NH2 3.92Å; E238-R241 PolarHBondContact OE2-NH2 3.43Å; R241-D243 PolarHBondContact O-N 3.04Å
242	R	89.7	Confident	91.5	Very high	125 Å²	125	35.2 Å²	35.2	47%	0.472	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	41.1	174.4	-65.5	177.9	176.5	-142.8	-4.7	113.3	E175 E238 L239 A240 R244	E175-R242 WeakPolarHBondContact OE1-CD 3.4Å; E175-R242 IonicContact OE1-CZ 3.95Å; E175-R242 IonicContact OE1-NE 3.4Å; E175-R242 IonicContact OE1-NH1 2.74Å; E175-R242 PolarHBondContact OE1-NH1 3.28Å; E175-R242 IonicContact OE2-NH1 3.17Å; E238-R242 WeakPolarHBondContact O-CG 3.42Å; E238-R242 PolarHBondContact O-N 3.15Å; E238-R242 IonicContact OE1-NE 3.67Å; L239-R242 PolarHBondContact O-N 3.32Å; A240-R242 PolarHBondContact O-N 2.95Å; R242-R244 PolarHBondContact O-N 3.3Å
243	D	89.1	Confident	90.9	Very high	60 Å²	60	35.5 Å²	35.5	32%	0.321	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	51.9	178.9	-176.7	49.5	0	0	0	112.3	H37 S79 K213 A240 R241	H37-D243 IonicContact CD2-OD2 3.82Å; S79-D243 WeakPolarHBondContact CB-OD1 3.24Å; S79-D243 WeakPolarHBondContact OG-CA 3.14Å; S79-D243 PolarHBondContact OG-O 3.01Å; S79-D243 PolarHBondContact OG-OD1 2.75Å; K213-D243 WeakPolarHBondContact CD-O 3.34Å; K213-D243 PolarHBondContact NZ-O 3.19Å; K213-D243 IonicContact NZ-OD2 3.65Å; K213-D243 PolarHBondContact NZ-OD2 3.27Å; A240-D243 PolarHBondContact O-N 2.82Å; R241-D243 PolarHBondContact O-N 3.04Å
244	R	91.9	Very high	90.5	Very high	27 Å²	27	41.7 Å²	41.7	10%	0.102	18%	0.184	C	C	.	.			trans	-127.4	151.4	170.8	-56.2	-179.2	-166.3	-94.3	3.9	110.2	S79 G80 P212 K213 L239 A240 R242 V246	S79-R244 PolarHBondContact OG-N 2.7Å; G80-R244 PolarHBondContact N-O 3.39Å; P212-R244 PolarHBondContact O-NH1 3.36Å; K213-R244 CarbonylContact O-C 3.58Å; K213-R244 WeakPolarHBondContact O-CA 3.43Å; L239-R244 WeakPolarHBondContact O-CB 3.47Å; A240-R244 WeakPolarHBondContact CA-O 3.17Å; A240-R244 PolarHBondContact O-N 2.54Å; A240-R244 VanDerWaalsContact O-N 3.15Å; R242-R244 PolarHBondContact O-N 3.3Å; R244-V246 HydrophobicContact CB-CG2 4.49Å
245	I	94	Very high	90.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.5	168.3	-63	-178.5	0	0	0	107.1	H37 L39 I77 K213 V214 M215 I247	H37-I245 HydrophobicContact CB-CD1 4.34Å; L39-I245 HydrophobicContact CB-CD1 3.91Å; L39-I245 HydrophobicContact CD2-CG2 4.34Å; I77-I245 HydrophobicContact CB-CG2 4.39Å; I77-I245 HydrophobicContact CD1-CG2 3.81Å; I77-I245 HydrophobicContact CG1-CG2 4.08Å; I77-I245 HydrophobicContact CG2-CG2 3.47Å; I77-I245 VanDerWaalsContact CG2-CG2 3.47Å; K213-I245 PolarHBondContact O-N 3.31Å; V214-I245 WeakPolarHBondContact CA-O 3.25Å; V214-I245 HydrophobicContact CB-CB 4.4Å; V214-I245 HydrophobicContact CG1-CB 4.05Å; V214-I245 HydrophobicContact CG1-CG2 3.94Å; V214-I245 HydrophobicContact CG2-CB 4.19Å; V214-I245 HydrophobicContact CG2-CD1 4.19Å; M215-I245 PolarHBondContact N-O 2.76Å; I245-I247 HydrophobicContact CG2-CG1 4.46Å
246	V	95.8	Very high	89.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.1	180	-176.4	0	0	0	0	109.7	Q81 I82 M83 M215 L217 L236 A240 R244 V248	Q81-V246 PolarHBondContact O-N 3.15Å; I82-V246 CarbonylContact C-O 3.54Å; I82-V246 WeakPolarHBondContact CA-O 3.17Å; I82-V246 HydrophobicContact CB-CB 4.43Å; I82-V246 HydrophobicContact CD1-CG1 4.33Å; I82-V246 HydrophobicContact CG1-CB 4.2Å; I82-V246 HydrophobicContact CG1-CG1 4.14Å; M83-V246 PolarHBondContact N-O 3.29Å; M215-V246 WeakPolarHBondContact O-CA 3.41Å; L217-V246 HydrophobicContact CD1-CG1 3.72Å; L236-V246 HydrophobicContact CB-CG1 4.33Å; L236-V246 HydrophobicContact CD2-CG1 4.25Å; A240-V246 HydrophobicContact CB-CB 4.3Å; A240-V246 HydrophobicContact CB-CG2 3.83Å; R244-V246 HydrophobicContact CB-CG2 4.49Å; V246-V248 HydrophobicContact CG1-CG2 3.87Å
247	I	96.1	Very high	89.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.8	174.2	-56.6	170.5	0	0	0	108.3	L39 I77 M83 I85 L97 M215 M216 L217 I245	L39-I247 HydrophobicContact CD2-CD1 3.57Å; I77-I247 HydrophobicContact CD1-CG1 4.27Å; M83-I247 HydrophobicContact CB-CG1 4.4Å; M83-I247 WeakPolarHBondContact O-CA 3.45Å; I85-I247 HydrophobicContact CD1-CG2 3.53Å; I85-I247 HydrophobicContact CG1-CG2 4.09Å; L97-I247 HydrophobicContact CD2-CB 4.43Å; L97-I247 HydrophobicContact CD2-CG2 3.65Å; M215-I247 PolarHBondContact O-N 2.73Å; M216-I247 CarbonylContact C-O 3.6Å; M216-I247 WeakPolarHBondContact CA-O 3.36Å; M216-I247 HydrophobicContact CG-CB 4.14Å; M216-I247 HydrophobicContact CG-CD1 4.3Å; L217-I247 PolarHBondContact N-O 3.13Å; I245-I247 HydrophobicContact CG2-CG1 4.46Å
248	V	95.3	Very high	88.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133.5	-177.1	-171.6	0	0	0	0	109.4	I82 M83 C84 I85 L217 P220 L236 V246 I250	I82-V248 HydrophobicContact CD1-CG2 4.22Å; I82-V248 HydrophobicContact CG1-CG2 4.34Å; M83-V248 PolarHBondContact O-N 3.16Å; C84-V248 CarbonylContact C-O 3.39Å; C84-V248 WeakPolarHBondContact CA-O 3.22Å; I85-V248 PolarHBondContact N-O 3.02Å; L217-V248 HydrophobicContact CD1-CG2 4.27Å; L217-V248 WeakPolarHBondContact O-CA 3.3Å; P220-V248 VanDerWaalsContact CD-CG1 3.46Å; P220-V248 HydrophobicContact CG-CG1 3.37Å; L236-V248 HydrophobicContact CD1-CG2 3.97Å; V246-V248 HydrophobicContact CG1-CG2 3.87Å; V248-I250 HydrophobicContact CG1-CD1 4.1Å; V248-I250 HydrophobicContact CG1-CG1 3.68Å
249	T	94.3	Very high	88.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.4	163.4	52.5	0	0	0	0	109.4	I85 K93 L97 L217 D218 E219 P220	I85-T249 HydrophobicContact CB-CG2 3.91Å; I85-T249 HydrophobicContact CD1-CG2 4.42Å; I85-T249 HydrophobicContact CG2-CG2 4.2Å; I85-T249 WeakPolarHBondContact O-CA 3.25Å; K93-T249 HydrophobicContact CB-CG2 3.82Å; L97-T249 HydrophobicContact CD1-CG2 3.32Å; L97-T249 HydrophobicContact CD2-CG2 4.33Å; L97-T249 HydrophobicContact CG-CG2 3.62Å; L217-T249 PolarHBondContact O-N 2.93Å; L217-T249 PolarHBondContact O-OG1 3.14Å; D218-T249 VanDerWaalsContact CA-OG1 3.25Å; D218-T249 WeakPolarHBondContact CA-OG1 3.39Å; D218-T249 PolarHBondContact OD1-OG1 3.39Å; E219-T249 WeakPolarHBondContact CA-O 3.16Å; E219-T249 PolarHBondContact N-O 2.92Å; E219-T249 VanDerWaalsContact N-O 3.14Å; E219-T249 PolarHBondContact N-OG1 2.91Å; P220-T249 WeakPolarHBondContact CD-O 3.32Å
250	I	90.1	Very high	88.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.239	C	C	.	.			trans	-128.9	135.1	177.7	-56.1	-176.9	0	0	0	110.2	I85 L86 V248 P253 F261	I85-I250 PolarHBondContact O-N 3.47Å; I85-I250 VanDerWaalsContact O-N 3.1Å; L86-I250 HydrophobicContact CD2-CB 4.22Å; V248-I250 HydrophobicContact CG1-CD1 4.1Å; V248-I250 HydrophobicContact CG1-CG1 3.68Å; I250-P253 HydrophobicContact CG2-CB 3.91Å; I250-P253 HydrophobicContact CG2-CG 4.38Å; I250-F261 HydrophobicContact CD1-CE1 4.15Å; I250-F261 HydrophobicContact CD1-CE2 4.28Å; I250-F261 HydrophobicContact CD1-CZ 3.44Å; I250-F261 VanDerWaalsContact CD1-CZ 3.44Å
251	H	79.5	Confident	88.1	Confident	63 Å²	63	53.7 Å²	53.7	29%	0.292	24%	0.24	S	C	.	.	S	Bend	trans	-95.4	105.2	168	-169	-80.8	0	0	0	108.3	S89 T222	S89-H251 PolarHBondContact OG-NE2 2.74Å; S89-H251 VanDerWaalsContact OG-NE2 3.16Å; T222-H251 HydrophobicContact CG2-CB 4.46Å
252	Q	77.5	Confident	88.2	Confident	113 Å²	113	49.6 Å²	49.6	53%	0.528	23%	0.23	S	C	.	.	S	Bend	trans	56.2	79.5	178.6	-65	173.6	-13	0	0	115.3	M303	Q252-M303 HydrophobicContact CG-CE 4.23Å; Q252-M303 HydrophobicContact CG-SD 3.81Å
253	P	80.6	Confident	88.4	Confident	5 Å²	5	45 Å²	45	3%	0.032	21%	0.213	C	C	.	.			trans	-72	149.5	173.9	32	-37.1	0	0	0	112.4	L86 I250 L257 N297 F299	L86-P253 HydrophobicContact CD2-CG 3.73Å; I250-P253 HydrophobicContact CG2-CB 3.91Å; I250-P253 HydrophobicContact CG2-CG 4.38Å; P253-L257 HydrophobicContact CB-CD1 4.19Å; P253-N297 PolarHBondContact O-ND2 3.42Å; P253-F299 HydrophobicContact CB-CD2 3.97Å; P253-F299 HydrophobicContact CB-CE2 4Å; P253-F299 HydrophobicContact CB-CG 4.4Å; P253-F299 HydrophobicContact CG-CB 3.64Å; P253-F299 HydrophobicContact CG-CD1 3.77Å; P253-F299 HydrophobicContact CG-CD2 3.42Å; P253-F299 VanDerWaalsContact CG-CD2 3.42Å; P253-F299 HydrophobicContact CG-CE1 4.11Å; P253-F299 HydrophobicContact CG-CE2 3.75Å; P253-F299 HydrophobicContact CG-CG 3.37Å; P253-F299 HydrophobicContact CG-CZ 4.08Å
254	R	83.6	Confident	88.7	Confident	132 Å²	132	42.1 Å²	42.1	50%	0.498	20%	0.198	S	C	.	.			trans	-64	150.2	167.3	-67	-72.9	-178.9	-179.8	-2.9	110.8	C226 E256 L257	C226-R254 PolarHBondContact SG-NH2 3.43Å; R254-E256 WeakPolarHBondContact CB-OE2 3.42Å; R254-E256 PolarHBondContact O-N 3.46Å; R254-L257 WeakPolarHBondContact O-CB 3.47Å; R254-L257 PolarHBondContact O-N 3.08Å; R254-L257 VanDerWaalsContact O-N 3.11Å
255	S	85.4	Confident	88.8	Confident	56 Å²	56	40.9 Å²	40.9	39%	0.392	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-58	-31.3	175.2	51	0	0	0	0	112.9	L257 F258 N297	S255-L257 PolarHBondContact O-N 2.89Å; S255-F258 WeakPolarHBondContact O-CB 3.47Å; S255-F258 PolarHBondContact O-N 3.4Å; S255-F258 VanDerWaalsContact O-N 3.11Å; S255-N297 WeakPolarHBondContact CA-OD1 3.45Å; S255-N297 WeakPolarHBondContact CB-OD1 3.43Å; S255-N297 PolarHBondContact N-ND2 2.9Å
256	E	84.2	Confident	88.9	Confident	107 Å²	107	41 Å²	41	50%	0.5	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-61.5	-28.4	178.7	-55.6	107.1	-153.3	0	0	112.8	N230 R254 F258	N230-E256 PolarHBondContact ND2-OE2 3.41Å; N230-E256 VanDerWaalsContact ND2-OE2 3.15Å; R254-E256 WeakPolarHBondContact CB-OE2 3.42Å; R254-E256 PolarHBondContact O-N 3.46Å; E256-F258 PolarHBondContact O-N 2.78Å
257	L	86	Confident	88.7	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.026	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-77.6	-10.8	-178.8	-61.4	176.7	0	0	0	112.9	N230 V233 P253 R254 S255 Q259 H260 F261	N230-L257 HydrophobicContact CB-CD2 4.4Å; N230-L257 VanDerWaalsContact OD1-CD2 3.3Å; N230-L257 WeakPolarHBondContact OD1-CD2 3.36Å; V233-L257 HydrophobicContact CB-CD2 3.76Å; V233-L257 HydrophobicContact CG1-CD2 3.83Å; V233-L257 HydrophobicContact CG2-CD1 4Å; V233-L257 HydrophobicContact CG2-CD2 4.08Å; P253-L257 HydrophobicContact CB-CD1 4.19Å; R254-L257 WeakPolarHBondContact O-CB 3.47Å; R254-L257 PolarHBondContact O-N 3.08Å; R254-L257 VanDerWaalsContact O-N 3.11Å; S255-L257 PolarHBondContact O-N 2.89Å; L257-Q259 VanDerWaalsContact C-N 3.28Å; L257-Q259 PolarHBondContact O-N 3.04Å; L257-H260 PolarHBondContact O-N 3.45Å; L257-H260 VanDerWaalsContact O-N 3.07Å; L257-F261 HydrophobicContact CB-CE2 3.84Å; L257-F261 HydrophobicContact CB-CZ 4.45Å; L257-F261 WeakPolarHBondContact O-CD2 3.44Å; L257-F261 WeakPolarHBondContact O-CE2 3.15Å
258	F	83.4	Confident	88.5	Confident	23 Å²	23	41.1 Å²	41.1	10%	0.101	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-57.6	-41.2	-172.1	-171.7	-103.1	0	0	0	112.9	S255 E256 H260 I264 P278 M281 L282 P298 F299	S255-F258 WeakPolarHBondContact O-CB 3.47Å; S255-F258 PolarHBondContact O-N 3.4Å; S255-F258 VanDerWaalsContact O-N 3.11Å; E256-F258 PolarHBondContact O-N 2.78Å; F258-H260 VanDerWaalsContact C-N 3.27Å; F258-H260 PolarHBondContact O-N 2.87Å; F258-I264 HydrophobicContact CD2-CD1 4.25Å; F258-I264 HydrophobicContact CE2-CD1 3.93Å; F258-P278 HydrophobicContact CD1-CB 4.01Å; F258-P278 HydrophobicContact CE1-CB 3.43Å; F258-P278 VanDerWaalsContact CE1-CB 3.43Å; F258-P278 HydrophobicContact CE2-CB 4.1Å; F258-P278 HydrophobicContact CZ-CB 3.48Å; F258-P278 VanDerWaalsContact CZ-CB 3.48Å; F258-M281 HydrophobicContact CE2-CE 3.38Å; F258-M281 HydrophobicContact CZ-CE 3.76Å; F258-L282 HydrophobicContact CE1-CD1 4.06Å; F258-L282 HydrophobicContact CE1-CG 4.5Å; F258-L282 HydrophobicContact CZ-CD1 4.21Å; F258-L282 HydrophobicContact CZ-CG 4.15Å; F258-P298 HydrophobicContact CD1-CG 4.48Å; F258-P298 HydrophobicContact CD2-CB 4.44Å; F258-P298 HydrophobicContact CD2-CG 3.81Å; F258-P298 HydrophobicContact CE2-CB 4.1Å; F258-P298 HydrophobicContact CE2-CG 3.93Å; F258-P298 HydrophobicContact CG-CG 4.11Å; F258-P298 HydrophobicContact CZ-CB 4.41Å; F258-P298 HydrophobicContact CZ-CG 4.31Å; F258-F299 HydrophobicContact CB-CD2 4.21Å; F258-F299 HydrophobicContact CB-CE2 3.57Å; F258-F299 HydrophobicContact CB-CZ 4.04Å; F258-F299 HydrophobicContact CD2-CD1 4.01Å; F258-F299 AromaticContact CD2-CD2 3.88Å; F258-F299 HydrophobicContact CD2-CD2 3.88Å; F258-F299 AromaticContact CD2-CE1 3.68Å; F258-F299 HydrophobicContact CD2-CE1 3.68Å; F258-F299 AromaticContact CD2-CE2 3.57Å; F258-F299 HydrophobicContact CD2-CE2 3.57Å; F258-F299 HydrophobicContact CD2-CG 4.12Å; F258-F299 AromaticContact CD2-CZ 3.46Å; F258-F299 HydrophobicContact CD2-CZ 3.46Å; F258-F299 VanDerWaalsContact CD2-CZ 3.46Å; F258-F299 HydrophobicContact CE2-CD1 4.37Å; F258-F299 HydrophobicContact CE2-CE1 4.14Å; F258-F299 HydrophobicContact CE2-CZ 4.33Å; F258-F299 HydrophobicContact CG-CE2 4.08Å; F258-F299 HydrophobicContact CG-CZ 4.19Å
259	Q	82.9	Confident	88.1	Confident	172 Å²	172	45.3 Å²	45.3	80%	0.804	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-81	-6.6	-176.6	-61.2	-179.5	-3.7	0	0	113.4	L257	L257-Q259 VanDerWaalsContact C-N 3.28Å; L257-Q259 PolarHBondContact O-N 3.04Å
260	H	87.4	Confident	87.8	Confident	76 Å²	76	45.3 Å²	45.3	35%	0.352	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-94.2	-9.8	-177.9	-64	-34.2	0	0	0	113.5	I82 L257 F258	I82-H260 VanDerWaalsContact CG2-O 3.24Å; I82-H260 WeakPolarHBondContact CG2-O 3.24Å; L257-H260 PolarHBondContact O-N 3.45Å; L257-H260 VanDerWaalsContact O-N 3.07Å; F258-H260 VanDerWaalsContact C-N 3.27Å; F258-H260 PolarHBondContact O-N 2.87Å
261	F	92.1	Very high	87.9	Confident	5 Å²	5	46.4 Å²	46.4	2%	0.022	22%	0.217	C	C	.	.			trans	-96	125.7	178.8	-61.6	-67	0	0	0	111.7	I82 C84 V233 I250 L257 I264 P278 F299	I82-F261 HydrophobicContact CD1-CD1 4.06Å; I82-F261 HydrophobicContact CD1-CE1 3.95Å; I82-F261 HydrophobicContact CG1-CD1 4.04Å; I82-F261 HydrophobicContact CG1-CE1 4.31Å; I82-F261 HydrophobicContact CG2-CD1 4.25Å; C84-F261 HydrophobicContact CB-CB 4.3Å; C84-F261 HydrophobicContact CB-CD1 3.53Å; C84-F261 HydrophobicContact CB-CD2 4.04Å; C84-F261 HydrophobicContact CB-CE1 3.74Å; C84-F261 HydrophobicContact CB-CE2 4.21Å; C84-F261 HydrophobicContact CB-CG 3.68Å; C84-F261 HydrophobicContact CB-CZ 4.08Å; V233-F261 HydrophobicContact CG1-CE1 4.07Å; V233-F261 HydrophobicContact CG1-CZ 3.88Å; I250-F261 HydrophobicContact CD1-CE1 4.15Å; I250-F261 HydrophobicContact CD1-CE2 4.28Å; I250-F261 HydrophobicContact CD1-CZ 3.44Å; I250-F261 VanDerWaalsContact CD1-CZ 3.44Å; L257-F261 HydrophobicContact CB-CE2 3.84Å; L257-F261 HydrophobicContact CB-CZ 4.45Å; L257-F261 WeakPolarHBondContact O-CD2 3.44Å; L257-F261 WeakPolarHBondContact O-CE2 3.15Å; F261-I264 HydrophobicContact CB-CG1 4Å; F261-P278 WeakPolarHBondContact O-CD 3.31Å; F261-P278 WeakPolarHBondContact O-CG 3.47Å; F261-F299 AromaticContact CD2-CZ 3.78Å; F261-F299 HydrophobicContact CD2-CZ 3.78Å; F261-F299 AromaticContact CE2-CZ 3.99Å; F261-F299 HydrophobicContact CE2-CZ 3.99Å
262	D	93.7	Very high	88.6	Confident	71 Å²	71	44 Å²	44	38%	0.38	21%	0.206	S	C	.	.	S	Bend	trans	-72.4	-37.2	174.4	-58.5	-72.1	0	0	0	111.3	Q81 I82	Q81-D262 VanDerWaalsContact CA-OD2 3.28Å; Q81-D262 WeakPolarHBondContact CA-OD2 3.44Å; Q81-D262 HydrophobicContact CB-CB 4.02Å; Q81-D262 HydrophobicContact CG-CB 4.21Å; I82-D262 WeakPolarHBondContact CG2-OD2 3.36Å; I82-D262 PolarHBondContact N-OD2 3.4Å; I82-D262 PolarHBondContact O-N 3.13Å; I82-D262 VanDerWaalsContact O-N 3.16Å
263	K	94.5	Very high	89.3	Confident	28 Å²	28	38.6 Å²	38.6	12%	0.122	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139	176.9	-65.6	-167.2	-179	-169.5	0	111.8	Y76 I82 M83 C84 G276	Y76-K263 WeakPolarHBondContact O-CD 3.31Å; Y76-K263 PolarHBondContact O-NZ 2.84Å; I82-K263 PolarHBondContact O-N 2.9Å; I82-K263 VanDerWaalsContact O-N 3.15Å; M83-K263 CarbonylContact C-O 3.58Å; M83-K263 VanDerWaalsContact CA-O 3.29Å; M83-K263 WeakPolarHBondContact CA-O 3.42Å; M83-K263 HydrophobicContact CB-CB 4.28Å; M83-K263 HydrophobicContact CE-CB 4.16Å; M83-K263 HydrophobicContact CE-CD 3.97Å; M83-K263 HydrophobicContact CG-CB 4.33Å; C84-K263 PolarHBondContact N-O 2.61Å; K263-G276 CarbonylContact C-O 3.51Å; K263-G276 WeakPolarHBondContact CA-O 3.31Å
264	I	94.8	Very high	90	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.9	174.2	-62.4	163.5	0	0	0	107.7	C84 L86 F258 F261 C275 G276 P278 M281 F299	C84-I264 HydrophobicContact CB-CG1 4.47Å; C84-I264 CarbonylContact O-C 3.54Å; C84-I264 WeakPolarHBondContact O-CA 3.41Å; L86-I264 HydrophobicContact CD1-CG2 3.62Å; L86-I264 HydrophobicContact CG-CG2 4.35Å; F258-I264 HydrophobicContact CD2-CD1 4.25Å; F258-I264 HydrophobicContact CE2-CD1 3.93Å; F261-I264 HydrophobicContact CB-CG1 4Å; I264-C275 VanDerWaalsContact O-CA 3.3Å; I264-C275 WeakPolarHBondContact O-CA 3.46Å; I264-G276 PolarHBondContact N-O 3.5Å; I264-G276 PolarHBondContact O-N 2.93Å; I264-P278 HydrophobicContact CD1-CB 3.88Å; I264-P278 HydrophobicContact CD1-CG 3.73Å; I264-P278 HydrophobicContact CG1-CG 4.46Å; I264-M281 HydrophobicContact CB-SD 4.48Å; I264-M281 HydrophobicContact CD1-CE 4.45Å; I264-M281 HydrophobicContact CG2-SD 3.95Å; I264-F299 HydrophobicContact CD1-CE1 3.59Å; I264-F299 HydrophobicContact CD1-CZ 4.05Å; I264-F299 HydrophobicContact CG1-CE1 4.19Å; I264-F299 HydrophobicContact CG2-CE1 4.41Å
265	A	94.6	Very high	90.5	Very high	2 Å²	2	32.1 Å²	32.1	2%	0.017	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.9	174.2	0	0	0	0	0	109.9	C84 I85 L86 L272 F274 C275	C84-A265 PolarHBondContact O-N 3.27Å; I85-A265 CarbonylContact C-O 3.53Å; I85-A265 WeakPolarHBondContact CA-O 3.36Å; I85-A265 HydrophobicContact CG1-CB 4.43Å; L86-A265 PolarHBondContact N-O 2.95Å; A265-L272 HydrophobicContact CB-CD1 4.11Å; A265-F274 CarbonylContact C-O 3.56Å; A265-F274 WeakPolarHBondContact CA-O 3.3Å; A265-C275 HydrophobicContact CB-CB 4.25Å
266	I	94.4	Very high	90.9	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.015	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.1	178.8	-58	176.8	0	0	0	109.2	L86 V273 F274 M281 F285 T306	L86-I266 HydrophobicContact CB-CG1 4.39Å; I266-V273 HydrophobicContact CG2-CB 4.44Å; I266-V273 PolarHBondContact O-N 3.43Å; I266-F274 HydrophobicContact CB-CB 4.49Å; I266-F274 HydrophobicContact CD1-CB 4.5Å; I266-F274 PolarHBondContact N-O 3.23Å; I266-M281 HydrophobicContact CD1-SD 4.03Å; I266-F285 HydrophobicContact CD1-CE2 3.93Å; I266-F285 HydrophobicContact CD1-CZ 3.94Å; I266-T306 HydrophobicContact CD1-CG2 4.46Å; I266-T306 HydrophobicContact CG2-CG2 4.01Å; I266-T306 WeakPolarHBondContact CG2-OG1 3.41Å
267	L	93.3	Very high	91.4	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	128	-179.2	-165.6	80.3	0	0	0	110.9	L70 V73 L86 G87 S91 L96 E271	L70-L267 HydrophobicContact CD2-CD2 4.19Å; V73-L267 HydrophobicContact CG2-CD1 4.08Å; L86-L267 PolarHBondContact O-N 3.14Å; G87-L267 VanDerWaalsContact CA-O 3.3Å; G87-L267 WeakPolarHBondContact CA-O 3.37Å; S91-L267 WeakPolarHBondContact CB-O 3.49Å; S91-L267 VanDerWaalsContact O-CD2 3.29Å; S91-L267 WeakPolarHBondContact O-CD2 3.33Å; S91-L267 PolarHBondContact OG-O 3.32Å; L96-L267 HydrophobicContact CB-CD2 4.43Å; L96-L267 HydrophobicContact CD2-CD1 4.44Å; L96-L267 HydrophobicContact CD2-CD2 4.34Å; L267-E271 WeakPolarHBondContact CA-O 3.07Å; L267-E271 WeakPolarHBondContact CD1-O 3.43Å
268	T	91.2	Very high	91.7	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	124.4	179	-68	0	0	0	0	110.3	G270 E271 T306 V308 V323	T268-G270 PolarHBondContact O-N 2.69Å; T268-E271 PolarHBondContact N-O 3.08Å; T268-E271 PolarHBondContact O-N 3.41Å; T268-T306 WeakPolarHBondContact CB-O 3.33Å; T268-T306 WeakPolarHBondContact CG2-O 3.37Å; T268-T306 PolarHBondContact OG1-O 3.48Å; T268-V308 HydrophobicContact CG2-CG2 4.2Å; T268-V323 HydrophobicContact CG2-CG1 3.72Å; T268-V323 HydrophobicContact CG2-CG2 4.27Å
269	Y	87.2	Confident	92.1	Very high	89 Å²	89	34 Å²	34	35%	0.349	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	33.6	-177	-71.3	-89.9	0	0	0	115.2	E271 V308	Y269-E271 VanDerWaalsContact C-N 3.34Å; Y269-V308 HydrophobicContact CD2-CB 4.27Å; Y269-V308 HydrophobicContact CD2-CG2 3.68Å; Y269-V308 HydrophobicContact CE2-CB 3.45Å; Y269-V308 VanDerWaalsContact CE2-CB 3.45Å; Y269-V308 HydrophobicContact CE2-CG1 4.38Å; Y269-V308 HydrophobicContact CE2-CG2 3.38Å
270	G	88.5	Confident	92.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	-2.9	-179.3	0	0	0	0	0	116.2	I69 K71 V73 S91 T268	I69-G270 WeakPolarHBondContact O-CA 3.49Å; K71-G270 PolarHBondContact N-O 2.86Å; V73-G270 WeakPolarHBondContact CG2-O 3.19Å; S91-G270 WeakPolarHBondContact O-CA 3.47Å; S91-G270 PolarHBondContact O-N 3.36Å; T268-G270 PolarHBondContact O-N 2.69Å
271	E	91.2	Very high	92.8	Very high	23 Å²	23	25 Å²	25	11%	0.107	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.2	178.3	-66.4	167	-178.9	0	0	109.6	K71 L267 T268 Y269 E327	K71-E271 HydrophobicContact CB-CG 3.82Å; K71-E271 HydrophobicContact CD-CG 3.57Å; K71-E271 WeakPolarHBondContact CD-OE1 3.44Å; K71-E271 WeakPolarHBondContact CE-OE1 3.47Å; K71-E271 HydrophobicContact CG-CG 4.35Å; K71-E271 IonicContact NZ-OE1 3.26Å; K71-E271 PolarHBondContact NZ-OE1 3.24Å; L267-E271 WeakPolarHBondContact CA-O 3.07Å; L267-E271 WeakPolarHBondContact CD1-O 3.43Å; T268-E271 PolarHBondContact N-O 3.08Å; T268-E271 PolarHBondContact O-N 3.41Å; Y269-E271 VanDerWaalsContact C-N 3.34Å; E271-E327 HydrophobicContact CB-CG 4.45Å
272	L	93.4	Very high	92.8	Very high	12 Å²	12	27.5 Å²	27.5	6%	0.063	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.4	176.5	-176.7	70.9	0	0	0	109.3	V73 S74 A265 F274 C275 F330	V73-L272 HydrophobicContact CG1-CB 4.31Å; V73-L272 HydrophobicContact CG1-CD2 4.41Å; S74-L272 WeakPolarHBondContact O-CD2 3.38Å; A265-L272 HydrophobicContact CB-CD1 4.11Å; L272-F274 WeakPolarHBondContact CD1-O 3.47Å; L272-C275 HydrophobicContact CD1-CB 4.39Å; L272-C275 HydrophobicContact CD2-CB 4.13Å; L272-F330 HydrophobicContact CD2-CE1 3.95Å; L272-F330 HydrophobicContact CG-CE1 4.16Å
273	V	93.3	Very high	92.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-33.6	-177.7	-178.5	0	0	0	0	111.7	I266 T306 V323 L326 F330	I266-V273 HydrophobicContact CG2-CB 4.44Å; I266-V273 PolarHBondContact O-N 3.43Å; V273-T306 HydrophobicContact CB-CG2 4.44Å; V273-T306 HydrophobicContact CG1-CG2 3.78Å; V273-V323 HydrophobicContact CG2-CG1 4.07Å; V273-L326 HydrophobicContact CG1-CB 3.84Å; V273-F330 WeakPolarHBondContact O-CB 3.32Å; V273-F330 WeakPolarHBondContact O-CG 3.32Å
274	F	94.6	Very high	92.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	147.9	178.9	178.1	-97.2	0	0	0	110.2	A265 I266 L272 G276 E280 M281 F284 F285 F330 I335	A265-F274 CarbonylContact C-O 3.56Å; A265-F274 WeakPolarHBondContact CA-O 3.3Å; I266-F274 HydrophobicContact CB-CB 4.49Å; I266-F274 HydrophobicContact CD1-CB 4.5Å; I266-F274 PolarHBondContact N-O 3.23Å; L272-F274 WeakPolarHBondContact CD1-O 3.47Å; F274-G276 VanDerWaalsContact CE1-N 3.33Å; F274-E280 HydrophobicContact CZ-CB 4.24Å; F274-M281 HydrophobicContact CD1-CB 4.09Å; F274-M281 HydrophobicContact CD1-CG 3.68Å; F274-M281 HydrophobicContact CD1-SD 4.24Å; F274-M281 HydrophobicContact CE1-CB 3.38Å; F274-M281 HydrophobicContact CE1-CG 3.52Å; F274-M281 HydrophobicContact CE1-SD 4.33Å; F274-M281 HydrophobicContact CE2-CB 4.46Å; F274-M281 HydrophobicContact CG-CG 4.33Å; F274-M281 HydrophobicContact CZ-CB 3.61Å; F274-M281 HydrophobicContact CZ-CG 4.04Å; F274-F284 HydrophobicContact CD2-CB 4.09Å; F274-F284 AromaticContact CD2-CD1 3.53Å; F274-F284 HydrophobicContact CD2-CD1 3.53Å; F274-F284 HydrophobicContact CD2-CE1 4.11Å; F274-F284 AromaticContact CD2-CG 3.81Å; F274-F284 HydrophobicContact CD2-CG 3.81Å; F274-F284 HydrophobicContact CE2-CB 3.69Å; F274-F284 HydrophobicContact CE2-CD1 4.06Å; F274-F284 AromaticContact CE2-CG 3.89Å; F274-F284 HydrophobicContact CE2-CG 3.89Å; F274-F284 HydrophobicContact CG-CD1 4.44Å; F274-F285 HydrophobicContact CB-CE2 4.31Å; F274-F285 HydrophobicContact CB-CZ 4.39Å; F274-F285 HydrophobicContact CG-CE2 4.33Å; F274-F330 AromaticContact CD2-CD2 3.95Å; F274-F330 HydrophobicContact CD2-CD2 3.95Å; F274-F330 AromaticContact CD2-CE2 3.99Å; F274-F330 HydrophobicContact CD2-CE2 3.99Å; F274-F330 HydrophobicContact CE2-CE2 4.46Å; F274-I335 HydrophobicContact CE2-CD1 4.04Å
275	C	95.1	Very high	92.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.007	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	121.7	167.3	178.4	0	0	0	0	109.2	I264 A265 L272 F330 I335 I339	I264-C275 VanDerWaalsContact O-CA 3.3Å; I264-C275 WeakPolarHBondContact O-CA 3.46Å; A265-C275 HydrophobicContact CB-CB 4.25Å; L272-C275 HydrophobicContact CD1-CB 4.39Å; L272-C275 HydrophobicContact CD2-CB 4.13Å; C275-F330 HydrophobicContact CB-CZ 3.89Å; C275-I335 WeakPolarHBondContact O-CG2 3.49Å; C275-I339 HydrophobicContact CB-CD1 3.92Å; C275-I339 WeakPolarHBondContact O-CD1 3.28Å
276	G	94	Very high	92.7	Very high	4 Å²	4	28.5 Å²	28.5	4%	0.041	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176	-172	-177.6	0	0	0	0	0	113	K263 I264 F274 E280	K263-G276 CarbonylContact C-O 3.51Å; K263-G276 WeakPolarHBondContact CA-O 3.31Å; I264-G276 PolarHBondContact N-O 3.5Å; I264-G276 PolarHBondContact O-N 2.93Å; F274-G276 VanDerWaalsContact CE1-N 3.33Å; G276-E280 WeakPolarHBondContact CA-OE2 3.44Å
277	T	93.9	Very high	92.6	Very high	46 Å²	46	35.2 Å²	35.2	28%	0.282	19%	0.185	S	C	.	.			trans	-72.2	162	173.9	71.1	0	0	0	0	111.5	E279 E280 M281	T277-E279 PolarHBondContact O-N 3.48Å; T277-E280 PolarHBondContact N-OE2 3.1Å; T277-E280 PolarHBondContact O-N 3.3Å; T277-E280 WeakPolarHBondContact OG1-CB 3.46Å; T277-E280 VanDerWaalsContact OG1-CG 3.24Å; T277-E280 WeakPolarHBondContact OG1-CG 3.36Å; T277-E280 PolarHBondContact OG1-N 3.11Å; T277-E280 VanDerWaalsContact OG1-N 3.11Å; T277-M281 PolarHBondContact O-N 3.49Å
278	P	91.8	Very high	92.5	Very high	17 Å²	17	36.9 Å²	36.9	11%	0.11	20%	0.196	C	C	.	.	H	α-helix	trans	-57.8	-35.8	176	-21.5	30.6	0	0	0	113.4	F258 F261 I264 M281 L282	F258-P278 HydrophobicContact CD1-CB 4.01Å; F258-P278 HydrophobicContact CE1-CB 3.43Å; F258-P278 VanDerWaalsContact CE1-CB 3.43Å; F258-P278 HydrophobicContact CE2-CB 4.1Å; F258-P278 HydrophobicContact CZ-CB 3.48Å; F258-P278 VanDerWaalsContact CZ-CB 3.48Å; F261-P278 WeakPolarHBondContact O-CD 3.31Å; F261-P278 WeakPolarHBondContact O-CG 3.47Å; I264-P278 HydrophobicContact CD1-CB 3.88Å; I264-P278 HydrophobicContact CD1-CG 3.73Å; I264-P278 HydrophobicContact CG1-CG 4.46Å; P278-M281 WeakPolarHBondContact O-CB 3.49Å; P278-M281 PolarHBondContact O-N 3.27Å; P278-L282 PolarHBondContact O-N 3.34Å
279	E	91.4	Very high	92.6	Very high	163 Å²	163	39.4 Å²	39.4	76%	0.762	22%	0.222	S	C	*	.	H	α-helix	trans	-70.8	-44.2	176	-63	-179.7	179.5	0	0	111.9	T277 M281 L282 G283	T277-E279 PolarHBondContact O-N 3.48Å; E279-M281 PolarHBondContact O-N 3.32Å; E279-L282 PolarHBondContact O-N 2.65Å; E279-G283 PolarHBondContact O-N 2.68Å
280	E	93.4	Very high	92.8	Very high	58 Å²	58	39.1 Å²	39.1	27%	0.271	22%	0.221	S	C	.	.	H	α-helix	trans	-59.8	-35	174	-75.7	172.9	169.4	0	0	111	F274 G276 T277 G283 F284 I335 K338	F274-E280 HydrophobicContact CZ-CB 4.24Å; G276-E280 WeakPolarHBondContact CA-OE2 3.44Å; T277-E280 PolarHBondContact N-OE2 3.1Å; T277-E280 PolarHBondContact O-N 3.3Å; T277-E280 WeakPolarHBondContact OG1-CB 3.46Å; T277-E280 VanDerWaalsContact OG1-CG 3.24Å; T277-E280 WeakPolarHBondContact OG1-CG 3.36Å; T277-E280 PolarHBondContact OG1-N 3.11Å; T277-E280 VanDerWaalsContact OG1-N 3.11Å; E280-G283 PolarHBondContact O-N 3.12Å; E280-F284 VanDerWaalsContact O-CB 3.25Å; E280-F284 WeakPolarHBondContact O-CB 3.47Å; E280-F284 PolarHBondContact O-N 3.46Å; E280-I335 HydrophobicContact CB-CD1 4.33Å; E280-K338 IonicContact OE1-NZ 2.73Å
281	M	92.6	Very high	93	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-50	177	-165.9	-178	68.6	0	0	111.8	F258 I264 I266 F274 T277 P278 E279 G283 F284 F285 Y302	F258-M281 HydrophobicContact CE2-CE 3.38Å; F258-M281 HydrophobicContact CZ-CE 3.76Å; I264-M281 HydrophobicContact CB-SD 4.48Å; I264-M281 HydrophobicContact CD1-CE 4.45Å; I264-M281 HydrophobicContact CG2-SD 3.95Å; I266-M281 HydrophobicContact CD1-SD 4.03Å; F274-M281 HydrophobicContact CD1-CB 4.09Å; F274-M281 HydrophobicContact CD1-CG 3.68Å; F274-M281 HydrophobicContact CD1-SD 4.24Å; F274-M281 HydrophobicContact CE1-CB 3.38Å; F274-M281 HydrophobicContact CE1-CG 3.52Å; F274-M281 HydrophobicContact CE1-SD 4.33Å; F274-M281 HydrophobicContact CE2-CB 4.46Å; F274-M281 HydrophobicContact CG-CG 4.33Å; F274-M281 HydrophobicContact CZ-CB 3.61Å; F274-M281 HydrophobicContact CZ-CG 4.04Å; T277-M281 PolarHBondContact O-N 3.49Å; P278-M281 WeakPolarHBondContact O-CB 3.49Å; P278-M281 PolarHBondContact O-N 3.27Å; E279-M281 PolarHBondContact O-N 3.32Å; M281-G283 VanDerWaalsContact C-N 3.29Å; M281-G283 PolarHBondContact O-N 3.18Å; M281-F284 PolarHBondContact O-N 3.37Å; M281-F285 HydrophobicContact CG-CD2 3.69Å; M281-F285 HydrophobicContact CG-CE2 3.63Å; M281-F285 VanDerWaalsContact O-CD2 3.31Å; M281-F285 WeakPolarHBondContact O-CD2 3.35Å; M281-F285 PolarHBondContact O-N 3.15Å; M281-F285 HydrophobicContact SD-CE2 4.34Å; M281-Y302 HydrophobicContact CE-CD2 3.43Å; M281-Y302 VanDerWaalsContact CE-CD2 3.43Å; M281-Y302 HydrophobicContact CE-CE2 3.74Å; M281-Y302 HydrophobicContact CE-CG 4.49Å; M281-Y302 HydrophobicContact SD-CD2 4.19Å
282	L	92.4	Very high	93	Very high	58 Å²	58	43.2 Å²	43.2	30%	0.304	25%	0.25	S	C	.	.	H	α-helix	trans	-58.4	-43.8	176.3	-68.8	171.4	0	0	0	110.8	F258 P278 E279 N286 P298 Y302	F258-L282 HydrophobicContact CE1-CD1 4.06Å; F258-L282 HydrophobicContact CE1-CG 4.5Å; F258-L282 HydrophobicContact CZ-CD1 4.21Å; F258-L282 HydrophobicContact CZ-CG 4.15Å; P278-L282 PolarHBondContact O-N 3.34Å; E279-L282 PolarHBondContact O-N 2.65Å; L282-N286 VanDerWaalsContact O-CB 3.27Å; L282-N286 WeakPolarHBondContact O-CB 3.32Å; L282-N286 PolarHBondContact O-N 3.29Å; L282-N286 VanDerWaalsContact O-N 3.09Å; L282-N286 PolarHBondContact O-ND2 2.98Å; L282-N286 VanDerWaalsContact O-ND2 3.16Å; L282-P298 HydrophobicContact CD2-CB 4.33Å; L282-Y302 HydrophobicContact CD2-CE2 3.8Å; L282-Y302 WeakPolarHBondContact CD2-OH 3.36Å
283	G	93.1	Very high	92.9	Very high	31 Å²	31	45.8 Å²	45.8	32%	0.32	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-46.1	176.1	0	0	0	0	0	113.3	E279 E280 M281 N286 N287	E279-G283 PolarHBondContact O-N 2.68Å; E280-G283 PolarHBondContact O-N 3.12Å; M281-G283 VanDerWaalsContact C-N 3.29Å; M281-G283 PolarHBondContact O-N 3.18Å; G283-N286 PolarHBondContact O-N 2.75Å; G283-N287 PolarHBondContact O-N 3.35Å; G283-N287 PolarHBondContact O-ND2 3.34Å; G283-N287 PolarHBondContact O-OD1 3.07Å
284	F	94.1	Very high	92.5	Very high	12 Å²	12	54.7 Å²	54.7	5%	0.053	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-48.5	-178.6	175.7	-99.3	0	0	0	112.5	F274 E280 M281 N287 C288 A329 F330 I335	F274-F284 HydrophobicContact CD2-CB 4.09Å; F274-F284 AromaticContact CD2-CD1 3.53Å; F274-F284 HydrophobicContact CD2-CD1 3.53Å; F274-F284 HydrophobicContact CD2-CE1 4.11Å; F274-F284 AromaticContact CD2-CG 3.81Å; F274-F284 HydrophobicContact CD2-CG 3.81Å; F274-F284 HydrophobicContact CE2-CB 3.69Å; F274-F284 HydrophobicContact CE2-CD1 4.06Å; F274-F284 AromaticContact CE2-CG 3.89Å; F274-F284 HydrophobicContact CE2-CG 3.89Å; F274-F284 HydrophobicContact CG-CD1 4.44Å; E280-F284 VanDerWaalsContact O-CB 3.25Å; E280-F284 WeakPolarHBondContact O-CB 3.47Å; E280-F284 PolarHBondContact O-N 3.46Å; M281-F284 PolarHBondContact O-N 3.37Å; F284-N287 WeakPolarHBondContact O-CB 3.44Å; F284-N287 PolarHBondContact O-N 3.43Å; F284-C288 PolarHBondContact O-N 3.21Å; F284-C288 PolarHBondContact O-SG 2.95Å; F284-A329 HydrophobicContact CZ-CB 4.25Å; F284-F330 HydrophobicContact CE1-CB 4.38Å; F284-F330 HydrophobicContact CE2-CB 4.22Å; F284-F330 HydrophobicContact CE2-CD2 4.34Å; F284-F330 HydrophobicContact CZ-CB 3.68Å; F284-F330 HydrophobicContact CZ-CD2 4.29Å; F284-F330 HydrophobicContact CZ-CG 4.49Å; F284-I335 HydrophobicContact CB-CD1 4.18Å; F284-I335 HydrophobicContact CD2-CD1 4.32Å
285	F	94.3	Very high	92.1	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-70.6	-31.9	179.8	-77.1	-75.6	0	0	0	112.8	I266 F274 M281 N287 C288 G289 Y290 Y302 L305 T306 L326	I266-F285 HydrophobicContact CD1-CE2 3.93Å; I266-F285 HydrophobicContact CD1-CZ 3.94Å; F274-F285 HydrophobicContact CB-CE2 4.31Å; F274-F285 HydrophobicContact CB-CZ 4.39Å; F274-F285 HydrophobicContact CG-CE2 4.33Å; M281-F285 HydrophobicContact CG-CD2 3.69Å; M281-F285 HydrophobicContact CG-CE2 3.63Å; M281-F285 VanDerWaalsContact O-CD2 3.31Å; M281-F285 WeakPolarHBondContact O-CD2 3.35Å; M281-F285 PolarHBondContact O-N 3.15Å; M281-F285 HydrophobicContact SD-CE2 4.34Å; F285-N287 VanDerWaalsContact C-N 3.34Å; F285-C288 PolarHBondContact O-N 3.46Å; F285-G289 PolarHBondContact O-N 3.21Å; F285-Y290 CarbonylContact O-C 3.58Å; F285-Y290 PolarHBondContact O-N 3.3Å; F285-Y302 HydrophobicContact CB-CD1 3.85Å; F285-Y302 HydrophobicContact CB-CE1 3.23Å; F285-Y302 AromaticContact CD1-CD1 3.82Å; F285-Y302 HydrophobicContact CD1-CD1 3.82Å; F285-Y302 HydrophobicContact CD1-CE1 4.09Å; F285-Y302 AromaticContact CD2-CD1 3.61Å; F285-Y302 HydrophobicContact CD2-CD1 3.61Å; F285-Y302 HydrophobicContact CD2-CD2 4.27Å; F285-Y302 AromaticContact CD2-CE1 3.75Å; F285-Y302 HydrophobicContact CD2-CE1 3.75Å; F285-Y302 HydrophobicContact CD2-CE2 4.38Å; F285-Y302 AromaticContact CD2-CG 3.9Å; F285-Y302 HydrophobicContact CD2-CG 3.9Å; F285-Y302 HydrophobicContact CE1-CD1 4.26Å; F285-Y302 HydrophobicContact CE2-CD1 4.08Å; F285-Y302 HydrophobicContact CE2-CG 4.07Å; F285-Y302 AromaticContact CG-CD1 3.48Å; F285-Y302 HydrophobicContact CG-CD1 3.48Å; F285-Y302 VanDerWaalsContact CG-CD1 3.48Å; F285-Y302 AromaticContact CG-CE1 3.43Å; F285-Y302 HydrophobicContact CG-CE1 3.43Å; F285-Y302 VanDerWaalsContact CG-CE1 3.43Å; F285-Y302 HydrophobicContact CG-CG 4.25Å; F285-Y302 HydrophobicContact CZ-CD1 4.39Å; F285-L305 HydrophobicContact CD1-CD2 3.85Å; F285-L305 HydrophobicContact CE1-CD2 4.1Å; F285-T306 HydrophobicContact CE1-CG2 3.96Å; F285-T306 HydrophobicContact CZ-CG2 3.87Å; F285-L326 HydrophobicContact CD1-CD2 4.36Å; F285-L326 HydrophobicContact CE1-CD1 4.31Å; F285-L326 HydrophobicContact CE1-CD2 4.26Å
286	N	93.4	Very high	91.8	Very high	78 Å²	78	65.9 Å²	65.9	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-60.1	-44.6	169.1	-74.9	-15.5	0	0	0	111.2	L282 G283 C288 G289 P291	L282-N286 VanDerWaalsContact O-CB 3.27Å; L282-N286 WeakPolarHBondContact O-CB 3.32Å; L282-N286 PolarHBondContact O-N 3.29Å; L282-N286 VanDerWaalsContact O-N 3.09Å; L282-N286 PolarHBondContact O-ND2 2.98Å; L282-N286 VanDerWaalsContact O-ND2 3.16Å; G283-N286 PolarHBondContact O-N 2.75Å; N286-C288 VanDerWaalsContact C-N 3.29Å; N286-C288 PolarHBondContact O-N 3.48Å; N286-G289 PolarHBondContact O-N 3.09Å; N286-P291 WeakPolarHBondContact OD1-CA 3.28Å; N286-P291 VanDerWaalsContact OD1-CB 3.26Å; N286-P291 WeakPolarHBondContact OD1-CB 3.13Å
287	N	92.8	Very high	91.6	Very high	145 Å²	145	67 Å²	67	78%	0.775	37%	0.371	S	S	*	.	H	α-helix	trans	-65.4	-32.1	177.3	-68.4	-16.8	0	0	0	112.6	G283 F284 F285 G289	G283-N287 PolarHBondContact O-N 3.35Å; G283-N287 PolarHBondContact O-ND2 3.34Å; G283-N287 PolarHBondContact O-OD1 3.07Å; F284-N287 WeakPolarHBondContact O-CB 3.44Å; F284-N287 PolarHBondContact O-N 3.43Å; F285-N287 VanDerWaalsContact C-N 3.34Å; N287-G289 PolarHBondContact O-N 3Å
288	C	91.7	Very high	91.4	Very high	36 Å²	36	65.9 Å²	65.9	24%	0.243	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-1.7	172.7	-63.2	0	0	0	0	113.5	F284 F285 N286 Y290 L326	F284-C288 PolarHBondContact O-N 3.21Å; F284-C288 PolarHBondContact O-SG 2.95Å; F285-C288 PolarHBondContact O-N 3.46Å; N286-C288 VanDerWaalsContact C-N 3.29Å; N286-C288 PolarHBondContact O-N 3.48Å; C288-Y290 HydrophobicContact CB-CD2 4.38Å; C288-L326 HydrophobicContact CB-CD2 3.82Å
289	G	91.8	Very high	91.2	Very high	53 Å²	53	65.1 Å²	65.1	55%	0.546	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	12.9	177.8	0	0	0	0	0	115.2	F285 N286 N287 P291	F285-G289 PolarHBondContact O-N 3.21Å; N286-G289 PolarHBondContact O-N 3.09Å; N287-G289 PolarHBondContact O-N 3Å; G289-P291 VanDerWaalsContact C-CD 3.47Å; G289-P291 WeakPolarHBondContact O-CD 3.32Å
290	Y	92.1	Very high	91.1	Very high	83 Å²	83	60.1 Å²	60.1	33%	0.325	34%	0.338	S	S	.	.			trans	-120.7	73.8	-178.8	-62.2	-69.6	0	0	0	112.1	F285 C288 L305 L326	F285-Y290 CarbonylContact O-C 3.58Å; F285-Y290 PolarHBondContact O-N 3.3Å; C288-Y290 HydrophobicContact CB-CD2 4.38Å; Y290-L305 HydrophobicContact CD1-CD1 3.8Å; Y290-L305 HydrophobicContact CD1-CD2 4.39Å; Y290-L305 HydrophobicContact CD2-CD1 4.29Å; Y290-L305 HydrophobicContact CD2-CD2 3.9Å; Y290-L305 HydrophobicContact CE1-CD1 4.07Å; Y290-L305 HydrophobicContact CG-CD1 3.92Å; Y290-L305 HydrophobicContact CG-CD2 3.69Å; Y290-L305 HydrophobicContact CG-CG 4.44Å; Y290-L326 HydrophobicContact CD2-CD2 4.23Å; Y290-L326 HydrophobicContact CE2-CD2 4.32Å
291	P	93.1	Very high	91	Very high	79 Å²	79	60.1 Å²	60.1	51%	0.513	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-71	139.4	178	30.1	-34.8	0	0	0	112.5	N286 G289	N286-P291 WeakPolarHBondContact OD1-CA 3.28Å; N286-P291 VanDerWaalsContact OD1-CB 3.26Å; N286-P291 WeakPolarHBondContact OD1-CB 3.13Å; G289-P291 VanDerWaalsContact C-CD 3.47Å; G289-P291 WeakPolarHBondContact O-CD 3.32Å
292	C	89.9	Confident	91	Very high	30 Å²	30	60.1 Å²	60.1	20%	0.203	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-74.6	128.3	174.7	-175.3	0	0	0	0	110.7	F301 Y302	C292-F301 HydrophobicContact CB-CD1 3.95Å; C292-F301 HydrophobicContact CB-CE1 4.31Å; C292-Y302 HydrophobicContact CB-CE1 4.48Å; C292-Y302 HydrophobicContact CB-CE2 4.3Å; C292-Y302 WeakPolarHBondContact CB-OH 3.48Å
293	P	91.8	Very high	90.8	Very high	67 Å²	67	57.8 Å²	57.8	44%	0.435	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-62.8	146.6	171	-18.9	30.7	0	0	0	112.1	H295 S296 F301	P293-H295 VanDerWaalsContact C-N 3.29Å; P293-H295 PolarHBondContact O-N 3.41Å; P293-S296 PolarHBondContact O-N 2.75Å; P293-S296 VanDerWaalsContact O-N 3.09Å; P293-F301 HydrophobicContact CG-CE2 4.5Å
294	E	85.2	Confident	90.6	Very high	186 Å²	186	61.2 Å²	61.2	87%	0.869	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.3	-175.1	-66.1	-171.5	167.3	0	0	114.4
295	H	86.8	Confident	90.5	Very high	188 Å²	188	61.3 Å²	61.3	87%	0.87	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	12.9	-179.3	-58.3	-42	0	0	0	113.5	P293	P293-H295 VanDerWaalsContact C-N 3.29Å; P293-H295 PolarHBondContact O-N 3.41Å
296	S	88.4	Confident	90.4	Very high	49 Å²	49	61.4 Å²	61.4	34%	0.343	34%	0.337	S	S	.	.	S	Bend	trans	-103.9	143.3	175.8	-62.2	0	0	0	0	110.2	P293 P298	P293-S296 PolarHBondContact O-N 2.75Å; P293-S296 VanDerWaalsContact O-N 3.09Å; S296-P298 VanDerWaalsContact O-CD 3.31Å; S296-P298 WeakPolarHBondContact O-CD 3.44Å
297	N	89	Confident	90.1	Very high	26 Å²	26	59.1 Å²	59.1	14%	0.139	33%	0.328	C	S	.	.			trans	-67.7	117.3	170	178.5	4.8	0	0	0	108	P253 S255 F299 D300 F301	P253-N297 PolarHBondContact O-ND2 3.42Å; S255-N297 WeakPolarHBondContact CA-OD1 3.45Å; S255-N297 WeakPolarHBondContact CB-OD1 3.43Å; S255-N297 PolarHBondContact N-ND2 2.9Å; N297-F299 PolarHBondContact O-N 3.09Å; N297-F299 PolarHBondContact OD1-N 2.69Å; N297-D300 HydrophobicContact CB-CB 4.1Å; N297-D300 WeakPolarHBondContact CB-OD2 3.39Å; N297-D300 PolarHBondContact ND2-OD1 3.16Å; N297-D300 PolarHBondContact ND2-OD2 2.92Å; N297-D300 PolarHBondContact O-N 3.07Å; N297-D300 VanDerWaalsContact O-N 3.14Å; N297-F301 WeakPolarHBondContact O-CB 3.36Å; N297-F301 PolarHBondContact O-N 3.02Å
298	P	90.5	Very high	89.9	Confident	23 Å²	23	52.9 Å²	52.9	15%	0.149	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-34.5	-178.1	22.5	-33.7	0	0	0	111.9	F258 L282 S296 Y302	F258-P298 HydrophobicContact CD1-CG 4.48Å; F258-P298 HydrophobicContact CD2-CB 4.44Å; F258-P298 HydrophobicContact CD2-CG 3.81Å; F258-P298 HydrophobicContact CE2-CB 4.1Å; F258-P298 HydrophobicContact CE2-CG 3.93Å; F258-P298 HydrophobicContact CG-CG 4.11Å; F258-P298 HydrophobicContact CZ-CB 4.41Å; F258-P298 HydrophobicContact CZ-CG 4.31Å; L282-P298 HydrophobicContact CD2-CB 4.33Å; S296-P298 VanDerWaalsContact O-CD 3.31Å; S296-P298 WeakPolarHBondContact O-CD 3.44Å; P298-Y302 HydrophobicContact CB-CD2 4.3Å; P298-Y302 HydrophobicContact CB-CE2 4.04Å; P298-Y302 WeakPolarHBondContact O-CD2 3.5Å; P298-Y302 PolarHBondContact O-N 2.63Å
299	F	87.3	Confident	89.7	Confident	2 Å²	2	53 Å²	53	1%	0.009	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-48.3	176.8	-73.1	-58.4	0	0	0	113.1	L86 P253 F258 F261 I264 N297 M303	L86-F299 HydrophobicContact CD1-CD1 3.34Å; L86-F299 HydrophobicContact CD1-CE1 3.6Å; L86-F299 HydrophobicContact CD1-CG 4.43Å; P253-F299 HydrophobicContact CB-CD2 3.97Å; P253-F299 HydrophobicContact CB-CE2 4Å; P253-F299 HydrophobicContact CB-CG 4.4Å; P253-F299 HydrophobicContact CG-CB 3.64Å; P253-F299 HydrophobicContact CG-CD1 3.77Å; P253-F299 HydrophobicContact CG-CD2 3.42Å; P253-F299 VanDerWaalsContact CG-CD2 3.42Å; P253-F299 HydrophobicContact CG-CE1 4.11Å; P253-F299 HydrophobicContact CG-CE2 3.75Å; P253-F299 HydrophobicContact CG-CG 3.37Å; P253-F299 HydrophobicContact CG-CZ 4.08Å; F258-F299 HydrophobicContact CB-CD2 4.21Å; F258-F299 HydrophobicContact CB-CE2 3.57Å; F258-F299 HydrophobicContact CB-CZ 4.04Å; F258-F299 HydrophobicContact CD2-CD1 4.01Å; F258-F299 AromaticContact CD2-CD2 3.88Å; F258-F299 HydrophobicContact CD2-CD2 3.88Å; F258-F299 AromaticContact CD2-CE1 3.68Å; F258-F299 HydrophobicContact CD2-CE1 3.68Å; F258-F299 AromaticContact CD2-CE2 3.57Å; F258-F299 HydrophobicContact CD2-CE2 3.57Å; F258-F299 HydrophobicContact CD2-CG 4.12Å; F258-F299 AromaticContact CD2-CZ 3.46Å; F258-F299 HydrophobicContact CD2-CZ 3.46Å; F258-F299 VanDerWaalsContact CD2-CZ 3.46Å; F258-F299 HydrophobicContact CE2-CD1 4.37Å; F258-F299 HydrophobicContact CE2-CE1 4.14Å; F258-F299 HydrophobicContact CE2-CZ 4.33Å; F258-F299 HydrophobicContact CG-CE2 4.08Å; F258-F299 HydrophobicContact CG-CZ 4.19Å; F261-F299 AromaticContact CD2-CZ 3.78Å; F261-F299 HydrophobicContact CD2-CZ 3.78Å; F261-F299 AromaticContact CE2-CZ 3.99Å; F261-F299 HydrophobicContact CE2-CZ 3.99Å; I264-F299 HydrophobicContact CD1-CE1 3.59Å; I264-F299 HydrophobicContact CD1-CZ 4.05Å; I264-F299 HydrophobicContact CG1-CE1 4.19Å; I264-F299 HydrophobicContact CG2-CE1 4.41Å; N297-F299 PolarHBondContact O-N 3.09Å; N297-F299 PolarHBondContact OD1-N 2.69Å; F299-M303 WeakPolarHBondContact O-CB 3.44Å; F299-M303 PolarHBondContact O-N 2.96Å
300	D	88.7	Confident	89.5	Confident	57 Å²	57	54.7 Å²	54.7	31%	0.305	29%	0.293	S	S	.	.	H	α-helix	trans	-67.6	-42.8	-178.5	-62.5	-25.1	0	0	0	109.7	N297 M303 D304	N297-D300 HydrophobicContact CB-CB 4.1Å; N297-D300 WeakPolarHBondContact CB-OD2 3.39Å; N297-D300 PolarHBondContact ND2-OD1 3.16Å; N297-D300 PolarHBondContact ND2-OD2 2.92Å; N297-D300 PolarHBondContact O-N 3.07Å; N297-D300 VanDerWaalsContact O-N 3.14Å; D300-M303 PolarHBondContact O-N 3.24Å; D300-D304 WeakPolarHBondContact O-CB 3.04Å; D300-D304 VanDerWaalsContact O-CG 3.31Å; D300-D304 PolarHBondContact O-N 3.07Å
301	F	91.9	Very high	89.3	Confident	58 Å²	58	58.2 Å²	58.2	25%	0.254	31%	0.312	S	S	.	.	H	α-helix	trans	-59.8	-50.9	178.9	-179.3	-99.9	0	0	0	112.6	C292 P293 N297 M303 D304 L305	C292-F301 HydrophobicContact CB-CD1 3.95Å; C292-F301 HydrophobicContact CB-CE1 4.31Å; P293-F301 HydrophobicContact CG-CE2 4.5Å; N297-F301 WeakPolarHBondContact O-CB 3.36Å; N297-F301 PolarHBondContact O-N 3.02Å; F301-M303 VanDerWaalsContact C-N 3.32Å; F301-M303 PolarHBondContact O-N 3.13Å; F301-D304 PolarHBondContact O-N 3.39Å; F301-L305 WeakPolarHBondContact O-CB 3.38Å; F301-L305 PolarHBondContact O-N 3.44Å
302	Y	91.9	Very high	89.2	Confident	1 Å²	1	56.5 Å²	56.5	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-71.5	-29	178.9	-63.8	-51.8	0	0	0	112.3	M281 L282 F285 C292 P298 L305 T306	M281-Y302 HydrophobicContact CE-CD2 3.43Å; M281-Y302 VanDerWaalsContact CE-CD2 3.43Å; M281-Y302 HydrophobicContact CE-CE2 3.74Å; M281-Y302 HydrophobicContact CE-CG 4.49Å; M281-Y302 HydrophobicContact SD-CD2 4.19Å; L282-Y302 HydrophobicContact CD2-CE2 3.8Å; L282-Y302 WeakPolarHBondContact CD2-OH 3.36Å; F285-Y302 HydrophobicContact CB-CD1 3.85Å; F285-Y302 HydrophobicContact CB-CE1 3.23Å; F285-Y302 AromaticContact CD1-CD1 3.82Å; F285-Y302 HydrophobicContact CD1-CD1 3.82Å; F285-Y302 HydrophobicContact CD1-CE1 4.09Å; F285-Y302 AromaticContact CD2-CD1 3.61Å; F285-Y302 HydrophobicContact CD2-CD1 3.61Å; F285-Y302 HydrophobicContact CD2-CD2 4.27Å; F285-Y302 AromaticContact CD2-CE1 3.75Å; F285-Y302 HydrophobicContact CD2-CE1 3.75Å; F285-Y302 HydrophobicContact CD2-CE2 4.38Å; F285-Y302 AromaticContact CD2-CG 3.9Å; F285-Y302 HydrophobicContact CD2-CG 3.9Å; F285-Y302 HydrophobicContact CE1-CD1 4.26Å; F285-Y302 HydrophobicContact CE2-CD1 4.08Å; F285-Y302 HydrophobicContact CE2-CG 4.07Å; F285-Y302 AromaticContact CG-CD1 3.48Å; F285-Y302 HydrophobicContact CG-CD1 3.48Å; F285-Y302 VanDerWaalsContact CG-CD1 3.48Å; F285-Y302 AromaticContact CG-CE1 3.43Å; F285-Y302 HydrophobicContact CG-CE1 3.43Å; F285-Y302 VanDerWaalsContact CG-CE1 3.43Å; F285-Y302 HydrophobicContact CG-CG 4.25Å; F285-Y302 HydrophobicContact CZ-CD1 4.39Å; C292-Y302 HydrophobicContact CB-CE1 4.48Å; C292-Y302 HydrophobicContact CB-CE2 4.3Å; C292-Y302 WeakPolarHBondContact CB-OH 3.48Å; P298-Y302 HydrophobicContact CB-CD2 4.3Å; P298-Y302 HydrophobicContact CB-CE2 4.04Å; P298-Y302 WeakPolarHBondContact O-CD2 3.5Å; P298-Y302 PolarHBondContact O-N 2.63Å; Y302-L305 HydrophobicContact CD1-CD2 4.33Å; Y302-T306 WeakPolarHBondContact O-CB 3.4Å; Y302-T306 VanDerWaalsContact O-CG2 3.25Å; Y302-T306 WeakPolarHBondContact O-CG2 3.3Å; Y302-T306 PolarHBondContact O-N 3.47Å; Y302-T306 PolarHBondContact O-OG1 2.84Å
303	M	89.3	Confident	89.2	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.049	33%	0.328	C	S	.	.	H	α-helix	trans	-65.8	-43.6	172.6	-168.7	177.5	-47.2	0	0	111.5	L86 Q252 F299 D300 F301 T306 S307	L86-M303 HydrophobicContact CB-CE 4.41Å; L86-M303 HydrophobicContact CD2-CE 4.1Å; Q252-M303 HydrophobicContact CG-CE 4.23Å; Q252-M303 HydrophobicContact CG-SD 3.81Å; F299-M303 WeakPolarHBondContact O-CB 3.44Å; F299-M303 PolarHBondContact O-N 2.96Å; D300-M303 PolarHBondContact O-N 3.24Å; F301-M303 VanDerWaalsContact C-N 3.32Å; F301-M303 PolarHBondContact O-N 3.13Å; M303-T306 PolarHBondContact O-N 3.26Å; M303-T306 PolarHBondContact O-OG1 3.49Å; M303-S307 VanDerWaalsContact O-CB 3.31Å; M303-S307 WeakPolarHBondContact O-CB 3.35Å; M303-S307 PolarHBondContact O-N 3.09Å
304	D	89.1	Confident	89.3	Confident	103 Å²	103	69.2 Å²	69.2	55%	0.551	34%	0.344	S	S	*	.	H	α-helix	trans	-63.9	-43.4	176.1	-73.2	-14.7	0	0	0	111.1	D300 F301 T306 S307 R322	D300-D304 WeakPolarHBondContact O-CB 3.04Å; D300-D304 VanDerWaalsContact O-CG 3.31Å; D300-D304 PolarHBondContact O-N 3.07Å; F301-D304 PolarHBondContact O-N 3.39Å; D304-T306 PolarHBondContact O-N 3.44Å; D304-S307 PolarHBondContact O-N 2.89Å; D304-S307 PolarHBondContact O-OG 2.83Å; D304-R322 PolarHBondContact O-NH2 3.21Å
305	L	91.8	Very high	89.5	Confident	14 Å²	14	66.3 Å²	66.3	7%	0.073	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-41.2	177.5	-174.5	70.7	0	0	0	112.5	F285 Y290 F301 Y302 S307 R322 L326	F285-L305 HydrophobicContact CD1-CD2 3.85Å; F285-L305 HydrophobicContact CE1-CD2 4.1Å; Y290-L305 HydrophobicContact CD1-CD1 3.8Å; Y290-L305 HydrophobicContact CD1-CD2 4.39Å; Y290-L305 HydrophobicContact CD2-CD1 4.29Å; Y290-L305 HydrophobicContact CD2-CD2 3.9Å; Y290-L305 HydrophobicContact CE1-CD1 4.07Å; Y290-L305 HydrophobicContact CG-CD1 3.92Å; Y290-L305 HydrophobicContact CG-CD2 3.69Å; Y290-L305 HydrophobicContact CG-CG 4.44Å; F301-L305 WeakPolarHBondContact O-CB 3.38Å; F301-L305 PolarHBondContact O-N 3.44Å; Y302-L305 HydrophobicContact CD1-CD2 4.33Å; L305-S307 VanDerWaalsContact C-N 3.34Å; L305-R322 PolarHBondContact O-NE 3.25Å; L305-R322 PolarHBondContact O-NH2 3.42Å; L305-L326 HydrophobicContact CD2-CD1 4.39Å; L305-L326 HydrophobicContact CG-CD1 4.29Å
306	T	90.9	Very high	89.7	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-85.6	-4.6	-178.7	56.9	0	0	0	0	113.3	I266 T268 V273 F285 Y302 M303 D304 V323 L326	I266-T306 HydrophobicContact CD1-CG2 4.46Å; I266-T306 HydrophobicContact CG2-CG2 4.01Å; I266-T306 WeakPolarHBondContact CG2-OG1 3.41Å; T268-T306 WeakPolarHBondContact CB-O 3.33Å; T268-T306 WeakPolarHBondContact CG2-O 3.37Å; T268-T306 PolarHBondContact OG1-O 3.48Å; V273-T306 HydrophobicContact CB-CG2 4.44Å; V273-T306 HydrophobicContact CG1-CG2 3.78Å; F285-T306 HydrophobicContact CE1-CG2 3.96Å; F285-T306 HydrophobicContact CZ-CG2 3.87Å; Y302-T306 WeakPolarHBondContact O-CB 3.4Å; Y302-T306 VanDerWaalsContact O-CG2 3.25Å; Y302-T306 WeakPolarHBondContact O-CG2 3.3Å; Y302-T306 PolarHBondContact O-N 3.47Å; Y302-T306 PolarHBondContact O-OG1 2.84Å; M303-T306 PolarHBondContact O-N 3.26Å; M303-T306 PolarHBondContact O-OG1 3.49Å; D304-T306 PolarHBondContact O-N 3.44Å; T306-V323 VanDerWaalsContact O-CG2 3.24Å; T306-V323 WeakPolarHBondContact O-CG2 3.33Å; T306-L326 HydrophobicContact CG2-CD1 4.35Å
307	S	88.9	Confident	89.9	Confident	31 Å²	31	64.1 Å²	64.1	22%	0.217	31%	0.313	C	S	.	.	S	Bend	trans	-85	150.6	175.2	75.2	0	0	0	0	112.4	M303 D304 L305 R322	M303-S307 VanDerWaalsContact O-CB 3.31Å; M303-S307 WeakPolarHBondContact O-CB 3.35Å; M303-S307 PolarHBondContact O-N 3.09Å; D304-S307 PolarHBondContact O-N 2.89Å; D304-S307 PolarHBondContact O-OG 2.83Å; L305-S307 VanDerWaalsContact C-N 3.34Å; S307-R322 PolarHBondContact O-NH2 2.75Å
308	V	88.4	Confident	90.1	Very high	14 Å²	14	69.4 Å²	69.4	9%	0.085	34%	0.336	C	S	.	.			trans	-99.4	122.6	171.9	-173.5	0	0	0	0	108.3	T268 Y269 E316 T319 Y320 V323	T268-V308 HydrophobicContact CG2-CG2 4.2Å; Y269-V308 HydrophobicContact CD2-CB 4.27Å; Y269-V308 HydrophobicContact CD2-CG2 3.68Å; Y269-V308 HydrophobicContact CE2-CB 3.45Å; Y269-V308 VanDerWaalsContact CE2-CB 3.45Å; Y269-V308 HydrophobicContact CE2-CG1 4.38Å; Y269-V308 HydrophobicContact CE2-CG2 3.38Å; V308-E316 HydrophobicContact CG1-CG 4.03Å; V308-T319 WeakPolarHBondContact CA-OG1 3.2Å; V308-T319 VanDerWaalsContact CG1-OG1 3.3Å; V308-T319 WeakPolarHBondContact CG1-OG1 3.22Å; V308-Y320 HydrophobicContact CG2-CD2 4.2Å; V308-V323 HydrophobicContact CG2-CG2 4.06Å
309	D	85.7	Confident	90.1	Very high	38 Å²	38	69 Å²	69	20%	0.203	33%	0.333	C	S	.	.			trans	-83.8	115.8	-179.7	-177.2	6.1	0	0	0	110.1	Q311 R315 E316 T319	D309-Q311 VanDerWaalsContact OD1-CB 3.22Å; D309-Q311 WeakPolarHBondContact OD1-CB 3.2Å; D309-Q311 WeakPolarHBondContact OD1-CG 2.98Å; D309-Q311 PolarHBondContact OD1-N 3.28Å; D309-R315 HydrophobicContact CB-CB 4.42Å; D309-R315 VanDerWaalsContact OD2-CD 3.26Å; D309-R315 WeakPolarHBondContact OD2-CD 3.28Å; D309-R315 IonicContact OD2-NH1 3.99Å; D309-R315 PolarHBondContact OD2-NH1 3.43Å; D309-E316 WeakPolarHBondContact O-CA 3.28Å; D309-E316 WeakPolarHBondContact O-CB 3.29Å; D309-E316 PolarHBondContact O-N 2.94Å; D309-T319 HydrophobicContact CB-CG2 4.17Å; D309-T319 PolarHBondContact N-OG1 3.08Å
310	T	87.7	Confident	90.3	Very high	89 Å²	89	73.3 Å²	73.3	55%	0.546	35%	0.35	S	S	.	.			trans	-94.4	6.3	-180	53.6	0	0	0	0	113.3	S312 E316	T310-S312 VanDerWaalsContact C-N 3.29Å; T310-S312 PolarHBondContact O-N 3.32Å; T310-E316 HydrophobicContact CG2-CG 4.49Å
311	Q	88.8	Confident	90.5	Very high	156 Å²	156	77 Å²	77	73%	0.729	36%	0.363	S	S	*	.	S	Bend	trans	-62.9	-33.8	-179.2	-74.1	176.6	17.4	0	0	113.4	D309	D309-Q311 VanDerWaalsContact OD1-CB 3.22Å; D309-Q311 WeakPolarHBondContact OD1-CB 3.2Å; D309-Q311 WeakPolarHBondContact OD1-CG 2.98Å; D309-Q311 PolarHBondContact OD1-N 3.28Å
312	S	90.9	Very high	90.5	Very high	44 Å²	44	77 Å²	77	31%	0.308	36%	0.362	S	S	.	.	S	Bend	trans	-143.1	144.6	176.2	67.5	0	0	0	0	109.8	T310 E314 R315 E316	T310-S312 VanDerWaalsContact C-N 3.29Å; T310-S312 PolarHBondContact O-N 3.32Å; S312-E314 PolarHBondContact O-N 2.83Å; S312-R315 PolarHBondContact O-N 3.28Å; S312-R315 WeakPolarHBondContact OG-CB 3.34Å; S312-R315 VanDerWaalsContact OG-CG 3.27Å; S312-R315 WeakPolarHBondContact OG-CG 3.46Å; S312-R315 PolarHBondContact OG-N 3.06Å; S312-E316 WeakPolarHBondContact O-CB 3.34Å; S312-E316 PolarHBondContact O-N 2.9Å
313	R	91	Very high	90.5	Very high	199 Å²	199	77.1 Å²	77.1	75%	0.751	36%	0.362	S	S	*	.	H	α-helix	trans	-59.1	-34.3	-178.8	-172.1	176.7	-179.4	-179.9	-0	112.6	E316 I317	R313-E316 PolarHBondContact O-N 3.32Å; R313-I317 HydrophobicContact CG-CD1 4.13Å; R313-I317 WeakPolarHBondContact O-CD1 3.14Å; R313-I317 VanDerWaalsContact O-CG1 3.26Å; R313-I317 WeakPolarHBondContact O-CG1 3.44Å; R313-I317 PolarHBondContact O-N 3.3Å; R313-I317 VanDerWaalsContact O-N 3.1Å
314	E	93	Very high	90.6	Very high	165 Å²	165	81.2 Å²	81.2	77%	0.771	38%	0.381	S	S	*	.	H	α-helix	trans	-65.2	-49.5	177.1	-68.2	174.6	-177.1	0	0	111.2	S312 E316 I317 E318	S312-E314 PolarHBondContact O-N 2.83Å; E314-E316 VanDerWaalsContact C-N 3.32Å; E314-E316 PolarHBondContact O-N 3.22Å; E314-I317 PolarHBondContact O-N 3.01Å; E314-E318 PolarHBondContact O-N 3.36Å
315	R	90.5	Very high	90.8	Very high	124 Å²	124	81.4 Å²	81.4	47%	0.468	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-35.4	175.1	-71.1	-174	-178.4	-179	0.6	112.6	D309 S312 E318 T319	D309-R315 HydrophobicContact CB-CB 4.42Å; D309-R315 VanDerWaalsContact OD2-CD 3.26Å; D309-R315 WeakPolarHBondContact OD2-CD 3.28Å; D309-R315 IonicContact OD2-NH1 3.99Å; D309-R315 PolarHBondContact OD2-NH1 3.43Å; S312-R315 PolarHBondContact O-N 3.28Å; S312-R315 WeakPolarHBondContact OG-CB 3.34Å; S312-R315 VanDerWaalsContact OG-CG 3.27Å; S312-R315 WeakPolarHBondContact OG-CG 3.46Å; S312-R315 PolarHBondContact OG-N 3.06Å; R315-E318 PolarHBondContact O-N 3.18Å; R315-T319 VanDerWaalsContact O-CB 3.31Å; R315-T319 WeakPolarHBondContact O-CB 3.43Å; R315-T319 VanDerWaalsContact O-CG2 3.29Å; R315-T319 WeakPolarHBondContact O-CG2 3.44Å; R315-T319 PolarHBondContact O-N 3.33Å; R315-T319 PolarHBondContact O-OG1 3.42Å
316	E	90.6	Very high	90.9	Very high	84 Å²	84	81 Å²	81	39%	0.393	38%	0.378	S	S	.	.	H	α-helix	trans	-60.1	-48.2	176.7	-173.8	-176.1	-178.3	0	0	110.4	V308 D309 T310 S312 R313 E314 T319 Y320	V308-E316 HydrophobicContact CG1-CG 4.03Å; D309-E316 WeakPolarHBondContact O-CA 3.28Å; D309-E316 WeakPolarHBondContact O-CB 3.29Å; D309-E316 PolarHBondContact O-N 2.94Å; T310-E316 HydrophobicContact CG2-CG 4.49Å; S312-E316 WeakPolarHBondContact O-CB 3.34Å; S312-E316 PolarHBondContact O-N 2.9Å; R313-E316 PolarHBondContact O-N 3.32Å; E314-E316 VanDerWaalsContact C-N 3.32Å; E314-E316 PolarHBondContact O-N 3.22Å; E316-T319 PolarHBondContact O-OG1 2.89Å; E316-Y320 WeakPolarHBondContact O-CB 3.25Å; E316-Y320 PolarHBondContact O-N 3.1Å
317	I	92.4	Very high	90.9	Very high	108 Å²	108	81.8 Å²	81.8	55%	0.554	38%	0.382	S	S	*	.	H	α-helix	trans	-64.2	-43.8	178.3	-66.1	164.8	0	0	0	111.1	R313 E314 K321	R313-I317 HydrophobicContact CG-CD1 4.13Å; R313-I317 WeakPolarHBondContact O-CD1 3.14Å; R313-I317 VanDerWaalsContact O-CG1 3.26Å; R313-I317 WeakPolarHBondContact O-CG1 3.44Å; R313-I317 PolarHBondContact O-N 3.3Å; R313-I317 VanDerWaalsContact O-N 3.1Å; E314-I317 PolarHBondContact O-N 3.01Å; I317-K321 WeakPolarHBondContact O-CB 3.3Å; I317-K321 PolarHBondContact O-N 3.15Å
318	E	92.6	Very high	91.1	Very high	137 Å²	137	82.8 Å²	82.8	64%	0.64	39%	0.388	S	S	*	.	H	α-helix	trans	-63	-51.2	179.1	-175.6	-174.4	175.4	0	0	112	E314 R315 K321 R322	E314-E318 PolarHBondContact O-N 3.36Å; R315-E318 PolarHBondContact O-N 3.18Å; E318-K321 PolarHBondContact O-N 2.96Å; E318-R322 PolarHBondContact O-N 3.4Å
319	T	91.6	Very high	91.4	Very high	13 Å²	13	83.8 Å²	83.8	8%	0.08	40%	0.398	C	S	.	.	H	α-helix	trans	-69.5	-35.7	-178.2	55.8	0	0	0	0	111.7	V308 D309 R315 E316 R322 V323	V308-T319 WeakPolarHBondContact CA-OG1 3.2Å; V308-T319 VanDerWaalsContact CG1-OG1 3.3Å; V308-T319 WeakPolarHBondContact CG1-OG1 3.22Å; D309-T319 HydrophobicContact CB-CG2 4.17Å; D309-T319 PolarHBondContact N-OG1 3.08Å; R315-T319 VanDerWaalsContact O-CB 3.31Å; R315-T319 WeakPolarHBondContact O-CB 3.43Å; R315-T319 VanDerWaalsContact O-CG2 3.29Å; R315-T319 WeakPolarHBondContact O-CG2 3.44Å; R315-T319 PolarHBondContact O-N 3.33Å; R315-T319 PolarHBondContact O-OG1 3.42Å; E316-T319 PolarHBondContact O-OG1 2.89Å; T319-R322 WeakPolarHBondContact O-CB 3.44Å; T319-R322 PolarHBondContact O-N 3.33Å; T319-V323 WeakPolarHBondContact O-CG2 3.37Å; T319-V323 PolarHBondContact O-N 2.96Å
320	Y	90.8	Very high	91.8	Very high	94 Å²	94	82 Å²	82	37%	0.369	39%	0.388	S	S	.	.	H	α-helix	trans	-61.6	-45.6	172.9	-173.2	-100.7	0	0	0	111.4	V308 E316 R322 V323 Q324	V308-Y320 HydrophobicContact CG2-CD2 4.2Å; E316-Y320 WeakPolarHBondContact O-CB 3.25Å; E316-Y320 PolarHBondContact O-N 3.1Å; Y320-R322 VanDerWaalsContact C-N 3.3Å; Y320-R322 PolarHBondContact O-N 3.37Å; Y320-V323 PolarHBondContact O-N 3.25Å; Y320-Q324 PolarHBondContact O-N 2.87Å
321	K	92.7	Very high	92	Very high	133 Å²	133	81 Å²	81	58%	0.578	38%	0.376	S	S	*	.	H	α-helix	trans	-60.4	-40.1	175.2	-175.3	177.5	180	-177.6	0	111.8	I317 E318 Q324 M325	I317-K321 WeakPolarHBondContact O-CB 3.3Å; I317-K321 PolarHBondContact O-N 3.15Å; E318-K321 PolarHBondContact O-N 2.96Å; K321-Q324 PolarHBondContact O-N 3.06Å; K321-M325 WeakPolarHBondContact O-CG 3.02Å; K321-M325 PolarHBondContact O-N 3.01Å; K321-M325 VanDerWaalsContact O-N 3.07Å
322	R	92.3	Very high	92.2	Very high	60 Å²	60	81 Å²	81	23%	0.226	38%	0.376	C	S	.	.	H	α-helix	trans	-60.3	-48.4	175.1	-177.5	-179.4	67.8	-164.6	-0.8	111.9	D304 L305 S307 E318 T319 Y320 Q324 M325 L326	D304-R322 PolarHBondContact O-NH2 3.21Å; L305-R322 PolarHBondContact O-NE 3.25Å; L305-R322 PolarHBondContact O-NH2 3.42Å; S307-R322 PolarHBondContact O-NH2 2.75Å; E318-R322 PolarHBondContact O-N 3.4Å; T319-R322 WeakPolarHBondContact O-CB 3.44Å; T319-R322 PolarHBondContact O-N 3.33Å; Y320-R322 VanDerWaalsContact C-N 3.3Å; Y320-R322 PolarHBondContact O-N 3.37Å; R322-Q324 VanDerWaalsContact C-N 3.33Å; R322-Q324 PolarHBondContact O-N 2.73Å; R322-M325 PolarHBondContact O-N 2.64Å; R322-L326 HydrophobicContact CG-CD1 4.38Å; R322-L326 WeakPolarHBondContact O-CG 3.2Å; R322-L326 PolarHBondContact O-N 3.04Å; R322-L326 VanDerWaalsContact O-N 3.1Å
323	V	91.6	Very high	92.2	Very high	2 Å²	2	79.7 Å²	79.7	1%	0.012	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-42.2	179.1	172.9	0	0	0	0	111.2	T268 V273 T306 V308 T319 Y320 M325 L326 E327	T268-V323 HydrophobicContact CG2-CG1 3.72Å; T268-V323 HydrophobicContact CG2-CG2 4.27Å; V273-V323 HydrophobicContact CG2-CG1 4.07Å; T306-V323 VanDerWaalsContact O-CG2 3.24Å; T306-V323 WeakPolarHBondContact O-CG2 3.33Å; V308-V323 HydrophobicContact CG2-CG2 4.06Å; T319-V323 WeakPolarHBondContact O-CG2 3.37Å; T319-V323 PolarHBondContact O-N 2.96Å; Y320-V323 PolarHBondContact O-N 3.25Å; V323-M325 VanDerWaalsContact C-N 3.32Å; V323-M325 PolarHBondContact O-N 3.03Å; V323-L326 PolarHBondContact O-N 3.32Å; V323-E327 WeakPolarHBondContact O-CB 2.9Å; V323-E327 PolarHBondContact O-N 2.8Å
324	Q	91.7	Very high	92.3	Very high	96 Å²	96	76.9 Å²	76.9	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-61.4	-40.2	177	-170.1	178.1	13.7	0	0	112.2	Y320 K321 R322 E327 C328	Y320-Q324 PolarHBondContact O-N 2.87Å; K321-Q324 PolarHBondContact O-N 3.06Å; R322-Q324 VanDerWaalsContact C-N 3.33Å; R322-Q324 PolarHBondContact O-N 2.73Å; Q324-E327 PolarHBondContact O-N 3.49Å; Q324-C328 WeakPolarHBondContact O-CB 3.5Å; Q324-C328 PolarHBondContact O-N 3.05Å; Q324-C328 PolarHBondContact O-SG 2.6Å
325	M	93.4	Very high	92.3	Very high	107 Å²	107	70.5 Å²	70.5	53%	0.527	34%	0.338	S	S	.	.	H	α-helix	trans	-63.3	-41	175	-70.4	-172.7	-61.3	0	0	112.1	K321 R322 V323 A329	K321-M325 WeakPolarHBondContact O-CG 3.02Å; K321-M325 PolarHBondContact O-N 3.01Å; K321-M325 VanDerWaalsContact O-N 3.07Å; R322-M325 PolarHBondContact O-N 2.64Å; V323-M325 VanDerWaalsContact C-N 3.32Å; V323-M325 PolarHBondContact O-N 3.03Å; M325-A329 WeakPolarHBondContact O-CB 3.5Å; M325-A329 PolarHBondContact O-N 3.27Å
326	L	93	Very high	92.4	Very high	5 Å²	5	65.6 Å²	65.6	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-66.5	-40.3	177	-68.8	169.3	0	0	0	112.1	V273 F285 C288 Y290 L305 T306 R322 V323 A329 F330	V273-L326 HydrophobicContact CG1-CB 3.84Å; F285-L326 HydrophobicContact CD1-CD2 4.36Å; F285-L326 HydrophobicContact CE1-CD1 4.31Å; F285-L326 HydrophobicContact CE1-CD2 4.26Å; C288-L326 HydrophobicContact CB-CD2 3.82Å; Y290-L326 HydrophobicContact CD2-CD2 4.23Å; Y290-L326 HydrophobicContact CE2-CD2 4.32Å; L305-L326 HydrophobicContact CD2-CD1 4.39Å; L305-L326 HydrophobicContact CG-CD1 4.29Å; T306-L326 HydrophobicContact CG2-CD1 4.35Å; R322-L326 HydrophobicContact CG-CD1 4.38Å; R322-L326 WeakPolarHBondContact O-CG 3.2Å; R322-L326 PolarHBondContact O-N 3.04Å; R322-L326 VanDerWaalsContact O-N 3.1Å; V323-L326 PolarHBondContact O-N 3.32Å; L326-A329 PolarHBondContact O-N 2.89Å; L326-F330 WeakPolarHBondContact O-CB 3.42Å; L326-F330 PolarHBondContact O-N 3.47Å
327	E	91.9	Very high	92.5	Very high	19 Å²	19	66.5 Å²	66.5	9%	0.089	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-46	176.4	177.9	-91.8	174.8	0	0	111.9	E271 V323 Q324 F330 K331	E271-E327 HydrophobicContact CB-CG 4.45Å; V323-E327 WeakPolarHBondContact O-CB 2.9Å; V323-E327 PolarHBondContact O-N 2.8Å; Q324-E327 PolarHBondContact O-N 3.49Å; E327-F330 PolarHBondContact O-N 3.35Å; E327-K331 PolarHBondContact O-N 3.27Å; E327-K331 VanDerWaalsContact OE1-CD 3.25Å; E327-K331 WeakPolarHBondContact OE1-CD 3.44Å; E327-K331 WeakPolarHBondContact OE1-CE 3.05Å; E327-K331 IonicContact OE1-NZ 3.2Å; E327-K331 PolarHBondContact OE1-NZ 3.13Å
328	C	93.5	Very high	92.5	Very high	52 Å²	52	66.5 Å²	66.5	35%	0.351	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-45.3	174.8	-69.5	0	0	0	0	111.3	Q324 F330 K331 E332	Q324-C328 WeakPolarHBondContact O-CB 3.5Å; Q324-C328 PolarHBondContact O-N 3.05Å; Q324-C328 PolarHBondContact O-SG 2.6Å; C328-F330 PolarHBondContact O-N 3.09Å; C328-K331 PolarHBondContact O-N 3.11Å; C328-E332 WeakPolarHBondContact O-CG 3.31Å; C328-E332 PolarHBondContact O-N 3.5Å
329	A	94.2	Very high	92.5	Very high	34 Å²	34	60.5 Å²	60.5	28%	0.281	29%	0.292	S	S	.	.	H	α-helix	trans	-60	-35.2	176.7	0	0	0	0	0	112.4	F284 M325 L326 S333	F284-A329 HydrophobicContact CZ-CB 4.25Å; M325-A329 WeakPolarHBondContact O-CB 3.5Å; M325-A329 PolarHBondContact O-N 3.27Å; L326-A329 PolarHBondContact O-N 2.89Å; A329-S333 WeakPolarHBondContact O-CB 3.36Å; A329-S333 PolarHBondContact O-N 2.95Å
330	F	93.6	Very high	92.5	Very high	1 Å²	1	61.8 Å²	61.8	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-70.3	-45.2	175.4	178.6	-114.4	0	0	0	111.8	L272 V273 F274 C275 F284 L326 E327 C328 E332 S333 I335 Y336 I339	L272-F330 HydrophobicContact CD2-CE1 3.95Å; L272-F330 HydrophobicContact CG-CE1 4.16Å; V273-F330 WeakPolarHBondContact O-CB 3.32Å; V273-F330 WeakPolarHBondContact O-CG 3.32Å; F274-F330 AromaticContact CD2-CD2 3.95Å; F274-F330 HydrophobicContact CD2-CD2 3.95Å; F274-F330 AromaticContact CD2-CE2 3.99Å; F274-F330 HydrophobicContact CD2-CE2 3.99Å; F274-F330 HydrophobicContact CE2-CE2 4.46Å; C275-F330 HydrophobicContact CB-CZ 3.89Å; F284-F330 HydrophobicContact CE1-CB 4.38Å; F284-F330 HydrophobicContact CE2-CB 4.22Å; F284-F330 HydrophobicContact CE2-CD2 4.34Å; F284-F330 HydrophobicContact CZ-CB 3.68Å; F284-F330 HydrophobicContact CZ-CD2 4.29Å; F284-F330 HydrophobicContact CZ-CG 4.49Å; L326-F330 WeakPolarHBondContact O-CB 3.42Å; L326-F330 PolarHBondContact O-N 3.47Å; E327-F330 PolarHBondContact O-N 3.35Å; C328-F330 PolarHBondContact O-N 3.09Å; F330-E332 VanDerWaalsContact C-N 3.25Å; F330-E332 PolarHBondContact O-N 3.48Å; F330-S333 VanDerWaalsContact O-CB 3.31Å; F330-S333 WeakPolarHBondContact O-CB 3.41Å; F330-S333 PolarHBondContact O-N 3.24Å; F330-S333 PolarHBondContact O-OG 3.02Å; F330-I335 HydrophobicContact CE2-CB 4.43Å; F330-I335 HydrophobicContact CE2-CG2 4.2Å; F330-Y336 HydrophobicContact CD1-CD2 4.17Å; F330-Y336 AromaticContact CE1-CD2 3.59Å; F330-Y336 HydrophobicContact CE1-CD2 3.59Å; F330-Y336 HydrophobicContact CE1-CE2 4.35Å; F330-Y336 HydrophobicContact CE1-CG 4.42Å; F330-Y336 HydrophobicContact CZ-CD2 4.02Å; F330-Y336 WeakPolarHBondContact O-CB 3.42Å; F330-I339 HydrophobicContact CZ-CD1 4.22Å
331	K	91.5	Very high	92.5	Very high	67 Å²	67	61.5 Å²	61.5	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-31.8	177.3	-77.4	-177.1	170.3	172	0	113.5	D72 E327 C328 S333 Y336	D72-K331 IonicContact OD2-NZ 2.64Å; E327-K331 PolarHBondContact O-N 3.27Å; E327-K331 VanDerWaalsContact OE1-CD 3.25Å; E327-K331 WeakPolarHBondContact OE1-CD 3.44Å; E327-K331 WeakPolarHBondContact OE1-CE 3.05Å; E327-K331 IonicContact OE1-NZ 3.2Å; E327-K331 PolarHBondContact OE1-NZ 3.13Å; C328-K331 PolarHBondContact O-N 3.11Å; K331-S333 VanDerWaalsContact C-N 3.35Å; K331-Y336 WeakPolarHBondContact O-CD1 3.4Å
332	E	92.6	Very high	92.4	Very high	156 Å²	156	56.7 Å²	56.7	73%	0.729	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.3	175.1	-68.5	178.5	178.7	0	0	113.4	C328 F330	C328-E332 WeakPolarHBondContact O-CG 3.31Å; C328-E332 PolarHBondContact O-N 3.5Å; F330-E332 VanDerWaalsContact C-N 3.25Å; F330-E332 PolarHBondContact O-N 3.48Å
333	S	92.6	Very high	92.2	Very high	17 Å²	17	53.8 Å²	53.8	12%	0.119	27%	0.27	C	S	.	.	S	Bend	trans	-75	150.5	-175.5	76	0	0	0	0	113.3	A329 F330 K331 I335 Y336 H337	A329-S333 WeakPolarHBondContact O-CB 3.36Å; A329-S333 PolarHBondContact O-N 2.95Å; F330-S333 VanDerWaalsContact O-CB 3.31Å; F330-S333 WeakPolarHBondContact O-CB 3.41Å; F330-S333 PolarHBondContact O-N 3.24Å; F330-S333 PolarHBondContact O-OG 3.02Å; K331-S333 VanDerWaalsContact C-N 3.35Å; S333-I335 PolarHBondContact O-N 3.39Å; S333-I335 VanDerWaalsContact O-N 3.13Å; S333-Y336 PolarHBondContact O-N 3.03Å; S333-Y336 VanDerWaalsContact O-N 3.11Å; S333-Y336 PolarHBondContact OG-N 2.73Å; S333-H337 PolarHBondContact O-CD2 3.02Å; S333-H337 PolarHBondContact O-N 3.05Å
334	D	93	Very high	91.9	Very high	141 Å²	141	58.1 Å²	58.1	75%	0.754	29%	0.29	S	S	*	.	H	α-helix	trans	-57	-28.3	172.1	-63.1	-36.4	0	0	0	112.5	H337 K338	D334-H337 PolarHBondContact O-N 3.38Å; D334-K338 VanDerWaalsContact O-CB 3.24Å; D334-K338 WeakPolarHBondContact O-CB 3.33Å; D334-K338 PolarHBondContact O-N 3.33Å
335	I	92.4	Very high	91.7	Very high	30 Å²	30	59.5 Å²	59.5	15%	0.154	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-45.5	179.2	-54.6	172.5	0	0	0	109.9	F274 C275 E280 F284 F330 S333 K338 I339	F274-I335 HydrophobicContact CE2-CD1 4.04Å; C275-I335 WeakPolarHBondContact O-CG2 3.49Å; E280-I335 HydrophobicContact CB-CD1 4.33Å; F284-I335 HydrophobicContact CB-CD1 4.18Å; F284-I335 HydrophobicContact CD2-CD1 4.32Å; F330-I335 HydrophobicContact CE2-CB 4.43Å; F330-I335 HydrophobicContact CE2-CG2 4.2Å; S333-I335 PolarHBondContact O-N 3.39Å; S333-I335 VanDerWaalsContact O-N 3.13Å; I335-K338 PolarHBondContact O-N 3.32Å; I335-I339 HydrophobicContact CG2-CD1 4.43Å; I335-I339 WeakPolarHBondContact O-CG1 3.46Å; I335-I339 PolarHBondContact O-N 3.47Å
336	Y	92.2	Very high	91.2	Very high	21 Å²	21	54.8 Å²	54.8	8%	0.082	27%	0.269	C	S	.	.	H	α-helix	trans	-67	-43.6	178.5	-176.1	-103.3	0	0	0	111.8	F330 K331 S333 K338 I339 L340	F330-Y336 HydrophobicContact CD1-CD2 4.17Å; F330-Y336 AromaticContact CE1-CD2 3.59Å; F330-Y336 HydrophobicContact CE1-CD2 3.59Å; F330-Y336 HydrophobicContact CE1-CE2 4.35Å; F330-Y336 HydrophobicContact CE1-CG 4.42Å; F330-Y336 HydrophobicContact CZ-CD2 4.02Å; F330-Y336 WeakPolarHBondContact O-CB 3.42Å; K331-Y336 WeakPolarHBondContact O-CD1 3.4Å; S333-Y336 PolarHBondContact O-N 3.03Å; S333-Y336 VanDerWaalsContact O-N 3.11Å; S333-Y336 PolarHBondContact OG-N 2.73Å; Y336-K338 VanDerWaalsContact C-N 3.32Å; Y336-K338 PolarHBondContact O-N 3.34Å; Y336-I339 WeakPolarHBondContact O-CB 3.4Å; Y336-I339 PolarHBondContact O-N 3Å; Y336-I339 VanDerWaalsContact O-N 3.14Å; Y336-L340 PolarHBondContact O-N 2.98Å
337	H	93.4	Very high	90.5	Very high	104 Å²	104	58.3 Å²	58.3	48%	0.481	28%	0.282	S	S	.	.	H	α-helix	trans	-60.5	-40.4	174.8	-73.5	-60.1	0	0	0	112.5	S333 D334 I339 L340 E341	S333-H337 PolarHBondContact O-CD2 3.02Å; S333-H337 PolarHBondContact O-N 3.05Å; D334-H337 PolarHBondContact O-N 3.38Å; H337-I339 VanDerWaalsContact C-N 3.34Å; H337-I339 PolarHBondContact O-N 3.34Å; H337-L340 PolarHBondContact O-N 2.72Å; H337-E341 WeakPolarHBondContact O-CB 3.45Å; H337-E341 PolarHBondContact O-N 3.32Å
338	K	93.2	Very high	89.7	Confident	107 Å²	107	66.6 Å²	66.6	47%	0.465	31%	0.314	S	S	.	.	H	α-helix	trans	-63.1	-37.6	174.3	-177.8	-177.5	176.4	-171.1	0	112.3	E280 D334 I335 Y336 N342	E280-K338 IonicContact OE1-NZ 2.73Å; D334-K338 VanDerWaalsContact O-CB 3.24Å; D334-K338 WeakPolarHBondContact O-CB 3.33Å; D334-K338 PolarHBondContact O-N 3.33Å; I335-K338 PolarHBondContact O-N 3.32Å; Y336-K338 VanDerWaalsContact C-N 3.32Å; Y336-K338 PolarHBondContact O-N 3.34Å; K338-N342 WeakPolarHBondContact O-CB 3.49Å; K338-N342 PolarHBondContact O-N 3.32Å; K338-N342 PolarHBondContact O-ND2 3.1Å
339	I	91.2	Very high	88.5	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.056	32%	0.324	C	S	.	.	H	α-helix	trans	-63.4	-48	174.4	-71.1	166.2	0	0	0	110.3	C275 F330 I335 Y336 H337 E341 N342 I343	C275-I339 HydrophobicContact CB-CD1 3.92Å; C275-I339 WeakPolarHBondContact O-CD1 3.28Å; F330-I339 HydrophobicContact CZ-CD1 4.22Å; I335-I339 HydrophobicContact CG2-CD1 4.43Å; I335-I339 WeakPolarHBondContact O-CG1 3.46Å; I335-I339 PolarHBondContact O-N 3.47Å; Y336-I339 WeakPolarHBondContact O-CB 3.4Å; Y336-I339 PolarHBondContact O-N 3Å; Y336-I339 VanDerWaalsContact O-N 3.14Å; H337-I339 VanDerWaalsContact C-N 3.34Å; H337-I339 PolarHBondContact O-N 3.34Å; I339-E341 VanDerWaalsContact C-N 3.35Å; I339-E341 PolarHBondContact O-N 3.49Å; I339-N342 PolarHBondContact O-N 3.09Å; I339-I343 HydrophobicContact CG2-CD1 3.99Å; I339-I343 WeakPolarHBondContact O-CG1 3.49Å; I339-I343 PolarHBondContact O-N 3.28Å
340	L	91.4	Very high	87.1	Confident	41 Å²	41	75.5 Å²	75.5	22%	0.215	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-45.1	179.1	-171.6	64.6	0	0	0	111.4	L42 Y336 H337 N342 I343 E344	L42-L340 HydrophobicContact CD1-CD1 3.33Å; Y336-L340 PolarHBondContact O-N 2.98Å; H337-L340 PolarHBondContact O-N 2.72Å; L340-N342 VanDerWaalsContact C-N 3.32Å; L340-N342 PolarHBondContact O-N 2.83Å; L340-I343 PolarHBondContact O-N 3.29Å; L340-E344 PolarHBondContact O-N 3.41Å
341	E	91.9	Very high	85.2	Confident	88 Å²	88	80 Å²	80	41%	0.411	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-40.2	176.5	-165.5	-170.6	180	0	0	111.8	H337 I339 E344 R345	H337-E341 WeakPolarHBondContact O-CB 3.45Å; H337-E341 PolarHBondContact O-N 3.32Å; I339-E341 VanDerWaalsContact C-N 3.35Å; I339-E341 PolarHBondContact O-N 3.49Å; E341-E344 PolarHBondContact O-N 3.45Å; E341-R345 HydrophobicContact CG-CG 4.48Å; E341-R345 WeakPolarHBondContact O-CB 3.46Å; E341-R345 VanDerWaalsContact O-CG 3.25Å; E341-R345 WeakPolarHBondContact O-CG 3.44Å; E341-R345 PolarHBondContact O-N 3.42Å; E341-R345 IonicContact OE1-CZ 2.75Å; E341-R345 IonicContact OE1-NE 3.6Å; E341-R345 PolarHBondContact OE1-NE 3.21Å; E341-R345 IonicContact OE1-NH2 3.53Å; E341-R345 PolarHBondContact OE1-NH2 3.11Å; E341-R345 IonicContact OE2-CZ 3.18Å; E341-R345 IonicContact OE2-NH2 2.64Å; E341-R345 PolarHBondContact OE2-NH2 3.2Å
342	N	90.3	Very high	83.7	Confident	31 Å²	31	78.7 Å²	78.7	17%	0.166	37%	0.368	C	S	.	.	H	α-helix	trans	-66.7	-36.6	177.1	-71.7	-29.1	0	0	0	112.7	Y76 K338 I339 L340 A346	Y76-N342 HydrophobicContact CD1-CB 3.64Å; Y76-N342 HydrophobicContact CD2-CB 4.36Å; Y76-N342 HydrophobicContact CE1-CB 3.7Å; Y76-N342 HydrophobicContact CE2-CB 4.39Å; Y76-N342 HydrophobicContact CG-CB 4Å; K338-N342 WeakPolarHBondContact O-CB 3.49Å; K338-N342 PolarHBondContact O-N 3.32Å; K338-N342 PolarHBondContact O-ND2 3.1Å; I339-N342 PolarHBondContact O-N 3.09Å; L340-N342 VanDerWaalsContact C-N 3.32Å; L340-N342 PolarHBondContact O-N 2.83Å; N342-A346 WeakPolarHBondContact O-CB 3.31Å; N342-A346 PolarHBondContact O-N 3.28Å
343	I	86.9	Confident	82.1	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-63.8	-44.9	173.3	-64.5	165	0	0	0	109.8	V41 Y76 F115 I339 L340 A346 R347	V41-I343 WeakPolarHBondContact O-CD1 3.49Å; Y76-I343 HydrophobicContact CD2-CG1 3.86Å; Y76-I343 HydrophobicContact CG-CG1 4.28Å; F115-I343 HydrophobicContact CD2-CG2 4.28Å; I339-I343 HydrophobicContact CG2-CD1 3.99Å; I339-I343 WeakPolarHBondContact O-CG1 3.49Å; I339-I343 PolarHBondContact O-N 3.28Å; L340-I343 PolarHBondContact O-N 3.29Å; I343-A346 PolarHBondContact O-N 2.96Å; I343-R347 PolarHBondContact O-N 3Å; I343-R347 VanDerWaalsContact O-N 3.15Å
344	E	87.3	Confident	80.6	Confident	93 Å²	93	79.1 Å²	79.1	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-63.3	-46.7	176.7	-71.4	-173	177.3	0	0	112.1	L340 E341 A346 R347 Y348	L340-E344 PolarHBondContact O-N 3.41Å; E341-E344 PolarHBondContact O-N 3.45Å; E344-A346 VanDerWaalsContact C-N 3.27Å; E344-A346 PolarHBondContact O-N 2.71Å; E344-R347 WeakPolarHBondContact O-CB 3.25Å; E344-R347 PolarHBondContact O-N 3.33Å; E344-Y348 WeakPolarHBondContact O-CD2 3.24Å; E344-Y348 PolarHBondContact O-N 3.38Å
345	R	86.4	Confident	79	Confident	125 Å²	125	73 Å²	73	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-55.9	-42.6	175	-75	172.3	-178.6	179.8	-0.8	111.5	E341 R347 Y348 L349	E341-R345 HydrophobicContact CG-CG 4.48Å; E341-R345 WeakPolarHBondContact O-CB 3.46Å; E341-R345 VanDerWaalsContact O-CG 3.25Å; E341-R345 WeakPolarHBondContact O-CG 3.44Å; E341-R345 PolarHBondContact O-N 3.42Å; E341-R345 IonicContact OE1-CZ 2.75Å; E341-R345 IonicContact OE1-NE 3.6Å; E341-R345 PolarHBondContact OE1-NE 3.21Å; E341-R345 IonicContact OE1-NH2 3.53Å; E341-R345 PolarHBondContact OE1-NH2 3.11Å; E341-R345 IonicContact OE2-CZ 3.18Å; E341-R345 IonicContact OE2-NH2 2.64Å; E341-R345 PolarHBondContact OE2-NH2 3.2Å; R345-R347 VanDerWaalsContact C-N 3.3Å; R345-R347 PolarHBondContact O-N 3.03Å; R345-Y348 PolarHBondContact O-N 3.24Å; R345-Y348 VanDerWaalsContact O-N 3.16Å; R345-L349 PolarHBondContact O-N 3.13Å
346	A	82.2	Confident	77.5	Confident	8 Å²	8	72.5 Å²	72.5	7%	0.066	35%	0.349	C	S	.	.	H	α-helix	trans	-63.8	-32.4	177	0	0	0	0	0	112.8	Y76 G118 N342 I343 E344 Y348	Y76-A346 HydrophobicContact CE2-CB 3.94Å; G118-A346 WeakPolarHBondContact CA-O 3.29Å; N342-A346 WeakPolarHBondContact O-CB 3.31Å; N342-A346 PolarHBondContact O-N 3.28Å; I343-A346 PolarHBondContact O-N 2.96Å; E344-A346 VanDerWaalsContact C-N 3.27Å; E344-A346 PolarHBondContact O-N 2.71Å; A346-Y348 VanDerWaalsContact C-N 3.33Å
347	R	79.3	Confident	76	Confident	78 Å²	78	74.9 Å²	74.9	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-35.5	173.4	-69.6	174.7	170.2	-165.3	-4.1	112.5	E113 F115 I343 E344 R345	E113-R347 IonicContact OE2-CZ 3.86Å; E113-R347 IonicContact OE2-NH2 2.85Å; E113-R347 PolarHBondContact OE2-NH2 2.91Å; F115-R347 HydrophobicContact CD1-CG 3.92Å; F115-R347 HydrophobicContact CE1-CG 4.14Å; F115-R347 HydrophobicContact CG-CG 4.35Å; F115-R347 VanDerWaalsContact CZ-NE 3.26Å; I343-R347 PolarHBondContact O-N 3Å; I343-R347 VanDerWaalsContact O-N 3.15Å; E344-R347 WeakPolarHBondContact O-CB 3.25Å; E344-R347 PolarHBondContact O-N 3.33Å; R345-R347 VanDerWaalsContact C-N 3.3Å; R345-R347 PolarHBondContact O-N 3.03Å
348	Y	74.7	Confident	74.6	Confident	194 Å²	194	70.6 Å²	70.6	76%	0.761	34%	0.34	S	S	*	.	H	α-helix	trans	-80.3	-36.2	179.8	-66	-70.1	0	0	0	113	E344 R345 A346 K350	E344-Y348 WeakPolarHBondContact O-CD2 3.24Å; E344-Y348 PolarHBondContact O-N 3.38Å; R345-Y348 PolarHBondContact O-N 3.24Å; R345-Y348 VanDerWaalsContact O-N 3.16Å; A346-Y348 VanDerWaalsContact C-N 3.33Å; Y348-K350 VanDerWaalsContact C-N 3.3Å; Y348-K350 PolarHBondContact O-N 3.37Å
349	L	67.6	Low	73.2	Confident	107 Å²	107	67.7 Å²	67.7	56%	0.56	33%	0.331	S	S	*	.			trans	-76.7	71.6	178.6	-90.2	149	0	0	0	111.9	R345 T351	R345-L349 PolarHBondContact O-N 3.13Å; L349-T351 HydrophobicContact CD2-CG2 3.79Å; L349-T351 PolarHBondContact O-N 3.1Å
350	K	64.8	Low	71.7	Confident	166 Å²	166	74.7 Å²	74.7	72%	0.722	36%	0.361	S	S	*	.			trans	-75.3	46.9	171.4	-67.6	-176.2	179.3	176.6	0	113.1	Y348	Y348-K350 VanDerWaalsContact C-N 3.3Å; Y348-K350 PolarHBondContact O-N 3.37Å
351	T	55.5	Low	70.5	Confident	95 Å²	95	77.9 Å²	77.9	58%	0.583	38%	0.379	S	S	*	.			trans	-88.3	-18.4	-173.7	50.2	0	0	0	0	113.8	L349	L349-T351 HydrophobicContact CD2-CG2 3.79Å; L349-T351 PolarHBondContact O-N 3.1Å
352	L	60	Low	69.5	Low	40 Å²	40	77.5 Å²	77.5	21%	0.209	38%	0.383	C	S	.	.	S	Bend	trans	-109.9	157	-175.2	-77.5	154.4	0	0	0	112.2	A35 R36 N117 T354	A35-L352 HydrophobicContact CB-CD1 3.65Å; A35-L352 HydrophobicContact CB-CD2 3.8Å; A35-L352 HydrophobicContact CB-CG 3.6Å; R36-L352 WeakPolarHBondContact O-CD1 3.38Å; N117-L352 HydrophobicContact CB-CB 4.35Å; L352-T354 PolarHBondContact O-N 3.09Å
353	P	57.9	Low	68.8	Low	92 Å²	92	76.9 Å²	76.9	60%	0.597	38%	0.381	S	S	*	.			trans	-53.7	138.6	175.6	20.8	-31.3	0	0	0	111.4	N117 V355	N117-P353 PolarHBondContact ND2-O 3.12Å; P353-V355 VanDerWaalsContact C-N 3.31Å; P353-V355 PolarHBondContact O-N 2.98Å; P353-V355 VanDerWaalsContact O-N 3.15Å
354	T	60.4	Low	68.6	Low	90 Å²	90	79.4 Å²	79.4	55%	0.552	41%	0.407	S	S	*	.	S	Bend	trans	-57.8	-34.1	-159.8	49.2	0	0	0	0	115.1	C119 L352	C119-T354 WeakPolarHBondContact CB-O 3.43Å; L352-T354 PolarHBondContact O-N 3.09Å
355	V	60.3	Low	68.6	Low	12 Å²	12	79.4 Å²	79.4	7%	0.073	41%	0.408	C	S	.	.			trans	-150.8	126.8	174.2	-172.4	0	0	0	0	108.4	L121 C129 P353 F357	L121-V355 HydrophobicContact CD1-CG1 3.92Å; L121-V355 HydrophobicContact CD1-CG2 4.3Å; C129-V355 HydrophobicContact CB-CG1 3.87Å; P353-V355 VanDerWaalsContact C-N 3.31Å; P353-V355 PolarHBondContact O-N 2.98Å; P353-V355 VanDerWaalsContact O-N 3.15Å; V355-F357 VanDerWaalsContact C-N 3.31Å; V355-F357 HydrophobicContact CB-CD2 4.38Å; V355-F357 HydrophobicContact CB-CE1 4.43Å; V355-F357 HydrophobicContact CB-CE2 3.96Å; V355-F357 HydrophobicContact CB-CZ 3.99Å; V355-F357 HydrophobicContact CG1-CE1 4.37Å; V355-F357 HydrophobicContact CG1-CZ 4.42Å; V355-F357 HydrophobicContact CG2-CZ 4.45Å; V355-F357 VanDerWaalsContact O-CD2 3.26Å; V355-F357 WeakPolarHBondContact O-CD2 3.43Å; V355-F357 PolarHBondContact O-N 3.27Å
356	P	61.6	Low	68.6	Low	19 Å²	19	81.6 Å²	81.6	12%	0.123	42%	0.421	C	S	.	.			trans	-74.5	86.3	173.7	30.4	-31	0	0	0	109.4	V116 K213 K358	V116-P356 HydrophobicContact CG1-CG 4.12Å; K213-P356 HydrophobicContact CB-CB 3.93Å; K213-P356 HydrophobicContact CB-CG 4.16Å; K213-P356 HydrophobicContact CG-CB 3.91Å; P356-K358 PolarHBondContact O-N 2.86Å
357	F	60	Low	68.8	Low	72 Å²	72	83.1 Å²	83.1	32%	0.316	44%	0.438	S	S	.	.			trans	-64.1	120.8	175.1	-65.6	-77.5	0	0	0	110.5	D128 V355 T359 K360	D128-F357 HydrophobicContact CB-CD1 3.75Å; D128-F357 HydrophobicContact CB-CE1 4.29Å; V355-F357 VanDerWaalsContact C-N 3.31Å; V355-F357 HydrophobicContact CB-CD2 4.38Å; V355-F357 HydrophobicContact CB-CE1 4.43Å; V355-F357 HydrophobicContact CB-CE2 3.96Å; V355-F357 HydrophobicContact CB-CZ 3.99Å; V355-F357 HydrophobicContact CG1-CE1 4.37Å; V355-F357 HydrophobicContact CG1-CZ 4.42Å; V355-F357 HydrophobicContact CG2-CZ 4.45Å; V355-F357 VanDerWaalsContact O-CD2 3.26Å; V355-F357 WeakPolarHBondContact O-CD2 3.43Å; V355-F357 PolarHBondContact O-N 3.27Å; F357-T359 VanDerWaalsContact C-N 3.29Å; F357-T359 PolarHBondContact O-N 3.43Å; F357-K360 HydrophobicContact CB-CG 4.05Å
358	K	63	Low	69.4	Low	14 Å²	14	80.5 Å²	80.5	6%	0.061	43%	0.429	C	S	.	.	S	Bend	trans	-53	-43.7	176.4	-169.4	175.4	-171.4	-156.7	0	110.7	D128 S131 Q210 P212 P356	D128-K358 WeakPolarHBondContact O-CB 3.38Å; D128-K358 PolarHBondContact O-N 3.04Å; S131-K358 WeakPolarHBondContact OG-CE 3.08Å; S131-K358 PolarHBondContact OG-NZ 2.94Å; S131-K358 VanDerWaalsContact OG-NZ 3.11Å; Q210-K358 HydrophobicContact CB-CD 3.99Å; Q210-K358 HydrophobicContact CB-CG 3.45Å; Q210-K358 VanDerWaalsContact CB-CG 3.45Å; Q210-K358 HydrophobicContact CG-CG 4.46Å; Q210-K358 CarbonylContact O-C 3.49Å; Q210-K358 WeakPolarHBondContact O-CG 3.39Å; P212-K358 HydrophobicContact CB-CD 4.33Å; P212-K358 HydrophobicContact CB-CG 4.15Å; P356-K358 PolarHBondContact O-N 2.86Å
359	T	64.5	Low	70.3	Confident	46 Å²	46	72.6 Å²	72.6	28%	0.282	40%	0.4	S	S	.	.			trans	-161	131	167	-25.6	0	0	0	0	111.2	L157 F357	L157-T359 HydrophobicContact CD2-CG2 3.71Å; F357-T359 VanDerWaalsContact C-N 3.29Å; F357-T359 PolarHBondContact O-N 3.43Å
360	K	59.3	Low	71.5	Confident	157 Å²	157	69.5 Å²	69.5	68%	0.683	39%	0.393	S	S	*	.	S	Bend	trans	-81.7	-24.1	-175.5	-69.5	-174.9	177.5	-179.9	0	114.7	F357	F357-K360 HydrophobicContact CB-CG 4.05Å
361	D	66.6	Low	72.8	Confident	109 Å²	109	62.9 Å²	62.9	58%	0.583	37%	0.367	S	S	*	.			trans	-127.3	93.2	-170.3	-54.7	-46.4	0	0	0	110.3	C158	C158-D361 HydrophobicContact CB-CB 3.81Å; C158-D361 WeakPolarHBondContact CB-O 3.35Å; C158-D361 PolarHBondContact N-O 3.31Å
362	P	71.1	Confident	74.7	Confident	79 Å²	79	58.4 Å²	58.4	51%	0.513	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-70.9	147.1	168.3	27.9	-32.3	0	0	0	110.2
363	P	76.5	Confident	76.4	Confident	18 Å²	18	58.9 Å²	58.9	12%	0.117	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-62.4	150.4	176.5	23.7	-31.4	0	0	0	111.4	L155 K368	L155-P363 VanDerWaalsContact O-CD 3.25Å; L155-P363 WeakPolarHBondContact O-CD 3.38Å; L155-P363 VanDerWaalsContact O-CG 3.3Å; L155-P363 WeakPolarHBondContact O-CG 3.35Å; P363-K368 HydrophobicContact CB-CG 4.38Å; P363-K368 HydrophobicContact CG-CD 4.41Å; P363-K368 HydrophobicContact CG-CG 3.78Å; P363-K368 WeakPolarHBondContact O-CE 3.38Å
364	G	82.7	Confident	78.2	Confident	53 Å²	53	61.5 Å²	61.5	55%	0.546	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-56.6	152.5	179.2	0	0	0	0	0	113.1	F366 G367 K368	G364-F366 VanDerWaalsContact C-N 3.3Å; G364-F366 PolarHBondContact O-N 2.82Å; G364-G367 WeakPolarHBondContact O-CA 3.47Å; G364-G367 PolarHBondContact O-N 3.12Å; G364-K368 PolarHBondContact O-N 3.17Å
365	M	86	Confident	79.9	Confident	93 Å²	93	57.2 Å²	57.2	46%	0.458	31%	0.314	S	S	.	.	H	α-helix	trans	-52.4	-43.1	-174.2	-175.9	176.5	78.2	0	0	113.8	K368 L369 W462	M365-K368 PolarHBondContact O-N 3.36Å; M365-L369 PolarHBondContact O-N 3.5Å; M365-W462 HydrophobicContact CE-CH2 4.46Å; M365-W462 HydrophobicContact CG-CH2 4.15Å; M365-W462 HydrophobicContact CG-CZ2 4.4Å; M365-W462 HydrophobicContact SD-CH2 3.61Å; M365-W462 HydrophobicContact SD-CZ2 3.74Å
366	F	86.9	Confident	81.5	Confident	171 Å²	171	56.8 Å²	56.8	75%	0.75	31%	0.311	S	S	*	.	H	α-helix	trans	-67.7	-36.1	178.2	-64.8	-73.1	0	0	0	112.6	G364 L369 G370	G364-F366 VanDerWaalsContact C-N 3.3Å; G364-F366 PolarHBondContact O-N 2.82Å; F366-L369 PolarHBondContact O-N 2.94Å; F366-G370 PolarHBondContact O-N 3.23Å
367	G	86.8	Confident	83	Confident	41 Å²	41	58 Å²	58	42%	0.423	32%	0.318	S	S	.	.	H	α-helix	trans	-63.6	-47.3	174	0	0	0	0	0	111.4	G364 L369 G370 V371	G364-G367 WeakPolarHBondContact O-CA 3.47Å; G364-G367 PolarHBondContact O-N 3.12Å; G367-L369 PolarHBondContact O-N 3.47Å; G367-G370 PolarHBondContact O-N 2.85Å; G367-V371 WeakPolarHBondContact O-CG2 3.31Å; G367-V371 PolarHBondContact O-N 3.49Å
368	K	91.3	Very high	84.7	Confident	23 Å²	23	58.6 Å²	58.6	10%	0.1	32%	0.318	C	S	.	.	H	α-helix	trans	-56.5	-47.9	175.4	-70.7	-172	177.3	-166.5	0	111.8	L155 P363 G364 M365 G370 V371 L372 L458	L155-K368 HydrophobicContact CD2-CB 4.13Å; L155-K368 HydrophobicContact CD2-CG 4.25Å; P363-K368 HydrophobicContact CB-CG 4.38Å; P363-K368 HydrophobicContact CG-CD 4.41Å; P363-K368 HydrophobicContact CG-CG 3.78Å; P363-K368 WeakPolarHBondContact O-CE 3.38Å; G364-K368 PolarHBondContact O-N 3.17Å; M365-K368 PolarHBondContact O-N 3.36Å; K368-G370 PolarHBondContact O-N 3.25Å; K368-V371 PolarHBondContact O-N 2.97Å; K368-L372 WeakPolarHBondContact O-CB 3.13Å; K368-L372 WeakPolarHBondContact O-CG 3.04Å; K368-L372 PolarHBondContact O-N 3.45Å; K368-L458 WeakPolarHBondContact CE-O 3.47Å; K368-L458 PolarHBondContact NZ-O 3.2Å
369	L	92.9	Very high	86.1	Confident	28 Å²	28	58.3 Å²	58.3	15%	0.147	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-42	178.7	-176.7	65.3	0	0	0	112.2	M365 F366 G367 V371 L372 L373 L466 A467 L470	M365-L369 PolarHBondContact O-N 3.5Å; F366-L369 PolarHBondContact O-N 2.94Å; G367-L369 PolarHBondContact O-N 3.47Å; L369-V371 PolarHBondContact O-N 2.92Å; L369-L372 PolarHBondContact O-N 3.44Å; L369-L373 WeakPolarHBondContact O-CB 3.47Å; L369-L373 PolarHBondContact O-N 3.34Å; L369-L466 HydrophobicContact CD1-CB 4.01Å; L369-L466 HydrophobicContact CD1-CD2 4.05Å; L369-L466 HydrophobicContact CD1-CG 4.01Å; L369-L466 HydrophobicContact CD2-CD2 3.6Å; L369-L466 HydrophobicContact CD2-CG 4.17Å; L369-A467 HydrophobicContact CD1-CB 4.17Å; L369-L470 HydrophobicContact CD2-CD1 4.18Å
370	G	93	Very high	87.4	Confident	41 Å²	41	56.1 Å²	56.1	42%	0.423	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-41.1	177	0	0	0	0	0	112.9	F366 G367 K368 L373 R374	F366-G370 PolarHBondContact O-N 3.23Å; G367-G370 PolarHBondContact O-N 2.85Å; K368-G370 PolarHBondContact O-N 3.25Å; G370-L373 PolarHBondContact O-N 3.32Å; G370-R374 WeakPolarHBondContact O-CB 3.32Å; G370-R374 PolarHBondContact O-N 2.56Å
371	V	93.4	Very high	88.9	Confident	28 Å²	28	53 Å²	53	17%	0.17	29%	0.293	C	S	.	.	H	α-helix	trans	-65.5	-44.7	175.4	176.2	0	0	0	0	110.9	Y151 M154 L155 G367 K368 L369 R374 R375	Y151-V371 HydrophobicContact CD1-CG1 3.88Å; M154-V371 HydrophobicContact CB-CG1 3.92Å; M154-V371 HydrophobicContact CB-CG2 4.22Å; L155-V371 HydrophobicContact CD2-CB 4.04Å; L155-V371 HydrophobicContact CD2-CG1 3.97Å; L155-V371 HydrophobicContact CG-CG1 3.95Å; G367-V371 WeakPolarHBondContact O-CG2 3.31Å; G367-V371 PolarHBondContact O-N 3.49Å; K368-V371 PolarHBondContact O-N 2.97Å; L369-V371 PolarHBondContact O-N 2.92Å; V371-R374 PolarHBondContact O-N 2.9Å; V371-R375 WeakPolarHBondContact O-CB 3.15Å; V371-R375 PolarHBondContact O-N 2.93Å
372	L	95.1	Very high	90.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-45.5	175.8	-75.7	168.7	0	0	0	112	L155 K368 L369 R374 R375 V376 Y459 Q463 M464 A467	L155-L372 HydrophobicContact CD1-CD2 4.01Å; L155-L372 HydrophobicContact CD1-CG 4.47Å; L155-L372 HydrophobicContact CD2-CD2 4.5Å; L155-L372 HydrophobicContact CD2-CG 4.08Å; K368-L372 WeakPolarHBondContact O-CB 3.13Å; K368-L372 WeakPolarHBondContact O-CG 3.04Å; K368-L372 PolarHBondContact O-N 3.45Å; L369-L372 PolarHBondContact O-N 3.44Å; L372-R374 VanDerWaalsContact C-N 3.31Å; L372-R374 PolarHBondContact O-N 3.33Å; L372-R375 WeakPolarHBondContact O-CB 3.44Å; L372-R375 PolarHBondContact O-N 3.45Å; L372-R375 VanDerWaalsContact O-N 3.17Å; L372-V376 WeakPolarHBondContact O-CB 3.41Å; L372-V376 WeakPolarHBondContact O-CG2 3.43Å; L372-V376 PolarHBondContact O-N 2.85Å; L372-Y459 HydrophobicContact CD1-CD1 4.38Å; L372-Y459 HydrophobicContact CD1-CD2 4.09Å; L372-Y459 HydrophobicContact CD1-CG 4Å; L372-Y459 HydrophobicContact CD2-CD1 4.09Å; L372-Y459 HydrophobicContact CD2-CE1 3.85Å; L372-Y459 HydrophobicContact CD2-CE2 4.35Å; L372-Y459 HydrophobicContact CD2-CG 4.44Å; L372-Q463 HydrophobicContact CD1-CB 3.77Å; L372-M464 HydrophobicContact CD2-CE 3.87Å; L372-A467 HydrophobicContact CB-CB 3.82Å
373	L	95.3	Very high	91	Very high	51 Å²	51	50.4 Å²	50.4	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-59.1	-44.1	177.3	178.6	60.6	0	0	0	111.3	L369 G370 T377 A467 L470 H471	L369-L373 WeakPolarHBondContact O-CB 3.47Å; L369-L373 PolarHBondContact O-N 3.34Å; G370-L373 PolarHBondContact O-N 3.32Å; L373-T377 VanDerWaalsContact O-CB 3.25Å; L373-T377 WeakPolarHBondContact O-CB 3.46Å; L373-T377 PolarHBondContact O-N 2.9Å; L373-T377 PolarHBondContact O-OG1 3.13Å; L373-A467 WeakPolarHBondContact CD1-O 3.49Å; L373-L470 HydrophobicContact CD1-CB 3.84Å; L373-L470 HydrophobicContact CD2-CB 4.31Å; L373-H471 HydrophobicContact CD1-CB 3.81Å
374	R	95.4	Very high	91.5	Very high	146 Å²	146	57.5 Å²	57.5	55%	0.551	30%	0.298	S	S	*	.	H	α-helix	trans	-63.8	-42.6	175.8	-172.5	-179.7	177.7	179.2	2.4	111.6	Y151 G370 V371 L372 R378	Y151-R374 HydrophobicContact CE1-CB 4.48Å; Y151-R374 HydrophobicContact CE1-CG 4.3Å; G370-R374 WeakPolarHBondContact O-CB 3.32Å; G370-R374 PolarHBondContact O-N 2.56Å; V371-R374 PolarHBondContact O-N 2.9Å; L372-R374 VanDerWaalsContact C-N 3.31Å; L372-R374 PolarHBondContact O-N 3.33Å; R374-R378 VanDerWaalsContact O-CB 3.3Å; R374-R378 WeakPolarHBondContact O-CB 3.4Å; R374-R378 PolarHBondContact O-N 3.05Å
375	R	95.8	Very high	91.8	Very high	1 Å²	1	61.5 Å²	61.5	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-50	178.2	-175.7	-177.5	-176.6	-168.9	-3	111.4	L140 L143 Y151 V371 L372 R378 N379 E453	L140-R375 HydrophobicContact CD1-CG 3.97Å; L143-R375 HydrophobicContact CD1-CG 3.8Å; Y151-R375 HydrophobicContact CD1-CB 3.88Å; Y151-R375 HydrophobicContact CD1-CG 4.31Å; Y151-R375 HydrophobicContact CD2-CB 4.09Å; Y151-R375 HydrophobicContact CD2-CG 3.7Å; Y151-R375 HydrophobicContact CE1-CB 3.98Å; Y151-R375 HydrophobicContact CE2-CB 4.2Å; Y151-R375 HydrophobicContact CE2-CG 4.08Å; Y151-R375 HydrophobicContact CG-CB 3.96Å; Y151-R375 HydrophobicContact CG-CG 3.86Å; V371-R375 WeakPolarHBondContact O-CB 3.15Å; V371-R375 PolarHBondContact O-N 2.93Å; L372-R375 WeakPolarHBondContact O-CB 3.44Å; L372-R375 PolarHBondContact O-N 3.45Å; L372-R375 VanDerWaalsContact O-N 3.17Å; R375-R378 PolarHBondContact O-N 2.76Å; R375-N379 WeakPolarHBondContact O-CB 3.25Å; R375-N379 PolarHBondContact O-N 3.4Å; R375-E453 IonicContact CZ-OE1 3.47Å; R375-E453 VanDerWaalsContact CZ-OE1 3.26Å; R375-E453 IonicContact CZ-OE2 3.57Å; R375-E453 IonicContact NH1-OE1 3.35Å; R375-E453 PolarHBondContact NH1-OE1 3.47Å; R375-E453 IonicContact NH1-OE2 3.64Å; R375-E453 PolarHBondContact NH1-OE2 3.19Å; R375-E453 IonicContact NH2-OE1 2.64Å; R375-E453 PolarHBondContact NH2-OE1 3.03Å; R375-E453 IonicContact NH2-OE2 3.32Å
376	V	94.8	Very high	92	Very high	3 Å²	3	58 Å²	58	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-45.1	178.9	170.4	0	0	0	0	110.9	L372 R378 N379 L380 L446 M464 A467 H471	L372-V376 WeakPolarHBondContact O-CB 3.41Å; L372-V376 WeakPolarHBondContact O-CG2 3.43Å; L372-V376 PolarHBondContact O-N 2.85Å; V376-R378 PolarHBondContact O-N 2.73Å; V376-N379 PolarHBondContact O-N 3.25Å; V376-L380 PolarHBondContact O-N 3.48Å; V376-L446 HydrophobicContact CB-CD2 4.43Å; V376-L446 HydrophobicContact CG1-CD2 3.8Å; V376-L446 HydrophobicContact CG2-CD2 3.81Å; V376-M464 HydrophobicContact CG2-SD 3.67Å; V376-A467 HydrophobicContact CG2-CB 4.4Å; V376-H471 HydrophobicContact CG1-CB 4.13Å
377	T	93.6	Very high	92.2	Very high	44 Å²	44	50.8 Å²	50.8	27%	0.27	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-42.9	178.8	-56.9	0	0	0	0	111.9	L373 L380 M381 H471	L373-T377 VanDerWaalsContact O-CB 3.25Å; L373-T377 WeakPolarHBondContact O-CB 3.46Å; L373-T377 PolarHBondContact O-N 2.9Å; L373-T377 PolarHBondContact O-OG1 3.13Å; T377-L380 PolarHBondContact O-N 2.94Å; T377-M381 HydrophobicContact CG2-CG 4.24Å; T377-M381 WeakPolarHBondContact O-CB 3.43Å; T377-M381 WeakPolarHBondContact O-CG 3.39Å; T377-M381 PolarHBondContact O-N 3.16Å; T377-H471 VanDerWaalsContact CA-CE1 3.5Å; T377-H471 WeakPolarHBondContact CA-CE1 3.23Å; T377-H471 WeakPolarHBondContact CA-ND1 3.48Å; T377-H471 PolarHBondContact OG1-ND1 3.29Å
378	R	94.6	Very high	92.5	Very high	84 Å²	84	53.6 Å²	53.6	32%	0.317	26%	0.263	S	S	.	.	H	α-helix	trans	-64.8	-41.3	176.8	-168.2	173.6	-164.5	173.7	2	112.1	L143 E147 Y151 R374 R375 V376 M381 R382	L143-R378 HydrophobicContact CD2-CB 4.3Å; L143-R378 HydrophobicContact CD2-CG 4.1Å; E147-R378 IonicContact OE1-CZ 3.74Å; E147-R378 IonicContact OE1-NE 3.16Å; E147-R378 IonicContact OE1-NH1 3.86Å; E147-R378 PolarHBondContact OE1-NH1 3.11Å; E147-R378 IonicContact OE1-NH2 2.69Å; E147-R378 PolarHBondContact OE1-NH2 3.37Å; E147-R378 IonicContact OE2-CZ 3.52Å; E147-R378 IonicContact OE2-NE 2.63Å; E147-R378 PolarHBondContact OE2-NE 3.19Å; E147-R378 IonicContact OE2-NH1 3.59Å; E147-R378 IonicContact OE2-NH2 3.43Å; Y151-R378 VanDerWaalsContact OH-CD 3.26Å; Y151-R378 WeakPolarHBondContact OH-CD 3.37Å; R374-R378 VanDerWaalsContact O-CB 3.3Å; R374-R378 WeakPolarHBondContact O-CB 3.4Å; R374-R378 PolarHBondContact O-N 3.05Å; R375-R378 PolarHBondContact O-N 2.76Å; V376-R378 PolarHBondContact O-N 2.73Å; R378-M381 PolarHBondContact O-N 3.07Å; R378-R382 PolarHBondContact O-N 3.4Å; R378-R382 VanDerWaalsContact O-N 3.17Å
379	N	93.2	Very high	92.5	Very high	8 Å²	8	58 Å²	58	4%	0.043	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-44.9	176.9	179.2	64.9	0	0	0	111.5	L140 S142 L143 R375 V376 N383	L140-N379 HydrophobicContact CD1-CB 4.25Å; S142-N379 VanDerWaalsContact OG-CA 3.24Å; S142-N379 WeakPolarHBondContact OG-CA 3.27Å; S142-N379 PolarHBondContact OG-O 3.39Å; S142-N379 PolarHBondContact OG-OD1 2.92Å; L143-N379 HydrophobicContact CD2-CB 4.28Å; L143-N379 HydrophobicContact CG-CB 4.4Å; R375-N379 WeakPolarHBondContact O-CB 3.25Å; R375-N379 PolarHBondContact O-N 3.4Å; V376-N379 PolarHBondContact O-N 3.25Å; N379-N383 PolarHBondContact O-N 2.98Å
380	L	90.8	Very high	92.4	Very high	1 Å²	1	57 Å²	57	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-65.1	-47.4	176.2	-174.8	65.2	0	0	0	111.3	V376 T377 R382 N383 A386 V387 L442 H471 F475	V376-L380 PolarHBondContact O-N 3.48Å; T377-L380 PolarHBondContact O-N 2.94Å; L380-R382 PolarHBondContact O-N 2.93Å; L380-N383 CarbonylContact O-C 3.56Å; L380-N383 WeakPolarHBondContact O-CA 3.46Å; L380-N383 PolarHBondContact O-N 3.39Å; L380-A386 HydrophobicContact CD1-CB 3.56Å; L380-V387 HydrophobicContact CD1-CG2 4.39Å; L380-V387 HydrophobicContact CD2-CG2 4.47Å; L380-V387 HydrophobicContact CG-CG2 3.92Å; L380-V387 WeakPolarHBondContact O-CG2 3.46Å; L380-L442 HydrophobicContact CD1-CD1 3.99Å; L380-L442 HydrophobicContact CD1-CD2 3.64Å; L380-L442 HydrophobicContact CD1-CG 4.49Å; L380-L442 HydrophobicContact CD2-CD2 4.45Å; L380-L442 HydrophobicContact CG-CD2 4.5Å; L380-H471 VanDerWaalsContact CB-NE2 3.26Å; L380-H471 WeakPolarHBondContact CB-NE2 3.24Å; L380-H471 WeakPolarHBondContact CD2-NE2 3.45Å; L380-F475 HydrophobicContact CD2-CD2 4.23Å; L380-F475 HydrophobicContact CD2-CE2 4.21Å; L380-F475 HydrophobicContact CD2-CG 4.46Å; L380-F475 HydrophobicContact CD2-CZ 4.38Å
381	M	91.6	Very high	92.3	Very high	90 Å²	90	57 Å²	57	44%	0.443	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-28.7	-174.1	-70.4	-87.5	71.7	0	0	113.7	T377 R378 V387 F475	T377-M381 HydrophobicContact CG2-CG 4.24Å; T377-M381 WeakPolarHBondContact O-CB 3.43Å; T377-M381 WeakPolarHBondContact O-CG 3.39Å; T377-M381 PolarHBondContact O-N 3.16Å; R378-M381 PolarHBondContact O-N 3.07Å; M381-V387 HydrophobicContact CE-CB 4.35Å; M381-V387 HydrophobicContact CE-CG1 3.82Å; M381-V387 HydrophobicContact CE-CG2 3.52Å; M381-F475 HydrophobicContact CE-CE1 3.32Å; M381-F475 HydrophobicContact CE-CZ 3.45Å; M381-F475 VanDerWaalsContact CE-CZ 3.45Å; M381-F475 HydrophobicContact CG-CZ 4.36Å; M381-F475 HydrophobicContact SD-CE1 4.15Å; M381-F475 HydrophobicContact SD-CZ 3.76Å
382	R	91.4	Very high	92.2	Very high	80 Å²	80	58.5 Å²	58.5	30%	0.302	28%	0.278	S	S	.	.	H	α-helix	trans	-78.3	-27.9	173.2	-77.2	-169.9	169.1	159.8	5.7	113.7	S142 E147 R378 L380 K384	S142-R382 WeakPolarHBondContact O-CD 3.49Å; S142-R382 PolarHBondContact O-NH1 3.25Å; E147-R382 VanDerWaalsContact CD-NH1 3.29Å; E147-R382 IonicContact OE1-CZ 3.89Å; E147-R382 IonicContact OE1-NH1 3.54Å; E147-R382 PolarHBondContact OE1-NH1 3.44Å; E147-R382 IonicContact OE1-NH2 3.89Å; E147-R382 PolarHBondContact OE1-NH2 3.39Å; E147-R382 IonicContact OE2-CZ 3.27Å; E147-R382 IonicContact OE2-NH1 2.66Å; E147-R382 PolarHBondContact OE2-NH1 3.14Å; E147-R382 IonicContact OE2-NH2 2.96Å; E147-R382 PolarHBondContact OE2-NH2 2.99Å; R378-R382 PolarHBondContact O-N 3.4Å; R378-R382 VanDerWaalsContact O-N 3.17Å; L380-R382 PolarHBondContact O-N 2.93Å; R382-K384 VanDerWaalsContact C-N 3.34Å; R382-K384 PolarHBondContact O-N 3.02Å
383	N	89.4	Confident	92	Very high	55 Å²	55	59.4 Å²	59.4	29%	0.294	28%	0.282	S	S	.	.			trans	-79.3	84.2	173.9	-170.8	-12.5	0	0	0	110.6	N379 L380 Q385 A386 V387	N379-N383 PolarHBondContact O-N 2.98Å; L380-N383 CarbonylContact O-C 3.56Å; L380-N383 WeakPolarHBondContact O-CA 3.46Å; L380-N383 PolarHBondContact O-N 3.39Å; N383-Q385 PolarHBondContact O-N 3.49Å; N383-Q385 PolarHBondContact OD1-N 3.31Å; N383-A386 HydrophobicContact CB-CB 4.07Å; N383-A386 PolarHBondContact O-N 3.37Å; N383-A386 VanDerWaalsContact O-N 3.13Å; N383-A386 PolarHBondContact OD1-N 3.05Å; N383-V387 PolarHBondContact O-N 2.9Å; N383-V387 VanDerWaalsContact O-N 3.09Å
384	K	88.5	Confident	91.6	Very high	166 Å²	166	57.1 Å²	57.1	72%	0.722	27%	0.27	S	S	*	.	H	α-helix	trans	-52.9	-41.3	-179.9	-64.5	-176.9	-178.8	179.5	0	112.6	R382 V387 I388	R382-K384 VanDerWaalsContact C-N 3.34Å; R382-K384 PolarHBondContact O-N 3.02Å; K384-V387 PolarHBondContact O-N 3Å; K384-I388 WeakPolarHBondContact O-CB 3.39Å; K384-I388 WeakPolarHBondContact O-CD1 3.45Å; K384-I388 WeakPolarHBondContact O-CG1 3.41Å; K384-I388 PolarHBondContact O-N 2.95Å
385	Q	88.7	Confident	91.4	Very high	137 Å²	137	51.8 Å²	51.8	64%	0.64	25%	0.253	S	S	*	.	H	α-helix	trans	-61.5	-47.2	-179.8	-69.1	179.3	-16	0	0	111.1	N383 I388 M389	N383-Q385 PolarHBondContact O-N 3.49Å; N383-Q385 PolarHBondContact OD1-N 3.31Å; Q385-I388 PolarHBondContact O-N 3.19Å; Q385-M389 WeakPolarHBondContact O-CB 3.21Å; Q385-M389 VanDerWaalsContact O-CG 3.29Å; Q385-M389 WeakPolarHBondContact O-CG 3.33Å; Q385-M389 PolarHBondContact O-N 2.97Å
386	A	89.5	Confident	91.3	Very high	20 Å²	20	56.6 Å²	56.6	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-45.3	178.6	0	0	0	0	0	111.8	L380 N383 I388 M389 R390	L380-A386 HydrophobicContact CD1-CB 3.56Å; N383-A386 HydrophobicContact CB-CB 4.07Å; N383-A386 PolarHBondContact O-N 3.37Å; N383-A386 VanDerWaalsContact O-N 3.13Å; N383-A386 PolarHBondContact OD1-N 3.05Å; A386-I388 PolarHBondContact O-N 3.42Å; A386-M389 PolarHBondContact O-N 3.48Å; A386-R390 VanDerWaalsContact O-CG 3.28Å; A386-R390 WeakPolarHBondContact O-CG 3.35Å; A386-R390 PolarHBondContact O-N 3.42Å
387	V	92.1	Very high	91	Very high	19 Å²	19	58.7 Å²	58.7	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-45.6	178.7	177.4	0	0	0	0	111.6	L380 M381 N383 K384 R390 L391	L380-V387 HydrophobicContact CD1-CG2 4.39Å; L380-V387 HydrophobicContact CD2-CG2 4.47Å; L380-V387 HydrophobicContact CG-CG2 3.92Å; L380-V387 WeakPolarHBondContact O-CG2 3.46Å; M381-V387 HydrophobicContact CE-CB 4.35Å; M381-V387 HydrophobicContact CE-CG1 3.82Å; M381-V387 HydrophobicContact CE-CG2 3.52Å; N383-V387 PolarHBondContact O-N 2.9Å; N383-V387 VanDerWaalsContact O-N 3.09Å; K384-V387 PolarHBondContact O-N 3Å; V387-R390 PolarHBondContact O-N 3.25Å; V387-L391 HydrophobicContact CG1-CD1 3.96Å; V387-L391 WeakPolarHBondContact O-CG 3.38Å; V387-L391 PolarHBondContact O-N 3.24Å; V387-L391 VanDerWaalsContact O-N 3.14Å
388	I	92.7	Very high	90.8	Very high	101 Å²	101	56.6 Å²	56.6	52%	0.518	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-48	178.3	-69.7	166.8	0	0	0	110.2	K384 Q385 A386 R390 L391 V392	K384-I388 WeakPolarHBondContact O-CB 3.39Å; K384-I388 WeakPolarHBondContact O-CD1 3.45Å; K384-I388 WeakPolarHBondContact O-CG1 3.41Å; K384-I388 PolarHBondContact O-N 2.95Å; Q385-I388 PolarHBondContact O-N 3.19Å; A386-I388 PolarHBondContact O-N 3.42Å; I388-R390 VanDerWaalsContact C-N 3.33Å; I388-R390 PolarHBondContact O-N 2.57Å; I388-L391 PolarHBondContact O-N 3.02Å; I388-V392 HydrophobicContact CG2-CG2 4.08Å; I388-V392 VanDerWaalsContact O-CB 3.27Å; I388-V392 WeakPolarHBondContact O-CB 3.22Å; I388-V392 VanDerWaalsContact O-CG2 3.32Å; I388-V392 WeakPolarHBondContact O-CG2 3.47Å; I388-V392 PolarHBondContact O-N 3.28Å
389	M	90.7	Very high	90.7	Very high	114 Å²	114	56.9 Å²	56.9	56%	0.562	28%	0.282	S	S	*	.	H	α-helix	trans	-59	-43.8	179	-72.6	-63.5	-74	0	0	111.9	Q385 A386 L391 Q393	Q385-M389 WeakPolarHBondContact O-CB 3.21Å; Q385-M389 VanDerWaalsContact O-CG 3.29Å; Q385-M389 WeakPolarHBondContact O-CG 3.33Å; Q385-M389 PolarHBondContact O-N 2.97Å; A386-M389 PolarHBondContact O-N 3.48Å; M389-L391 PolarHBondContact O-N 3.11Å; M389-Q393 WeakPolarHBondContact O-CB 3.4Å; M389-Q393 WeakPolarHBondContact O-CG 3.08Å; M389-Q393 PolarHBondContact O-N 3.49Å
390	R	91.3	Very high	90.6	Very high	7 Å²	7	61.8 Å²	61.8	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-40.4	179.3	-68.1	-169.8	78.5	94.5	21.7	113.2	A386 V387 I388 N438 Y468 V472 A479 E515	A386-R390 VanDerWaalsContact O-CG 3.28Å; A386-R390 WeakPolarHBondContact O-CG 3.35Å; A386-R390 PolarHBondContact O-N 3.42Å; V387-R390 PolarHBondContact O-N 3.25Å; I388-R390 VanDerWaalsContact C-N 3.33Å; I388-R390 PolarHBondContact O-N 2.57Å; R390-N438 WeakPolarHBondContact CG-OD1 3.49Å; R390-N438 PolarHBondContact NH2-ND2 3.4Å; R390-N438 VanDerWaalsContact NH2-ND2 3.12Å; R390-Y468 PolarHBondContact NH1-OH 3.09Å; R390-V472 VanDerWaalsContact CZ-CG2 3.44Å; R390-A479 WeakPolarHBondContact O-CB 3.49Å; R390-E515 IonicContact CZ-OE1 2.74Å; R390-E515 IonicContact CZ-OE2 3.79Å; R390-E515 IonicContact NH1-OE1 2.66Å; R390-E515 PolarHBondContact NH1-OE1 3.22Å; R390-E515 VanDerWaalsContact NH1-OE1 3.17Å; R390-E515 IonicContact NH2-OE1 3.36Å; R390-E515 PolarHBondContact NH2-OE1 3.28Å; R390-E515 IonicContact NH2-OE2 3.2Å; R390-E515 PolarHBondContact NH2-OE2 3.43Å
391	L	90.1	Very high	90.6	Very high	42 Å²	42	62.5 Å²	62.5	22%	0.22	31%	0.307	C	S	.	.	H	α-helix	trans	-80.8	-37.4	-177.1	-66.1	176.1	0	0	0	112.6	V387 I388 M389 I478 A479	V387-L391 HydrophobicContact CG1-CD1 3.96Å; V387-L391 WeakPolarHBondContact O-CG 3.38Å; V387-L391 PolarHBondContact O-N 3.24Å; V387-L391 VanDerWaalsContact O-N 3.14Å; I388-L391 PolarHBondContact O-N 3.02Å; M389-L391 PolarHBondContact O-N 3.11Å; L391-I478 HydrophobicContact CD2-CB 4.25Å; L391-I478 HydrophobicContact CD2-CG2 3.89Å; L391-A479 HydrophobicContact CD2-CB 4.26Å
392	V	90.7	Very high	90.6	Very high	59 Å²	59	59.3 Å²	59.3	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-93.4	-28.2	-168.7	179.4	0	0	0	0	112.9	I388 N394 L395 I396	I388-V392 HydrophobicContact CG2-CG2 4.08Å; I388-V392 VanDerWaalsContact O-CB 3.27Å; I388-V392 WeakPolarHBondContact O-CB 3.22Å; I388-V392 VanDerWaalsContact O-CG2 3.32Å; I388-V392 WeakPolarHBondContact O-CG2 3.47Å; I388-V392 PolarHBondContact O-N 3.28Å; V392-N394 VanDerWaalsContact C-N 3.32Å; V392-N394 PolarHBondContact O-N 3.41Å; V392-L395 CarbonylContact O-C 3.53Å; V392-L395 WeakPolarHBondContact O-CA 3.06Å; V392-L395 WeakPolarHBondContact O-CB 3.44Å; V392-L395 PolarHBondContact O-N 3.2Å; V392-I396 HydrophobicContact CG1-CD1 3.79Å; V392-I396 HydrophobicContact CG1-CG1 3.85Å; V392-I396 WeakPolarHBondContact O-CG1 3.32Å; V392-I396 PolarHBondContact O-N 3.35Å
393	Q	91.3	Very high	90.6	Very high	19 Å²	19	62.8 Å²	62.8	9%	0.089	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-37	-174.9	69.7	-178.6	-5.4	0	0	114.1	M389 L395 I396 M397 T434 N438	M389-Q393 WeakPolarHBondContact O-CB 3.4Å; M389-Q393 WeakPolarHBondContact O-CG 3.08Å; M389-Q393 PolarHBondContact O-N 3.49Å; Q393-L395 VanDerWaalsContact C-N 3.34Å; Q393-I396 PolarHBondContact O-N 3.23Å; Q393-M397 PolarHBondContact O-N 3.37Å; Q393-M397 VanDerWaalsContact O-N 3.14Å; Q393-T434 HydrophobicContact CG-CG2 4.16Å; Q393-T434 PolarHBondContact NE2-O 2.96Å; Q393-N438 PolarHBondContact NE2-ND2 3.17Å; Q393-N438 PolarHBondContact NE2-OD1 2.93Å
394	N	88.6	Confident	90.7	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-44.1	176.8	-76.8	-9.4	0	0	0	109.2	V392 I396 M397 G398 T434 F483 H511	V392-N394 VanDerWaalsContact C-N 3.32Å; V392-N394 PolarHBondContact O-N 3.41Å; N394-I396 VanDerWaalsContact C-N 3.35Å; N394-I396 PolarHBondContact O-N 3.32Å; N394-M397 WeakPolarHBondContact O-CB 3.18Å; N394-M397 PolarHBondContact O-N 3.28Å; N394-G398 PolarHBondContact O-N 3.33Å; N394-T434 WeakPolarHBondContact OD1-CB 3.39Å; N394-T434 VanDerWaalsContact OD1-CG2 3.28Å; N394-T434 WeakPolarHBondContact OD1-CG2 3.48Å; N394-T434 PolarHBondContact OD1-OG1 3.45Å; N394-F483 VanDerWaalsContact C-CD2 3.47Å; N394-F483 HydrophobicContact CB-CB 3.78Å; N394-F483 HydrophobicContact CB-CD1 4.42Å; N394-F483 HydrophobicContact CB-CD2 4.3Å; N394-F483 HydrophobicContact CB-CG 3.94Å; N394-F483 WeakPolarHBondContact O-CD2 3.43Å; N394-F483 WeakPolarHBondContact O-CE2 3.49Å; N394-H511 PolarHBondContact ND2-CE1 3.47Å
395	L	91.2	Very high	90.6	Very high	35 Å²	35	61.8 Å²	61.8	18%	0.183	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-40.9	175.7	-177.5	66	0	0	0	112.1	V392 Q393 M397 G398 L399 I482 V486	V392-L395 CarbonylContact O-C 3.53Å; V392-L395 WeakPolarHBondContact O-CA 3.06Å; V392-L395 WeakPolarHBondContact O-CB 3.44Å; V392-L395 PolarHBondContact O-N 3.2Å; Q393-L395 VanDerWaalsContact C-N 3.34Å; L395-M397 VanDerWaalsContact C-N 3.33Å; L395-M397 PolarHBondContact O-N 3.38Å; L395-G398 CarbonylContact O-C 3.58Å; L395-G398 WeakPolarHBondContact O-CA 3.16Å; L395-G398 PolarHBondContact O-N 3.41Å; L395-L399 HydrophobicContact CD1-CG 4.35Å; L395-L399 HydrophobicContact CG-CD1 4.08Å; L395-L399 HydrophobicContact CG-CG 4.31Å; L395-L399 WeakPolarHBondContact O-CG 3.43Å; L395-L399 PolarHBondContact O-N 2.65Å; L395-I482 HydrophobicContact CD2-CG2 4.34Å; L395-V486 HydrophobicContact CD1-CB 3.73Å; L395-V486 HydrophobicContact CD1-CG1 3.92Å; L395-V486 HydrophobicContact CD1-CG2 3.74Å
396	I	92	Very high	90.5	Very high	101 Å²	101	61.3 Å²	61.3	52%	0.518	30%	0.302	S	S	.	.	H	α-helix	trans	-58.9	-45.7	176.2	-69.2	167.5	0	0	0	110.7	V392 Q393 N394 G398 L399 F400	V392-I396 HydrophobicContact CG1-CD1 3.79Å; V392-I396 HydrophobicContact CG1-CG1 3.85Å; V392-I396 WeakPolarHBondContact O-CG1 3.32Å; V392-I396 PolarHBondContact O-N 3.35Å; Q393-I396 PolarHBondContact O-N 3.23Å; N394-I396 VanDerWaalsContact C-N 3.35Å; N394-I396 PolarHBondContact O-N 3.32Å; I396-G398 PolarHBondContact O-N 2.97Å; I396-L399 PolarHBondContact O-N 3.47Å; I396-F400 WeakPolarHBondContact O-CB 3.3Å; I396-F400 PolarHBondContact O-N 3.35Å
397	M	88.8	Confident	90.4	Very high	48 Å²	48	69.1 Å²	69.1	24%	0.236	33%	0.327	C	S	.	.	H	α-helix	trans	-59.7	-39.2	175	-178	62.3	62.1	0	0	111.5	Q393 N394 L395 F400 L401 A430	Q393-M397 PolarHBondContact O-N 3.37Å; Q393-M397 VanDerWaalsContact O-N 3.14Å; N394-M397 WeakPolarHBondContact O-CB 3.18Å; N394-M397 PolarHBondContact O-N 3.28Å; L395-M397 VanDerWaalsContact C-N 3.33Å; L395-M397 PolarHBondContact O-N 3.38Å; M397-F400 PolarHBondContact O-N 3.27Å; M397-L401 WeakPolarHBondContact O-CG 3.35Å; M397-L401 PolarHBondContact O-N 2.89Å; M397-A430 HydrophobicContact CE-CB 3.87Å; M397-A430 HydrophobicContact CG-CB 3.67Å; M397-A430 HydrophobicContact SD-CB 3.76Å
398	G	89.6	Confident	90.1	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-49	176.4	0	0	0	0	0	114.1	N394 L395 I396 F400 L401 I402 F483 C487	N394-G398 PolarHBondContact O-N 3.33Å; L395-G398 CarbonylContact O-C 3.58Å; L395-G398 WeakPolarHBondContact O-CA 3.16Å; L395-G398 PolarHBondContact O-N 3.41Å; I396-G398 PolarHBondContact O-N 2.97Å; G398-F400 VanDerWaalsContact C-N 3.29Å; G398-F400 PolarHBondContact O-N 3.48Å; G398-L401 PolarHBondContact O-N 3.39Å; G398-L401 VanDerWaalsContact O-N 3.15Å; G398-I402 WeakPolarHBondContact O-CD1 3.36Å; G398-I402 VanDerWaalsContact O-CG1 3.24Å; G398-I402 WeakPolarHBondContact O-CG1 3.1Å; G398-I402 PolarHBondContact O-N 3.34Å; G398-F483 VanDerWaalsContact CA-CE2 3.43Å; G398-C487 WeakPolarHBondContact CA-SG 3.33Å
399	L	91.9	Very high	89.7	Confident	89 Å²	89	67.9 Å²	67.9	47%	0.466	32%	0.319	S	S	.	.	H	α-helix	trans	-62.1	-38.8	176	-69.2	172.8	0	0	0	111.4	L395 I396 L401 I402 F403 V486	L395-L399 HydrophobicContact CD1-CG 4.35Å; L395-L399 HydrophobicContact CG-CD1 4.08Å; L395-L399 HydrophobicContact CG-CG 4.31Å; L395-L399 WeakPolarHBondContact O-CG 3.43Å; L395-L399 PolarHBondContact O-N 2.65Å; I396-L399 PolarHBondContact O-N 3.47Å; L399-L401 VanDerWaalsContact C-N 3.34Å; L399-L401 PolarHBondContact O-N 2.9Å; L399-I402 HydrophobicContact CD2-CD1 4.31Å; L399-I402 PolarHBondContact O-N 3.04Å; L399-F403 WeakPolarHBondContact O-CB 3.43Å; L399-F403 PolarHBondContact O-N 2.76Å; L399-V486 HydrophobicContact CD2-CG1 4.31Å
400	F	92	Very high	89.1	Confident	111 Å²	111	66.2 Å²	66.2	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-59.1	-45.4	173.1	-177.6	-97.2	0	0	0	111.1	I396 M397 G398 F403 Y404	I396-F400 WeakPolarHBondContact O-CB 3.3Å; I396-F400 PolarHBondContact O-N 3.35Å; M397-F400 PolarHBondContact O-N 3.27Å; G398-F400 VanDerWaalsContact C-N 3.29Å; G398-F400 PolarHBondContact O-N 3.48Å; F400-F403 PolarHBondContact O-N 2.91Å; F400-Y404 HydrophobicContact CD2-CE2 4.09Å; F400-Y404 HydrophobicContact CE1-CD2 4.27Å; F400-Y404 HydrophobicContact CE1-CE2 4.12Å; F400-Y404 HydrophobicContact CE2-CD2 4.34Å; F400-Y404 AromaticContact CE2-CE2 3.54Å; F400-Y404 HydrophobicContact CE2-CE2 3.54Å; F400-Y404 HydrophobicContact CZ-CD2 4.16Å; F400-Y404 AromaticContact CZ-CE2 3.55Å; F400-Y404 HydrophobicContact CZ-CE2 3.55Å; F400-Y404 WeakPolarHBondContact O-CD2 3.14Å
401	L	90.6	Very high	88.5	Confident	16 Å²	16	68.6 Å²	68.6	8%	0.084	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-43.5	176.6	-74.3	171.1	0	0	0	113.2	M397 G398 L399 F403 Y404 L405 L423 Q426 L427	M397-L401 WeakPolarHBondContact O-CG 3.35Å; M397-L401 PolarHBondContact O-N 2.89Å; G398-L401 PolarHBondContact O-N 3.39Å; G398-L401 VanDerWaalsContact O-N 3.15Å; L399-L401 VanDerWaalsContact C-N 3.34Å; L399-L401 PolarHBondContact O-N 2.9Å; L401-F403 VanDerWaalsContact C-N 3.26Å; L401-F403 PolarHBondContact O-N 2.89Å; L401-Y404 PolarHBondContact O-N 2.98Å; L401-L405 PolarHBondContact O-N 3.18Å; L401-L423 HydrophobicContact CB-CD1 4.45Å; L401-L423 HydrophobicContact CD1-CD1 4.19Å; L401-Q426 HydrophobicContact CD1-CB 4.22Å; L401-Q426 HydrophobicContact CD1-CG 3.9Å; L401-Q426 HydrophobicContact CD2-CB 3.94Å; L401-Q426 HydrophobicContact CD2-CG 3.54Å; L401-Q426 HydrophobicContact CG-CG 4.16Å; L401-L427 HydrophobicContact CD1-CD2 3.9Å; L401-L427 HydrophobicContact CD1-CG 4.33Å
402	I	91.6	Very high	87.8	Confident	24 Å²	24	67 Å²	67	12%	0.123	32%	0.317	C	S	.	.	H	α-helix	trans	-58.3	-41.2	176.5	-70.1	161.8	0	0	0	110.7	G398 L399 Y404 L406 V486 T490 L491	G398-I402 WeakPolarHBondContact O-CD1 3.36Å; G398-I402 VanDerWaalsContact O-CG1 3.24Å; G398-I402 WeakPolarHBondContact O-CG1 3.1Å; G398-I402 PolarHBondContact O-N 3.34Å; L399-I402 HydrophobicContact CD2-CD1 4.31Å; L399-I402 PolarHBondContact O-N 3.04Å; I402-Y404 VanDerWaalsContact C-N 3.33Å; I402-Y404 PolarHBondContact O-N 2.85Å; I402-L406 WeakPolarHBondContact O-CA 3.38Å; I402-L406 PolarHBondContact O-N 2.93Å; I402-V486 HydrophobicContact CD1-CG1 4.06Å; I402-T490 HydrophobicContact CD1-CG2 4.15Å; I402-T490 HydrophobicContact CG1-CG2 4.27Å; I402-T490 HydrophobicContact CG2-CG2 3.63Å; I402-L491 HydrophobicContact CG1-CD1 4.48Å; I402-L491 HydrophobicContact CG1-CD2 4.11Å; I402-L491 HydrophobicContact CG1-CG 4.07Å
403	F	92.3	Very high	86.8	Confident	152 Å²	152	68.3 Å²	68.3	67%	0.667	32%	0.322	S	S	*	.	H	α-helix	trans	-60.5	-40.4	-178.7	178.5	-99.7	0	0	0	112.6	L399 F400 L401	L399-F403 WeakPolarHBondContact O-CB 3.43Å; L399-F403 PolarHBondContact O-N 2.76Å; F400-F403 PolarHBondContact O-N 2.91Å; L401-F403 VanDerWaalsContact C-N 3.26Å; L401-F403 PolarHBondContact O-N 2.89Å
404	Y	89.6	Confident	85.9	Confident	157 Å²	157	73.5 Å²	73.5	62%	0.616	34%	0.344	S	S	*	.	H	α-helix	trans	-84.2	-42	-179.5	-77	-82.8	0	0	0	113.7	F400 L401 I402	F400-Y404 HydrophobicContact CD2-CE2 4.09Å; F400-Y404 HydrophobicContact CE1-CD2 4.27Å; F400-Y404 HydrophobicContact CE1-CE2 4.12Å; F400-Y404 HydrophobicContact CE2-CD2 4.34Å; F400-Y404 AromaticContact CE2-CE2 3.54Å; F400-Y404 HydrophobicContact CE2-CE2 3.54Å; F400-Y404 HydrophobicContact CZ-CD2 4.16Å; F400-Y404 AromaticContact CZ-CE2 3.55Å; F400-Y404 HydrophobicContact CZ-CE2 3.55Å; F400-Y404 WeakPolarHBondContact O-CD2 3.14Å; L401-Y404 PolarHBondContact O-N 2.98Å; I402-Y404 VanDerWaalsContact C-N 3.33Å; I402-Y404 PolarHBondContact O-N 2.85Å
405	L	87.5	Confident	85.5	Confident	44 Å²	44	74.1 Å²	74.1	23%	0.23	35%	0.351	C	S	.	.	H	α-helix	trans	-84.9	-20.5	-174.4	-69.5	172.6	0	0	0	113.3	L401 D419 L423 L491	L401-L405 PolarHBondContact O-N 3.18Å; L405-D419 HydrophobicContact CD2-CB 4.24Å; L405-L423 HydrophobicContact CD1-CB 3.79Å; L405-L423 HydrophobicContact CD1-CD1 3.91Å; L405-L423 HydrophobicContact CD1-CG 4.38Å; L405-L491 HydrophobicContact CB-CD2 4.26Å
406	L	86.7	Confident	85.2	Confident	126 Å²	126	72.4 Å²	72.4	66%	0.66	34%	0.342	S	S	*	.			trans	49.6	-149.5	-169.1	-66.7	158.8	0	0	0	110	I402 L491	I402-L406 WeakPolarHBondContact O-CA 3.38Å; I402-L406 PolarHBondContact O-N 2.93Å; L406-L491 WeakPolarHBondContact O-CD2 3.45Å
407	R	87.4	Confident	84.9	Confident	184 Å²	184	68.8 Å²	68.8	69%	0.694	33%	0.325	S	S	*	.	S	Bend	trans	-79.7	127.6	175	-169.3	175.4	-176.7	178	2.6	110.1	Q409	R407-Q409 PolarHBondContact O-N 3.26Å
408	V	85.7	Confident	84.8	Confident	9 Å²	9	72.7 Å²	72.7	6%	0.055	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-62.6	130	178.9	179.5	0	0	0	0	109.9	R420 L491	V408-R420 HydrophobicContact CG1-CG 3.61Å; V408-R420 VanDerWaalsContact CG1-CZ 3.41Å; V408-L491 WeakPolarHBondContact CB-O 3.47Å; V408-L491 HydrophobicContact CG2-CB 4.35Å; V408-L491 WeakPolarHBondContact CG2-O 3.43Å; V408-L491 PolarHBondContact N-O 2.79Å
409	Q	83.3	Confident	84.8	Confident	86 Å²	86	74.9 Å²	74.9	40%	0.402	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-91.3	157.1	179.9	-57.2	-170.1	17	0	0	111.3	R407 A416 R420	R407-Q409 PolarHBondContact O-N 3.26Å; Q409-A416 VanDerWaalsContact O-CA 3.29Å; Q409-A416 WeakPolarHBondContact O-CA 3.38Å; Q409-A416 WeakPolarHBondContact O-CB 3.42Å; Q409-R420 PolarHBondContact O-NH1 2.89Å
410	N	80	Confident	84.7	Confident	79 Å²	79	70.8 Å²	70.8	42%	0.422	33%	0.332	S	S	.	.	S	Bend	trans	-95.2	-7.1	177.1	-70.4	-11.8	0	0	0	113.4	T412 R420 T587	N410-T412 PolarHBondContact O-N 2.71Å; N410-R420 PolarHBondContact OD1-NH2 3.46Å; N410-T587 PolarHBondContact O-N 3.06Å; N410-T587 PolarHBondContact O-OG1 3.35Å
411	N	78.6	Confident	84.7	Confident	56 Å²	56	66.7 Å²	66.7	30%	0.299	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-78.1	117	178.3	-73.2	-25.8	0	0	0	110.6	L413 K414 A416 T587	N411-L413 VanDerWaalsContact C-N 3.29Å; N411-L413 PolarHBondContact O-N 3.14Å; N411-K414 HydrophobicContact CB-CB 4.08Å; N411-K414 HydrophobicContact CB-CD 4.24Å; N411-K414 HydrophobicContact CB-CG 4.06Å; N411-K414 PolarHBondContact O-N 3.47Å; N411-A416 VanDerWaalsContact O-CB 3.31Å; N411-A416 WeakPolarHBondContact O-CB 3.47Å; N411-A416 PolarHBondContact O-N 3.2Å; N411-T587 CarbonylContact C-O 3.49Å; N411-T587 VanDerWaalsContact CA-O 3.28Å; N411-T587 WeakPolarHBondContact CA-O 3.47Å; N411-T587 PolarHBondContact OD1-OG1 3.36Å
412	T	75	Confident	84.7	Confident	8 Å²	8	67.9 Å²	67.9	5%	0.049	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-57.5	-41.4	179.6	53.4	0	0	0	0	112.3	N410 K414 G415 F586 T587 C588	N410-T412 PolarHBondContact O-N 2.71Å; T412-K414 PolarHBondContact O-N 3Å; T412-K414 VanDerWaalsContact O-N 3.15Å; T412-G415 PolarHBondContact O-N 3.31Å; T412-G415 VanDerWaalsContact O-N 3.1Å; T412-F586 HydrophobicContact CG2-CB 3.4Å; T412-F586 HydrophobicContact CG2-CG 4.2Å; T412-T587 PolarHBondContact N-O 3.42Å; T412-T587 PolarHBondContact OG1-O 2.66Å; T412-C588 VanDerWaalsContact OG1-CA 3.3Å; T412-C588 WeakPolarHBondContact OG1-CA 3.4Å; T412-C588 WeakPolarHBondContact OG1-CB 3.16Å
413	L	68.9	Low	84.8	Confident	87 Å²	87	66.7 Å²	66.7	46%	0.455	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-59.9	-21.3	175.1	-85.7	149.8	0	0	0	114.1	N411	N411-L413 VanDerWaalsContact C-N 3.29Å; N411-L413 PolarHBondContact O-N 3.14Å
414	K	72.5	Confident	84.8	Confident	128 Å²	128	59.6 Å²	59.6	56%	0.557	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-102	15.3	179.1	-63.5	-170.6	176.6	-174.4	0	113.1	N411 T412	N411-K414 HydrophobicContact CB-CB 4.08Å; N411-K414 HydrophobicContact CB-CD 4.24Å; N411-K414 HydrophobicContact CB-CG 4.06Å; N411-K414 PolarHBondContact O-N 3.47Å; T412-K414 PolarHBondContact O-N 3Å; T412-K414 VanDerWaalsContact O-N 3.15Å
415	G	80.4	Confident	85	Confident	16 Å²	16	54.3 Å²	54.3	17%	0.165	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	13.3	175.4	0	0	0	0	0	115.4	T412 V417 Q418 D419	T412-G415 PolarHBondContact O-N 3.31Å; T412-G415 VanDerWaalsContact O-N 3.1Å; G415-V417 VanDerWaalsContact C-N 3.27Å; G415-V417 PolarHBondContact O-N 3.42Å; G415-Q418 PolarHBondContact O-N 3.01Å; G415-D419 VanDerWaalsContact O-CG 3.29Å; G415-D419 PolarHBondContact O-N 3.14Å
416	A	84.1	Confident	85.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-47.1	-41.7	-173	0	0	0	0	0	115.9	Q409 N411 R420 F586	Q409-A416 VanDerWaalsContact O-CA 3.29Å; Q409-A416 WeakPolarHBondContact O-CA 3.38Å; Q409-A416 WeakPolarHBondContact O-CB 3.42Å; N411-A416 VanDerWaalsContact O-CB 3.31Å; N411-A416 WeakPolarHBondContact O-CB 3.47Å; N411-A416 PolarHBondContact O-N 3.2Å; A416-R420 WeakPolarHBondContact O-CG 3.48Å; A416-R420 PolarHBondContact O-NH1 3.28Å; A416-F586 HydrophobicContact CB-CD1 4.09Å; A416-F586 HydrophobicContact CB-CE1 4.46Å
417	V	85.9	Confident	85.5	Confident	25 Å²	25	49.8 Å²	49.8	15%	0.152	25%	0.249	C	C	.	.	H	α-helix	trans	-82	-43.4	178.7	179.1	0	0	0	0	110.8	G415 D419 R420 V421 F581 F586 F609	G415-V417 VanDerWaalsContact C-N 3.27Å; G415-V417 PolarHBondContact O-N 3.42Å; V417-D419 PolarHBondContact O-N 3.24Å; V417-R420 PolarHBondContact O-N 3.24Å; V417-V421 HydrophobicContact CG1-CG2 4.2Å; V417-V421 WeakPolarHBondContact O-CB 3.32Å; V417-V421 VanDerWaalsContact O-CG2 3.24Å; V417-V421 WeakPolarHBondContact O-CG2 3.49Å; V417-V421 PolarHBondContact O-N 3.37Å; V417-F581 HydrophobicContact CG1-CE1 4.1Å; V417-F581 HydrophobicContact CG1-CZ 4.28Å; V417-F581 HydrophobicContact CG2-CE1 4.43Å; V417-F586 HydrophobicContact CG2-CD2 4.06Å; V417-F586 HydrophobicContact CG2-CE2 3.82Å; V417-F586 HydrophobicContact CG2-CZ 4.09Å; V417-F609 HydrophobicContact CG1-CD2 3.58Å; V417-F609 HydrophobicContact CG1-CE2 3.5Å; V417-F609 VanDerWaalsContact CG1-CE2 3.5Å; V417-F609 HydrophobicContact CG1-CG 4.18Å; V417-F609 HydrophobicContact CG1-CZ 4.04Å
418	Q	86.9	Confident	85.8	Confident	129 Å²	129	41 Å²	41	60%	0.603	22%	0.216	S	C	*	.	H	α-helix	trans	-63.9	-41.2	-177.1	-176.5	171.6	-23.3	0	0	112.1	G415 V421 G422	G415-Q418 PolarHBondContact O-N 3.01Å; Q418-V421 PolarHBondContact O-N 2.92Å; Q418-G422 PolarHBondContact O-N 2.82Å
419	D	90.2	Very high	86.1	Confident	47 Å²	47	41.2 Å²	41.2	25%	0.251	22%	0.219	S	C	.	.	H	α-helix	trans	-64.9	-42.4	177.9	-64.1	-18.3	0	0	0	111.2	L405 G415 V417 G422 L423	L405-D419 HydrophobicContact CD2-CB 4.24Å; G415-D419 VanDerWaalsContact O-CG 3.29Å; G415-D419 PolarHBondContact O-N 3.14Å; V417-D419 PolarHBondContact O-N 3.24Å; D419-G422 PolarHBondContact O-N 3.38Å; D419-L423 VanDerWaalsContact O-CB 3.24Å; D419-L423 WeakPolarHBondContact O-CB 3.19Å; D419-L423 PolarHBondContact O-N 3.38Å
420	R	90.7	Very high	86.5	Confident	3 Å²	3	37.4 Å²	37.4	1%	0.011	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-44	175	-72.8	-179.7	173.6	86.3	-2.1	111.7	V408 Q409 N410 A416 V417 L423 L424 E580 F581	V408-R420 HydrophobicContact CG1-CG 3.61Å; V408-R420 VanDerWaalsContact CG1-CZ 3.41Å; Q409-R420 PolarHBondContact O-NH1 2.89Å; N410-R420 PolarHBondContact OD1-NH2 3.46Å; A416-R420 WeakPolarHBondContact O-CG 3.48Å; A416-R420 PolarHBondContact O-NH1 3.28Å; V417-R420 PolarHBondContact O-N 3.24Å; R420-L423 WeakPolarHBondContact O-CB 3.48Å; R420-L423 PolarHBondContact O-N 2.84Å; R420-L424 WeakPolarHBondContact O-CB 3.38Å; R420-L424 VanDerWaalsContact O-CG 3.29Å; R420-L424 WeakPolarHBondContact O-CG 3.33Å; R420-L424 PolarHBondContact O-N 2.87Å; R420-E580 WeakPolarHBondContact CD-OE1 3.3Å; R420-E580 IonicContact CZ-OE1 3.59Å; R420-E580 IonicContact NE-OE1 3.13Å; R420-E580 PolarHBondContact NE-OE1 2.96Å; R420-E580 IonicContact NH2-OE1 2.92Å; R420-F581 HydrophobicContact CB-CE2 4.43Å; R420-F581 HydrophobicContact CB-CZ 3.9Å
421	V	90.8	Very high	87.1	Confident	25 Å²	25	33.9 Å²	33.9	15%	0.152	18%	0.184	C	C	.	.	H	α-helix	trans	-63.9	-45.6	178.5	171.3	0	0	0	0	110.8	V417 Q418 L423 L424 Y425 F549 F581 F609	V417-V421 HydrophobicContact CG1-CG2 4.2Å; V417-V421 WeakPolarHBondContact O-CB 3.32Å; V417-V421 VanDerWaalsContact O-CG2 3.24Å; V417-V421 WeakPolarHBondContact O-CG2 3.49Å; V417-V421 PolarHBondContact O-N 3.37Å; Q418-V421 PolarHBondContact O-N 2.92Å; V421-L423 VanDerWaalsContact C-N 3.34Å; V421-L423 PolarHBondContact O-N 2.8Å; V421-L424 PolarHBondContact O-N 3.27Å; V421-Y425 VanDerWaalsContact O-CB 3.25Å; V421-Y425 WeakPolarHBondContact O-CB 3.41Å; V421-Y425 PolarHBondContact O-N 2.8Å; V421-F549 HydrophobicContact CG1-CB 3.73Å; V421-F549 HydrophobicContact CG1-CD1 3.87Å; V421-F549 HydrophobicContact CG1-CD2 4.06Å; V421-F549 HydrophobicContact CG1-CE1 4.46Å; V421-F549 HydrophobicContact CG1-CG 3.64Å; V421-F581 HydrophobicContact CG2-CZ 4.36Å; V421-F609 HydrophobicContact CG2-CE1 3.89Å; V421-F609 HydrophobicContact CG2-CE2 4.09Å; V421-F609 HydrophobicContact CG2-CZ 3.29Å
422	G	91.2	Very high	87.9	Confident	40 Å²	40	31.2 Å²	31.2	41%	0.412	17%	0.169	S	C	.	.	H	α-helix	trans	-61.1	-42.2	175.8	0	0	0	0	0	112.4	Q418 D419 Y425 Q426	Q418-G422 PolarHBondContact O-N 2.82Å; D419-G422 PolarHBondContact O-N 3.38Å; G422-Y425 PolarHBondContact O-N 3.36Å; G422-Q426 WeakPolarHBondContact O-CB 3.4Å; G422-Q426 PolarHBondContact O-N 3.02Å
423	L	92.8	Very high	88.7	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-55.6	173.7	174.7	67.1	0	0	0	111.6	L401 L405 D419 R420 V421 Y425 Q426 L427 L491 L493	L401-L423 HydrophobicContact CB-CD1 4.45Å; L401-L423 HydrophobicContact CD1-CD1 4.19Å; L405-L423 HydrophobicContact CD1-CB 3.79Å; L405-L423 HydrophobicContact CD1-CD1 3.91Å; L405-L423 HydrophobicContact CD1-CG 4.38Å; D419-L423 VanDerWaalsContact O-CB 3.24Å; D419-L423 WeakPolarHBondContact O-CB 3.19Å; D419-L423 PolarHBondContact O-N 3.38Å; R420-L423 WeakPolarHBondContact O-CB 3.48Å; R420-L423 PolarHBondContact O-N 2.84Å; V421-L423 VanDerWaalsContact C-N 3.34Å; V421-L423 PolarHBondContact O-N 2.8Å; L423-Y425 VanDerWaalsContact C-N 3.3Å; L423-Y425 PolarHBondContact O-N 3.5Å; L423-Q426 PolarHBondContact O-N 3.46Å; L423-L427 HydrophobicContact CD1-CD1 3.97Å; L423-L427 HydrophobicContact CD1-CG 4.12Å; L423-L427 HydrophobicContact CG-CD1 3.88Å; L423-L427 HydrophobicContact CG-CG 4.39Å; L423-L427 WeakPolarHBondContact O-CB 3.23Å; L423-L427 WeakPolarHBondContact O-CG 3.49Å; L423-L427 PolarHBondContact O-N 3.4Å; L423-L491 HydrophobicContact CD1-CD1 3.49Å; L423-L491 VanDerWaalsContact CD1-CD1 3.49Å; L423-L491 HydrophobicContact CD2-CD1 3.66Å; L423-L491 HydrophobicContact CG-CD1 4.2Å; L423-L493 HydrophobicContact CD2-CD1 4.33Å; L423-L493 HydrophobicContact CD2-CD2 4.01Å
424	L	92.8	Very high	89.8	Confident	2 Å²	2	31 Å²	31	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-61.2	-40.1	-179	-66.6	-176.2	0	0	0	111.4	R420 V421 L427 V428 F503 F549 L576 V577 F581	R420-L424 WeakPolarHBondContact O-CB 3.38Å; R420-L424 VanDerWaalsContact O-CG 3.29Å; R420-L424 WeakPolarHBondContact O-CG 3.33Å; R420-L424 PolarHBondContact O-N 2.87Å; V421-L424 PolarHBondContact O-N 3.27Å; L424-L427 HydrophobicContact CD2-CD1 4.35Å; L424-L427 PolarHBondContact O-N 2.94Å; L424-V428 WeakPolarHBondContact O-CG2 2.98Å; L424-V428 PolarHBondContact O-N 3.17Å; L424-V428 VanDerWaalsContact O-N 3.08Å; L424-F503 HydrophobicContact CD2-CE2 4.35Å; L424-F549 HydrophobicContact CB-CE2 3.92Å; L424-F549 HydrophobicContact CB-CZ 4.1Å; L424-F549 HydrophobicContact CD1-CZ 4.35Å; L424-L576 HydrophobicContact CD1-CB 4.12Å; L424-L576 HydrophobicContact CD2-CB 3.94Å; L424-L576 HydrophobicContact CD2-CD1 4.26Å; L424-L576 HydrophobicContact CD2-CG 4.49Å; L424-V577 HydrophobicContact CD1-CG2 4.19Å; L424-F581 HydrophobicContact CD1-CE2 4.32Å
425	Y	93.1	Very high	90.8	Very high	47 Å²	47	25 Å²	25	18%	0.184	14%	0.137	C	C	.	.	H	α-helix	trans	-57.8	-50.5	174.8	-173.7	-93.8	0	0	0	111.1	V421 G422 L423 L427 V428 G429 L543 F549 I550	V421-Y425 VanDerWaalsContact O-CB 3.25Å; V421-Y425 WeakPolarHBondContact O-CB 3.41Å; V421-Y425 PolarHBondContact O-N 2.8Å; G422-Y425 PolarHBondContact O-N 3.36Å; L423-Y425 VanDerWaalsContact C-N 3.3Å; L423-Y425 PolarHBondContact O-N 3.5Å; Y425-L427 PolarHBondContact O-N 3.44Å; Y425-V428 PolarHBondContact O-N 3.38Å; Y425-G429 PolarHBondContact O-N 3.34Å; Y425-L543 HydrophobicContact CD1-CD2 3.77Å; Y425-L543 HydrophobicContact CD2-CD1 4.07Å; Y425-L543 HydrophobicContact CD2-CD2 3.87Å; Y425-L543 HydrophobicContact CD2-CG 3.83Å; Y425-L543 HydrophobicContact CE1-CD2 3.43Å; Y425-L543 VanDerWaalsContact CE1-CD2 3.43Å; Y425-L543 HydrophobicContact CE1-CG 4.24Å; Y425-L543 HydrophobicContact CE2-CD1 4.14Å; Y425-L543 HydrophobicContact CE2-CD2 3.57Å; Y425-L543 HydrophobicContact CE2-CG 3.42Å; Y425-L543 VanDerWaalsContact CE2-CG 3.42Å; Y425-L543 HydrophobicContact CG-CD2 3.97Å; Y425-L543 HydrophobicContact CG-CG 4.41Å; Y425-L543 WeakPolarHBondContact O-CD2 3.22Å; Y425-F549 HydrophobicContact CD2-CB 4.31Å; Y425-F549 AromaticContact CD2-CD2 3.95Å; Y425-F549 HydrophobicContact CD2-CD2 3.95Å; Y425-F549 HydrophobicContact CG-CD2 4.43Å; Y425-I550 HydrophobicContact CD2-CD1 4.49Å; Y425-I550 HydrophobicContact CE1-CD1 4.35Å; Y425-I550 HydrophobicContact CE2-CD1 3.51Å; Y425-I550 HydrophobicContact CE2-CG1 3.96Å; Y425-I550 VanDerWaalsContact CZ-CD1 3.44Å; Y425-I550 VanDerWaalsContact OH-CD1 3.23Å; Y425-I550 WeakPolarHBondContact OH-CD1 3.29Å
426	Q	93	Very high	91.5	Very high	74 Å²	74	24.2 Å²	24.2	35%	0.346	13%	0.129	S	C	.	.	H	α-helix	trans	-66.3	-38.3	-179.4	-169.9	64.1	18.7	0	0	112.3	L401 G422 L423 G429 A430	L401-Q426 HydrophobicContact CD1-CB 4.22Å; L401-Q426 HydrophobicContact CD1-CG 3.9Å; L401-Q426 HydrophobicContact CD2-CB 3.94Å; L401-Q426 HydrophobicContact CD2-CG 3.54Å; L401-Q426 HydrophobicContact CG-CG 4.16Å; G422-Q426 WeakPolarHBondContact O-CB 3.4Å; G422-Q426 PolarHBondContact O-N 3.02Å; L423-Q426 PolarHBondContact O-N 3.46Å; Q426-G429 PolarHBondContact O-N 3.47Å; Q426-A430 WeakPolarHBondContact O-CB 3.35Å; Q426-A430 PolarHBondContact O-N 3.06Å
427	L	93.2	Very high	91.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-44.8	177.7	-70.1	173.1	0	0	0	112	L401 L423 L424 Y425 T431 F483 F503 L507	L401-L427 HydrophobicContact CD1-CD2 3.9Å; L401-L427 HydrophobicContact CD1-CG 4.33Å; L423-L427 HydrophobicContact CD1-CD1 3.97Å; L423-L427 HydrophobicContact CD1-CG 4.12Å; L423-L427 HydrophobicContact CG-CD1 3.88Å; L423-L427 HydrophobicContact CG-CG 4.39Å; L423-L427 WeakPolarHBondContact O-CB 3.23Å; L423-L427 WeakPolarHBondContact O-CG 3.49Å; L423-L427 PolarHBondContact O-N 3.4Å; L424-L427 HydrophobicContact CD2-CD1 4.35Å; L424-L427 PolarHBondContact O-N 2.94Å; Y425-L427 PolarHBondContact O-N 3.44Å; L427-T431 WeakPolarHBondContact O-CB 3.05Å; L427-T431 VanDerWaalsContact O-CG2 3.25Å; L427-T431 WeakPolarHBondContact O-CG2 3.41Å; L427-T431 PolarHBondContact O-N 3.43Å; L427-T431 PolarHBondContact O-OG1 3.19Å; L427-F483 HydrophobicContact CD2-CE1 4.01Å; L427-F483 HydrophobicContact CD2-CE2 4.27Å; L427-F483 HydrophobicContact CD2-CZ 3.35Å; L427-F503 HydrophobicContact CD1-CE2 3.79Å; L427-F503 HydrophobicContact CD1-CZ 3.59Å; L427-L507 HydrophobicContact CB-CD2 3.89Å
428	V	93.3	Very high	92.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-70.8	-31.6	178.6	179.8	0	0	0	0	111.9	L424 Y425 P432 L543 Q569 C572 L576	L424-V428 WeakPolarHBondContact O-CG2 2.98Å; L424-V428 PolarHBondContact O-N 3.17Å; L424-V428 VanDerWaalsContact O-N 3.08Å; Y425-V428 PolarHBondContact O-N 3.38Å; V428-P432 WeakPolarHBondContact O-CD 3.48Å; V428-P432 WeakPolarHBondContact O-CG 3.34Å; V428-L543 HydrophobicContact CB-CD1 3.89Å; V428-L543 HydrophobicContact CG1-CD1 3.76Å; V428-Q569 HydrophobicContact CG1-CB 4.04Å; V428-Q569 HydrophobicContact CG1-CG 3.98Å; V428-C572 HydrophobicContact CG1-CB 4.26Å; V428-C572 HydrophobicContact CG2-CB 4.45Å; V428-L576 HydrophobicContact CG2-CD1 3.43Å; V428-L576 VanDerWaalsContact CG2-CD1 3.43Å
429	G	91.5	Very high	92.5	Very high	12 Å²	12	19.8 Å²	19.8	12%	0.124	11%	0.108	C	C	.	.	H	α-helix	trans	-75.9	-38.1	175.8	0	0	0	0	0	114.6	Y425 Q426 P432	Y425-G429 PolarHBondContact O-N 3.34Å; Q426-G429 PolarHBondContact O-N 3.47Å; G429-P432 WeakPolarHBondContact O-CD 3.16Å; G429-P432 WeakPolarHBondContact O-CG 3.41Å
430	A	92	Very high	92.6	Very high	6 Å²	6	18.2 Å²	18.2	5%	0.05	10%	0.1	C	C	.	.	H	α-helix	trans	-84.2	-33.9	-172.8	0	0	0	0	0	113.6	M397 Q426 Y433 T434	M397-A430 HydrophobicContact CE-CB 3.87Å; M397-A430 HydrophobicContact CG-CB 3.67Å; M397-A430 HydrophobicContact SD-CB 3.76Å; Q426-A430 WeakPolarHBondContact O-CB 3.35Å; Q426-A430 PolarHBondContact O-N 3.06Å; A430-Y433 VanDerWaalsContact O-CB 3.29Å; A430-Y433 WeakPolarHBondContact O-CB 3.34Å; A430-Y433 PolarHBondContact O-N 3.46Å; A430-Y433 VanDerWaalsContact O-N 3.11Å; A430-T434 PolarHBondContact O-N 3.26Å
431	T	92.9	Very high	92.5	Very high	5 Å²	5	24.1 Å²	24.1	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-59.3	-43.6	179.5	43.8	0	0	0	0	114.7	L427 Y433 T434 G435 F483 L507 P510 H511	L427-T431 WeakPolarHBondContact O-CB 3.05Å; L427-T431 VanDerWaalsContact O-CG2 3.25Å; L427-T431 WeakPolarHBondContact O-CG2 3.41Å; L427-T431 PolarHBondContact O-N 3.43Å; L427-T431 PolarHBondContact O-OG1 3.19Å; T431-Y433 VanDerWaalsContact C-N 3.28Å; T431-Y433 PolarHBondContact O-N 3.3Å; T431-T434 PolarHBondContact O-N 3.3Å; T431-T434 PolarHBondContact O-OG1 2.94Å; T431-G435 PolarHBondContact O-N 3.27Å; T431-F483 HydrophobicContact CG2-CE1 4.2Å; T431-L507 HydrophobicContact CG2-CB 4.38Å; T431-L507 HydrophobicContact CG2-CD2 4.17Å; T431-P510 WeakPolarHBondContact OG1-CB 3.29Å; T431-H511 WeakPolarHBondContact O-CA 3.39Å; T431-H511 PolarHBondContact O-ND1 3.45Å
432	P	94.2	Very high	92.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.8	-29.9	173.1	26.7	-34.7	0	0	0	112.3	V428 G429 G435 M436 P510 G514 F568	V428-P432 WeakPolarHBondContact O-CD 3.48Å; V428-P432 WeakPolarHBondContact O-CG 3.34Å; G429-P432 WeakPolarHBondContact O-CD 3.16Å; G429-P432 WeakPolarHBondContact O-CG 3.41Å; P432-G435 PolarHBondContact O-N 2.97Å; P432-M436 PolarHBondContact O-N 2.87Å; P432-P510 VanDerWaalsContact CA-O 3.29Å; P432-P510 WeakPolarHBondContact CA-O 3.42Å; P432-P510 WeakPolarHBondContact CB-O 3.49Å; P432-G514 WeakPolarHBondContact O-CA 3.15Å; P432-F568 HydrophobicContact CB-CE2 4.4Å; P432-F568 HydrophobicContact CB-CZ 4.1Å; P432-F568 HydrophobicContact CG-CE2 4.34Å; P432-F568 HydrophobicContact CG-CZ 4.25Å
433	Y	92.7	Very high	92.5	Very high	87 Å²	87	22 Å²	22	34%	0.341	11%	0.11	S	C	.	.	H	α-helix	trans	-64.7	-40.1	176.9	-167.9	-90.9	0	0	0	111.8	A430 T431 M436 L437 A536	A430-Y433 VanDerWaalsContact O-CB 3.29Å; A430-Y433 WeakPolarHBondContact O-CB 3.34Å; A430-Y433 PolarHBondContact O-N 3.46Å; A430-Y433 VanDerWaalsContact O-N 3.11Å; T431-Y433 VanDerWaalsContact C-N 3.28Å; T431-Y433 PolarHBondContact O-N 3.3Å; Y433-M436 HydrophobicContact CD1-CE 4.23Å; Y433-M436 HydrophobicContact CD2-CE 3.42Å; Y433-M436 VanDerWaalsContact CD2-CE 3.42Å; Y433-M436 HydrophobicContact CE1-CE 4.13Å; Y433-M436 HydrophobicContact CE2-CE 3.3Å; Y433-M436 HydrophobicContact CG-CE 3.89Å; Y433-M436 WeakPolarHBondContact O-CB 3.43Å; Y433-M436 PolarHBondContact O-N 3.26Å; Y433-L437 HydrophobicContact CD1-CD1 3.84Å; Y433-L437 HydrophobicContact CD1-CG 4.06Å; Y433-L437 HydrophobicContact CE1-CD1 3.66Å; Y433-L437 HydrophobicContact CE1-CD2 4.13Å; Y433-L437 HydrophobicContact CE1-CG 3.86Å; Y433-L437 WeakPolarHBondContact O-CG 2.99Å; Y433-L437 PolarHBondContact O-N 3.45Å; Y433-A536 HydrophobicContact CD2-CB 4.11Å; Y433-A536 HydrophobicContact CE2-CB 3.76Å
434	T	92.6	Very high	92.4	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-69	-34.3	175.3	57.1	0	0	0	0	112.3	Q393 N394 A430 T431 M436 L437 N438 H511	Q393-T434 HydrophobicContact CG-CG2 4.16Å; Q393-T434 PolarHBondContact NE2-O 2.96Å; N394-T434 WeakPolarHBondContact OD1-CB 3.39Å; N394-T434 VanDerWaalsContact OD1-CG2 3.28Å; N394-T434 WeakPolarHBondContact OD1-CG2 3.48Å; N394-T434 PolarHBondContact OD1-OG1 3.45Å; A430-T434 PolarHBondContact O-N 3.26Å; T431-T434 PolarHBondContact O-N 3.3Å; T431-T434 PolarHBondContact O-OG1 2.94Å; T434-M436 VanDerWaalsContact C-N 3.34Å; T434-L437 PolarHBondContact O-N 2.91Å; T434-N438 PolarHBondContact O-N 2.84Å; T434-N438 VanDerWaalsContact O-N 3.09Å; T434-H511 PolarHBondContact OG1-CE1 2.87Å; T434-H511 VanDerWaalsContact OG1-CE1 3.26Å; T434-H511 PolarHBondContact OG1-ND1 3.25Å
435	G	93.2	Very high	92.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.9	-40.6	170.4	0	0	0	0	0	112.8	T431 P432 N438 A439 H511 E515	T431-G435 PolarHBondContact O-N 3.27Å; P432-G435 PolarHBondContact O-N 2.97Å; G435-N438 WeakPolarHBondContact O-CB 3.24Å; G435-N438 PolarHBondContact O-N 2.86Å; G435-A439 PolarHBondContact O-N 3.32Å; G435-H511 WeakPolarHBondContact CA-O 3.34Å; G435-H511 PolarHBondContact N-CE1 3.01Å; G435-H511 PolarHBondContact N-ND1 3.26Å; G435-E515 WeakPolarHBondContact O-CA 3.43Å; G435-E515 WeakPolarHBondContact O-CB 3.19Å
436	M	94.2	Very high	92.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-49.7	173.8	174.9	-161.7	68.6	0	0	112.1	P432 Y433 T434 N438 A439 V440 T518 N532 V535 A536	P432-M436 PolarHBondContact O-N 2.87Å; Y433-M436 HydrophobicContact CD1-CE 4.23Å; Y433-M436 HydrophobicContact CD2-CE 3.42Å; Y433-M436 VanDerWaalsContact CD2-CE 3.42Å; Y433-M436 HydrophobicContact CE1-CE 4.13Å; Y433-M436 HydrophobicContact CE2-CE 3.3Å; Y433-M436 HydrophobicContact CG-CE 3.89Å; Y433-M436 WeakPolarHBondContact O-CB 3.43Å; Y433-M436 PolarHBondContact O-N 3.26Å; T434-M436 VanDerWaalsContact C-N 3.34Å; M436-N438 PolarHBondContact O-N 3.5Å; M436-A439 PolarHBondContact O-N 3.5Å; M436-A439 VanDerWaalsContact O-N 3.1Å; M436-V440 HydrophobicContact CG-CG2 3.98Å; M436-V440 WeakPolarHBondContact O-CG2 3.23Å; M436-V440 PolarHBondContact O-N 3.47Å; M436-T518 VanDerWaalsContact CA-OG1 3.3Å; M436-T518 WeakPolarHBondContact CA-OG1 3.22Å; M436-T518 WeakPolarHBondContact CB-OG1 3.26Å; M436-T518 HydrophobicContact CG-CG2 4.24Å; M436-T518 WeakPolarHBondContact CG-OG1 3.39Å; M436-N532 WeakPolarHBondContact CE-OD1 3.43Å; M436-N532 PolarHBondContact SD-OD1 2.96Å; M436-V535 HydrophobicContact CB-CG1 3.79Å; M436-V535 HydrophobicContact CG-CB 3.9Å; M436-V535 HydrophobicContact CG-CG1 3.7Å; M436-V535 HydrophobicContact SD-CB 3.58Å; M436-V535 VanDerWaalsContact SD-CB 3.58Å; M436-V535 HydrophobicContact SD-CG1 3.67Å; M436-A536 HydrophobicContact CE-CB 4.4Å; M436-A536 HydrophobicContact SD-CB 4.24Å
437	L	92.8	Very high	92.3	Very high	51 Å²	51	21.8 Å²	21.8	27%	0.267	11%	0.113	S	C	.	.	H	α-helix	trans	-56	-38.1	178	-73.6	177.7	0	0	0	112.1	Y433 T434 N441	Y433-L437 HydrophobicContact CD1-CD1 3.84Å; Y433-L437 HydrophobicContact CD1-CG 4.06Å; Y433-L437 HydrophobicContact CE1-CD1 3.66Å; Y433-L437 HydrophobicContact CE1-CD2 4.13Å; Y433-L437 HydrophobicContact CE1-CG 3.86Å; Y433-L437 WeakPolarHBondContact O-CG 2.99Å; Y433-L437 PolarHBondContact O-N 3.45Å; T434-L437 PolarHBondContact O-N 2.91Å; L437-N441 PolarHBondContact O-N 3.3Å; L437-N441 PolarHBondContact O-ND2 2.94Å
438	N	92.4	Very high	92.1	Very high	10 Å²	10	23.6 Å²	23.6	5%	0.053	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-50.6	174.6	-82.3	-11.8	0	0	0	112.7	R390 Q393 T434 G435 M436 L442 H511	R390-N438 WeakPolarHBondContact CG-OD1 3.49Å; R390-N438 PolarHBondContact NH2-ND2 3.4Å; R390-N438 VanDerWaalsContact NH2-ND2 3.12Å; Q393-N438 PolarHBondContact NE2-ND2 3.17Å; Q393-N438 PolarHBondContact NE2-OD1 2.93Å; T434-N438 PolarHBondContact O-N 2.84Å; T434-N438 VanDerWaalsContact O-N 3.09Å; G435-N438 WeakPolarHBondContact O-CB 3.24Å; G435-N438 PolarHBondContact O-N 2.86Å; M436-N438 PolarHBondContact O-N 3.5Å; N438-L442 WeakPolarHBondContact O-CB 3.34Å; N438-L442 PolarHBondContact O-N 3.33Å; N438-H511 PolarHBondContact ND2-NE2 3.35Å
439	A	93.1	Very high	92.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-71.2	-43.9	-176.7	0	0	0	0	0	113.1	G435 M436 N441 L442 F443 Y468 E515 T518 L519	G435-A439 PolarHBondContact O-N 3.32Å; M436-A439 PolarHBondContact O-N 3.5Å; M436-A439 VanDerWaalsContact O-N 3.1Å; A439-N441 VanDerWaalsContact C-N 3.28Å; A439-N441 PolarHBondContact O-N 2.9Å; A439-L442 PolarHBondContact O-N 3.32Å; A439-F443 WeakPolarHBondContact O-CB 3.46Å; A439-F443 PolarHBondContact O-N 3.47Å; A439-Y468 WeakPolarHBondContact CA-OH 3.34Å; A439-E515 HydrophobicContact CB-CG 4.17Å; A439-T518 HydrophobicContact CB-CG2 3.58Å; A439-L519 HydrophobicContact CB-CD2 4.24Å; A439-L519 HydrophobicContact CB-CG 4.39Å
440	V	92	Very high	92.1	Very high	14 Å²	14	23.1 Å²	23.1	9%	0.085	12%	0.123	C	C	.	.	H	α-helix	trans	-61.3	-36.3	-178.8	173.7	0	0	0	0	111.8	M436 P444 T518 P528 N532	M436-V440 HydrophobicContact CG-CG2 3.98Å; M436-V440 WeakPolarHBondContact O-CG2 3.23Å; M436-V440 PolarHBondContact O-N 3.47Å; V440-P444 WeakPolarHBondContact O-CD 3.22Å; V440-P444 WeakPolarHBondContact O-CG 3.27Å; V440-T518 HydrophobicContact CG2-CG2 3.45Å; V440-T518 VanDerWaalsContact CG2-CG2 3.45Å; V440-P528 HydrophobicContact CG1-CB 4Å; V440-N532 HydrophobicContact CG1-CB 4.41Å; V440-N532 HydrophobicContact CG2-CB 4.24Å
441	N	88.6	Confident	92	Very high	127 Å²	127	24.2 Å²	24.2	68%	0.679	13%	0.128	S	C	*	.	H	α-helix	trans	-81.9	-33.8	-177	-72.6	-51.3	0	0	0	113.6	L437 A439	L437-N441 PolarHBondContact O-N 3.3Å; L437-N441 PolarHBondContact O-ND2 2.94Å; A439-N441 VanDerWaalsContact C-N 3.28Å; A439-N441 PolarHBondContact O-N 2.9Å
442	L	89.4	Confident	91.8	Very high	19 Å²	19	24.9 Å²	24.9	10%	0.099	13%	0.131	C	C	.	.	H	α-helix	trans	-96.8	-41	-172.7	-174.1	62.1	0	0	0	113	L380 N438 A439 Y468	L380-L442 HydrophobicContact CD1-CD1 3.99Å; L380-L442 HydrophobicContact CD1-CD2 3.64Å; L380-L442 HydrophobicContact CD1-CG 4.49Å; L380-L442 HydrophobicContact CD2-CD2 4.45Å; L380-L442 HydrophobicContact CG-CD2 4.5Å; N438-L442 WeakPolarHBondContact O-CB 3.34Å; N438-L442 PolarHBondContact O-N 3.33Å; A439-L442 PolarHBondContact O-N 3.32Å; L442-Y468 HydrophobicContact CB-CE2 4.37Å; L442-Y468 HydrophobicContact CD2-CE2 3.78Å; L442-Y468 HydrophobicContact CG-CE2 4.1Å
443	F	92.5	Very high	91.6	Very high	1 Å²	1	25.4 Å²	25.4	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-72	-32.1	-168.8	-169.4	-100.9	0	0	0	115.4	A439 M445 L446 R447 L465 Y468 L519 L522 F643	A439-F443 WeakPolarHBondContact O-CB 3.46Å; A439-F443 PolarHBondContact O-N 3.47Å; F443-M445 VanDerWaalsContact C-N 3.3Å; F443-M445 PolarHBondContact O-N 2.87Å; F443-L446 PolarHBondContact O-N 3.48Å; F443-L446 VanDerWaalsContact O-N 3.14Å; F443-R447 HydrophobicContact CD1-CB 4.04Å; F443-R447 HydrophobicContact CE1-CB 3.74Å; F443-R447 HydrophobicContact CE1-CG 3.99Å; F443-R447 HydrophobicContact CZ-CB 4.34Å; F443-R447 WeakPolarHBondContact O-CB 3.28Å; F443-R447 PolarHBondContact O-N 3.27Å; F443-L465 HydrophobicContact CE2-CD1 4.12Å; F443-L465 HydrophobicContact CZ-CD1 3.96Å; F443-Y468 HydrophobicContact CB-CE2 4.32Å; F443-Y468 HydrophobicContact CD2-CD1 4.36Å; F443-Y468 AromaticContact CD2-CD2 3.81Å; F443-Y468 HydrophobicContact CD2-CD2 3.81Å; F443-Y468 HydrophobicContact CD2-CE2 4.17Å; F443-Y468 AromaticContact CD2-CG 3.89Å; F443-Y468 HydrophobicContact CD2-CG 3.89Å; F443-Y468 HydrophobicContact CE2-CG 4.3Å; F443-L519 HydrophobicContact CB-CD2 3.74Å; F443-L519 HydrophobicContact CD1-CD2 3.72Å; F443-L519 HydrophobicContact CD2-CD2 3.29Å; F443-L519 HydrophobicContact CE1-CD2 4.14Å; F443-L519 HydrophobicContact CE2-CD2 3.73Å; F443-L519 HydrophobicContact CG-CD2 3.27Å; F443-L519 HydrophobicContact CZ-CD2 4.13Å; F443-L522 HydrophobicContact CB-CD1 4.07Å; F443-L522 HydrophobicContact CD1-CB 4.04Å; F443-L522 HydrophobicContact CD1-CD1 3.83Å; F443-L522 HydrophobicContact CE1-CB 4.32Å; F443-L522 HydrophobicContact CG-CD1 4.38Å; F443-F643 AromaticContact CE1-CE1 3.95Å; F443-F643 HydrophobicContact CE1-CE1 3.95Å; F443-F643 AromaticContact CE1-CZ 3.49Å; F443-F643 HydrophobicContact CE1-CZ 3.49Å; F443-F643 VanDerWaalsContact CE1-CZ 3.49Å; F443-F643 AromaticContact CZ-CE1 3.71Å; F443-F643 HydrophobicContact CZ-CE1 3.71Å; F443-F643 HydrophobicContact CZ-CE2 4.45Å; F443-F643 AromaticContact CZ-CZ 3.49Å; F443-F643 HydrophobicContact CZ-CZ 3.49Å; F443-F643 VanDerWaalsContact CZ-CZ 3.49Å
444	P	91.9	Very high	91.3	Very high	27 Å²	27	21.8 Å²	21.8	18%	0.175	12%	0.121	C	C	.	.	H	α-helix	trans	-57.1	-38.5	-178.3	-28.8	36.5	0	0	0	114.5	V440 R447 A448 P528	V440-P444 WeakPolarHBondContact O-CD 3.22Å; V440-P444 WeakPolarHBondContact O-CG 3.27Å; P444-R447 PolarHBondContact O-N 2.89Å; P444-A448 WeakPolarHBondContact O-CB 3.4Å; P444-A448 PolarHBondContact O-N 3Å; P444-P528 HydrophobicContact CB-CG 4.03Å; P444-P528 HydrophobicContact CG-CB 4.03Å; P444-P528 HydrophobicContact CG-CG 3.68Å
445	M	90.3	Very high	90.9	Very high	65 Å²	65	24.8 Å²	24.8	32%	0.32	13%	0.134	S	C	.	.	H	α-helix	trans	-65.7	-47.1	176.4	-174.3	-173	-133.1	0	0	111.2	F139 L140 F443 R447 A448 V449	F139-M445 WeakPolarHBondContact O-CE 3.37Å; L140-M445 HydrophobicContact CD2-CG 4.48Å; L140-M445 HydrophobicContact CD2-SD 4.4Å; F443-M445 VanDerWaalsContact C-N 3.3Å; F443-M445 PolarHBondContact O-N 2.87Å; M445-R447 VanDerWaalsContact C-N 3.28Å; M445-R447 PolarHBondContact O-N 2.76Å; M445-A448 PolarHBondContact O-N 3.24Å; M445-V449 WeakPolarHBondContact O-CG2 3.5Å; M445-V449 PolarHBondContact O-N 2.97Å
446	L	92.9	Very high	90.5	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-63.3	-37.3	177.6	-85.1	69.2	0	0	0	111.6	L140 V376 F443 S450 M464 Y468	L140-L446 HydrophobicContact CD2-CD1 4.04Å; L140-L446 HydrophobicContact CD2-CG 4.3Å; V376-L446 HydrophobicContact CB-CD2 4.43Å; V376-L446 HydrophobicContact CG1-CD2 3.8Å; V376-L446 HydrophobicContact CG2-CD2 3.81Å; F443-L446 PolarHBondContact O-N 3.48Å; F443-L446 VanDerWaalsContact O-N 3.14Å; L446-S450 VanDerWaalsContact O-CB 3.24Å; L446-S450 WeakPolarHBondContact O-CB 3.2Å; L446-S450 PolarHBondContact O-N 3.49Å; L446-M464 HydrophobicContact CB-CG 4.41Å; L446-M464 HydrophobicContact CB-SD 4.29Å; L446-M464 HydrophobicContact CD2-SD 4.12Å; L446-M464 HydrophobicContact CG-SD 4.32Å; L446-Y468 HydrophobicContact CD2-CD2 4.06Å
447	R	91.8	Very high	89.9	Confident	25 Å²	25	27.6 Å²	27.6	9%	0.094	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-45.2	175.7	-172.3	-174.2	72.9	171.4	-4.9	111.4	F443 P444 M445 S450 D451 L522 V525 Q526 F643	F443-R447 HydrophobicContact CD1-CB 4.04Å; F443-R447 HydrophobicContact CE1-CB 3.74Å; F443-R447 HydrophobicContact CE1-CG 3.99Å; F443-R447 HydrophobicContact CZ-CB 4.34Å; F443-R447 WeakPolarHBondContact O-CB 3.28Å; F443-R447 PolarHBondContact O-N 3.27Å; P444-R447 PolarHBondContact O-N 2.89Å; M445-R447 VanDerWaalsContact C-N 3.28Å; M445-R447 PolarHBondContact O-N 2.76Å; R447-S450 PolarHBondContact O-N 3.34Å; R447-D451 PolarHBondContact O-N 3.39Å; R447-L522 WeakPolarHBondContact CD-O 3.31Å; R447-L522 PolarHBondContact NH1-O 3.13Å; R447-V525 PolarHBondContact NH1-O 2.92Å; R447-Q526 PolarHBondContact NH1-O 3.32Å; R447-Q526 PolarHBondContact NH2-O 2.85Å; R447-F643 HydrophobicContact CG-CE1 4.33Å
448	A	90.1	Very high	89.6	Confident	40 Å²	40	25.5 Å²	25.5	33%	0.331	15%	0.149	S	C	.	.	H	α-helix	trans	-64	-45.7	177.8	0	0	0	0	0	111.8	V138 P444 M445 S450 D451 Q452	V138-A448 HydrophobicContact CG1-CB 4.31Å; P444-A448 WeakPolarHBondContact O-CB 3.4Å; P444-A448 PolarHBondContact O-N 3Å; M445-A448 PolarHBondContact O-N 3.24Å; A448-S450 VanDerWaalsContact C-N 3.29Å; A448-S450 PolarHBondContact O-N 2.99Å; A448-D451 PolarHBondContact O-N 3.24Å; A448-Q452 PolarHBondContact O-N 3.4Å; A448-Q452 VanDerWaalsContact O-N 3.11Å
449	V	92.7	Very high	89.4	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.5	-42.4	173.1	173.3	0	0	0	0	110.8	V138 L140 M445 D451 Q452 E453	V138-V449 HydrophobicContact CB-CG2 4.43Å; V138-V449 HydrophobicContact CG1-CG2 3.7Å; L140-V449 HydrophobicContact CD2-CG2 4.06Å; L140-V449 HydrophobicContact CG-CG2 4.43Å; M445-V449 WeakPolarHBondContact O-CG2 3.5Å; M445-V449 PolarHBondContact O-N 2.97Å; V449-D451 PolarHBondContact O-N 3.4Å; V449-Q452 PolarHBondContact O-N 3.4Å; V449-E453 VanDerWaalsContact CG1-CD 3.46Å; V449-E453 HydrophobicContact CG1-CG 4.04Å; V449-E453 WeakPolarHBondContact O-CB 3.32Å; V449-E453 WeakPolarHBondContact O-CG 3.05Å; V449-E453 PolarHBondContact O-N 3.46Å
450	S	92.5	Very high	89.2	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	17%	0.17	C	C	.	.	H	α-helix	trans	-66.5	-34.3	177.1	179.6	0	0	0	0	113.4	L446 R447 A448 Q452 S454 Y459	L446-S450 VanDerWaalsContact O-CB 3.24Å; L446-S450 WeakPolarHBondContact O-CB 3.2Å; L446-S450 PolarHBondContact O-N 3.49Å; R447-S450 PolarHBondContact O-N 3.34Å; A448-S450 VanDerWaalsContact C-N 3.29Å; A448-S450 PolarHBondContact O-N 2.99Å; S450-Q452 VanDerWaalsContact C-N 3.34Å; S450-S454 WeakPolarHBondContact O-CB 3.44Å; S450-S454 PolarHBondContact O-N 3.5Å; S450-S454 VanDerWaalsContact O-N 3.09Å; S450-Y459 WeakPolarHBondContact CA-OH 3.22Å
451	D	89	Confident	89.2	Confident	28 Å²	28	29.6 Å²	29.6	15%	0.15	17%	0.166	C	C	.	.	H	α-helix	trans	-66.2	-41.2	175.8	-76.2	-40.8	0	0	0	110.4	R447 A448 V449 Q455 K461 R646 I650	R447-D451 PolarHBondContact O-N 3.39Å; A448-D451 PolarHBondContact O-N 3.24Å; V449-D451 PolarHBondContact O-N 3.4Å; D451-Q455 WeakPolarHBondContact O-CG 3.4Å; D451-Q455 PolarHBondContact O-N 2.97Å; D451-K461 WeakPolarHBondContact OD1-CD 3.44Å; D451-K461 WeakPolarHBondContact OD1-CE 3.46Å; D451-K461 IonicContact OD1-NZ 3.81Å; D451-K461 PolarHBondContact OD1-NZ 2.8Å; D451-R646 IonicContact OD1-CZ 3.31Å; D451-R646 IonicContact OD1-NE 3.77Å; D451-R646 PolarHBondContact OD1-NE 2.8Å; D451-R646 VanDerWaalsContact OD1-NE 3.16Å; D451-R646 IonicContact OD1-NH2 3.53Å; D451-R646 IonicContact OD2-CZ 2.71Å; D451-R646 IonicContact OD2-NE 3.88Å; D451-R646 IonicContact OD2-NH2 3.39Å; D451-R646 PolarHBondContact OD2-NH2 3.32Å; D451-I650 WeakPolarHBondContact OD1-CD1 3.06Å
452	Q	88.2	Confident	89.4	Confident	20 Å²	20	25.7 Å²	25.7	9%	0.093	14%	0.142	C	C	.	.	H	α-helix	trans	-68.4	-56.8	176.2	167.7	163.3	12.3	0	0	112.4	L134 V138 A448 V449 S450 S454 Q455 D456	L134-Q452 HydrophobicContact CD1-CB 4.24Å; L134-Q452 HydrophobicContact CD1-CG 3.6Å; V138-Q452 VanDerWaalsContact CB-OE1 3.29Å; V138-Q452 VanDerWaalsContact N-OE1 3.11Å; A448-Q452 PolarHBondContact O-N 3.4Å; A448-Q452 VanDerWaalsContact O-N 3.11Å; V449-Q452 PolarHBondContact O-N 3.4Å; S450-Q452 VanDerWaalsContact C-N 3.34Å; Q452-S454 VanDerWaalsContact C-N 3.27Å; Q452-S454 PolarHBondContact O-N 2.94Å; Q452-Q455 WeakPolarHBondContact O-CB 2.94Å; Q452-Q455 PolarHBondContact O-N 3.15Å; Q452-D456 PolarHBondContact O-N 3.22Å
453	E	90.3	Very high	89.6	Confident	10 Å²	10	25.1 Å²	25.1	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-67.4	-27.5	-174.7	-70.2	-178.8	165.4	0	0	112.6	R375 V449 D456 G457 L458 Y459	R375-E453 IonicContact CZ-OE1 3.47Å; R375-E453 VanDerWaalsContact CZ-OE1 3.26Å; R375-E453 IonicContact CZ-OE2 3.57Å; R375-E453 IonicContact NH1-OE1 3.35Å; R375-E453 PolarHBondContact NH1-OE1 3.47Å; R375-E453 IonicContact NH1-OE2 3.64Å; R375-E453 PolarHBondContact NH1-OE2 3.19Å; R375-E453 IonicContact NH2-OE1 2.64Å; R375-E453 PolarHBondContact NH2-OE1 3.03Å; R375-E453 IonicContact NH2-OE2 3.32Å; V449-E453 VanDerWaalsContact CG1-CD 3.46Å; V449-E453 HydrophobicContact CG1-CG 4.04Å; V449-E453 WeakPolarHBondContact O-CB 3.32Å; V449-E453 WeakPolarHBondContact O-CG 3.05Å; V449-E453 PolarHBondContact O-N 3.46Å; E453-D456 PolarHBondContact O-N 3.07Å; E453-G457 PolarHBondContact O-N 3.02Å; E453-L458 HydrophobicContact CB-CD1 3.84Å; E453-L458 HydrophobicContact CG-CD1 4.01Å; E453-L458 PolarHBondContact O-N 3.23Å; E453-Y459 HydrophobicContact CB-CE1 3.69Å; E453-Y459 HydrophobicContact CG-CE1 4.48Å; E453-Y459 WeakPolarHBondContact OE2-CE1 3.15Å; E453-Y459 PolarHBondContact OE2-OH 3.07Å
454	S	87.5	Confident	89.7	Confident	11 Å²	11	25.1 Å²	25.1	8%	0.077	14%	0.139	C	C	.	.	H	α-helix	trans	-70.3	-31.7	173.4	-173.9	0	0	0	0	112.2	S450 Q452 D456 G457 Y459 K461 D647	S450-S454 WeakPolarHBondContact O-CB 3.44Å; S450-S454 PolarHBondContact O-N 3.5Å; S450-S454 VanDerWaalsContact O-N 3.09Å; Q452-S454 VanDerWaalsContact C-N 3.27Å; Q452-S454 PolarHBondContact O-N 2.94Å; S454-D456 VanDerWaalsContact C-N 3.25Å; S454-D456 PolarHBondContact O-N 3.35Å; S454-G457 PolarHBondContact O-N 3.33Å; S454-Y459 VanDerWaalsContact CA-O 3.29Å; S454-Y459 WeakPolarHBondContact CA-O 3.39Å; S454-Y459 VanDerWaalsContact CB-O 3.28Å; S454-Y459 WeakPolarHBondContact CB-O 3.26Å; S454-Y459 PolarHBondContact OG-O 3.23Å; S454-Y459 VanDerWaalsContact OG-O 3.1Å; S454-K461 WeakPolarHBondContact OG-CG 3.42Å; S454-D647 PolarHBondContact OG-OD1 2.88Å
455	Q	83.7	Confident	89.8	Confident	68 Å²	68	24 Å²	24	32%	0.318	13%	0.132	S	C	.	.	H	α-helix	trans	-71.7	-22.1	173.2	-73.6	177.5	-13.4	0	0	112.3	R103 D451 Q452 G457	R103-Q455 PolarHBondContact NH2-O 2.86Å; D451-Q455 WeakPolarHBondContact O-CG 3.4Å; D451-Q455 PolarHBondContact O-N 2.97Å; Q452-Q455 WeakPolarHBondContact O-CB 2.94Å; Q452-Q455 PolarHBondContact O-N 3.15Å; Q455-G457 VanDerWaalsContact C-N 3.26Å
456	D	83.9	Confident	90	Very high	15 Å²	15	22.6 Å²	22.6	8%	0.08	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.8	172.5	-64.4	-22.4	0	0	0	112.8	R103 Q207 Q452 E453 S454 L458	R103-D456 IonicContact CZ-OD1 2.69Å; R103-D456 IonicContact NH1-OD1 3.57Å; R103-D456 IonicContact NH2-OD1 2.64Å; R103-D456 PolarHBondContact NH2-OD1 2.9Å; Q207-D456 PolarHBondContact NE2-OD2 2.78Å; Q452-D456 PolarHBondContact O-N 3.22Å; E453-D456 PolarHBondContact O-N 3.07Å; S454-D456 VanDerWaalsContact C-N 3.25Å; S454-D456 PolarHBondContact O-N 3.35Å; D456-L458 HydrophobicContact CB-CD1 4.34Å
457	G	81.8	Confident	90.1	Very high	44 Å²	44	22.5 Å²	22.5	45%	0.454	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	9.6	178.5	0	0	0	0	0	115.5	E453 S454 Q455	E453-G457 PolarHBondContact O-N 3.02Å; S454-G457 PolarHBondContact O-N 3.33Å; Q455-G457 VanDerWaalsContact C-N 3.26Å
458	L	86.1	Confident	90.2	Very high	7 Å²	7	21.3 Å²	21.3	4%	0.037	12%	0.12	C	C	.	.	S	Bend	trans	-68	-47.3	-176.6	-72.5	159.5	0	0	0	112.4	L155 A156 K368 E453 D456	L155-L458 HydrophobicContact CB-CD2 4.15Å; A156-L458 HydrophobicContact CB-CD2 3.76Å; K368-L458 WeakPolarHBondContact CE-O 3.47Å; K368-L458 PolarHBondContact NZ-O 3.2Å; E453-L458 HydrophobicContact CB-CD1 3.84Å; E453-L458 HydrophobicContact CG-CD1 4.01Å; E453-L458 PolarHBondContact O-N 3.23Å; D456-L458 HydrophobicContact CB-CD1 4.34Å
459	Y	89.7	Confident	90.4	Very high	7 Å²	7	20 Å²	20	3%	0.027	11%	0.108	C	C	.	.			trans	-158.8	159.9	-179.9	55.9	-92.1	0	0	0	111.5	L155 L372 S450 E453 S454 M464	L155-Y459 HydrophobicContact CD1-CD1 4.03Å; L155-Y459 HydrophobicContact CD1-CE1 4.12Å; L372-Y459 HydrophobicContact CD1-CD1 4.38Å; L372-Y459 HydrophobicContact CD1-CD2 4.09Å; L372-Y459 HydrophobicContact CD1-CG 4Å; L372-Y459 HydrophobicContact CD2-CD1 4.09Å; L372-Y459 HydrophobicContact CD2-CE1 3.85Å; L372-Y459 HydrophobicContact CD2-CE2 4.35Å; L372-Y459 HydrophobicContact CD2-CG 4.44Å; S450-Y459 WeakPolarHBondContact CA-OH 3.22Å; E453-Y459 HydrophobicContact CB-CE1 3.69Å; E453-Y459 HydrophobicContact CG-CE1 4.48Å; E453-Y459 WeakPolarHBondContact OE2-CE1 3.15Å; E453-Y459 PolarHBondContact OE2-OH 3.07Å; S454-Y459 VanDerWaalsContact CA-O 3.29Å; S454-Y459 WeakPolarHBondContact CA-O 3.39Å; S454-Y459 VanDerWaalsContact CB-O 3.28Å; S454-Y459 WeakPolarHBondContact CB-O 3.26Å; S454-Y459 PolarHBondContact OG-O 3.23Å; S454-Y459 VanDerWaalsContact OG-O 3.1Å; Y459-M464 HydrophobicContact CE2-CB 4Å; Y459-M464 HydrophobicContact CE2-CE 4.09Å; Y459-M464 WeakPolarHBondContact OH-CE 3.34Å
460	H	89.1	Confident	90.5	Very high	102 Å²	102	23.3 Å²	23.3	47%	0.472	13%	0.125	S	C	.	.			trans	-78.4	145.6	174.2	-66.1	-68.1	0	0	0	112	W462 Q463 D647	H460-W462 VanDerWaalsContact C-N 3.26Å; H460-W462 HydrophobicContact CB-CG 4.49Å; H460-W462 AromaticContact CG-NE1 3.99Å; H460-W462 PolarHBondContact O-N 3.42Å; H460-W462 VanDerWaalsContact O-N 3.08Å; H460-Q463 HydrophobicContact CB-CG 4.38Å; H460-Q463 VanDerWaalsContact O-CB 3.28Å; H460-Q463 WeakPolarHBondContact O-CB 3.37Å; H460-Q463 PolarHBondContact O-N 2.94Å; H460-D647 IonicContact ND1-OD2 3.78Å
461	K	91.6	Very high	90.5	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.009	13%	0.125	C	C	.	.	H	α-helix	trans	-52.8	-35.6	-176.6	-56.1	-171.7	-179.5	-167.6	0	115.3	D451 S454 Q463 M464 L465 F643 D647 I650	D451-K461 WeakPolarHBondContact OD1-CD 3.44Å; D451-K461 WeakPolarHBondContact OD1-CE 3.46Å; D451-K461 IonicContact OD1-NZ 3.81Å; D451-K461 PolarHBondContact OD1-NZ 2.8Å; S454-K461 WeakPolarHBondContact OG-CG 3.42Å; K461-Q463 PolarHBondContact O-N 3.31Å; K461-M464 PolarHBondContact O-N 3.44Å; K461-L465 PolarHBondContact O-N 2.8Å; K461-F643 HydrophobicContact CB-CB 4.48Å; K461-F643 HydrophobicContact CB-CD1 4.23Å; K461-D647 HydrophobicContact CD-CB 4.05Å; K461-D647 WeakPolarHBondContact CE-OD1 3.29Å; K461-D647 HydrophobicContact CG-CB 4.25Å; K461-I650 VanDerWaalsContact NZ-CD1 3.33Å
462	W	92.9	Very high	90.6	Very high	44 Å²	44	22 Å²	22	17%	0.167	12%	0.118	C	C	.	.	H	α-helix	trans	-66.8	-23.8	178.4	70.4	-95.6	0	0	0	113.2	M365 H460 L465 L466 I640 F643	M365-W462 HydrophobicContact CE-CH2 4.46Å; M365-W462 HydrophobicContact CG-CH2 4.15Å; M365-W462 HydrophobicContact CG-CZ2 4.4Å; M365-W462 HydrophobicContact SD-CH2 3.61Å; M365-W462 HydrophobicContact SD-CZ2 3.74Å; H460-W462 VanDerWaalsContact C-N 3.26Å; H460-W462 HydrophobicContact CB-CG 4.49Å; H460-W462 AromaticContact CG-NE1 3.99Å; H460-W462 PolarHBondContact O-N 3.42Å; H460-W462 VanDerWaalsContact O-N 3.08Å; W462-L465 WeakPolarHBondContact O-CB 3.4Å; W462-L465 PolarHBondContact O-N 3.29Å; W462-L466 HydrophobicContact CE3-CB 4.46Å; W462-L466 HydrophobicContact CE3-CD2 4.4Å; W462-L466 HydrophobicContact CZ3-CD2 3.83Å; W462-L466 PolarHBondContact O-N 2.94Å; W462-I640 HydrophobicContact CB-CG2 4.09Å; W462-I640 HydrophobicContact CD2-CG2 4.39Å; W462-I640 HydrophobicContact CE3-CG2 4.4Å; W462-I640 HydrophobicContact CG-CG2 4.27Å; W462-F643 HydrophobicContact CB-CB 4.12Å
463	Q	93.5	Very high	90.9	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-68.8	-36.8	178.4	-61.9	-178.4	-15	0	0	111.1	L372 H460 K461 L466 A467	L372-Q463 HydrophobicContact CD1-CB 3.77Å; H460-Q463 HydrophobicContact CB-CG 4.38Å; H460-Q463 VanDerWaalsContact O-CB 3.28Å; H460-Q463 WeakPolarHBondContact O-CB 3.37Å; H460-Q463 PolarHBondContact O-N 2.94Å; K461-Q463 PolarHBondContact O-N 3.31Å; Q463-L466 PolarHBondContact O-N 3.18Å; Q463-A467 WeakPolarHBondContact O-CB 3.49Å; Q463-A467 PolarHBondContact O-N 2.96Å
464	M	93.6	Very high	91	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-65.3	-43.6	172.2	-179.2	63.6	72.7	0	0	111.4	L372 V376 L446 Y459 K461 L466 A467 Y468	L372-M464 HydrophobicContact CD2-CE 3.87Å; V376-M464 HydrophobicContact CG2-SD 3.67Å; L446-M464 HydrophobicContact CB-CG 4.41Å; L446-M464 HydrophobicContact CB-SD 4.29Å; L446-M464 HydrophobicContact CD2-SD 4.12Å; L446-M464 HydrophobicContact CG-SD 4.32Å; Y459-M464 HydrophobicContact CE2-CB 4Å; Y459-M464 HydrophobicContact CE2-CE 4.09Å; Y459-M464 WeakPolarHBondContact OH-CE 3.34Å; K461-M464 PolarHBondContact O-N 3.44Å; M464-L466 VanDerWaalsContact C-N 3.33Å; M464-L466 PolarHBondContact O-N 3.45Å; M464-A467 PolarHBondContact O-N 3.33Å; M464-Y468 PolarHBondContact O-N 2.87Å
465	L	93.9	Very high	91.2	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-57.1	-48.9	175.3	177.4	73.9	0	0	0	110.6	F443 K461 W462 A467 Y468 V469 L519 I640 F643	F443-L465 HydrophobicContact CE2-CD1 4.12Å; F443-L465 HydrophobicContact CZ-CD1 3.96Å; K461-L465 PolarHBondContact O-N 2.8Å; W462-L465 WeakPolarHBondContact O-CB 3.4Å; W462-L465 PolarHBondContact O-N 3.29Å; L465-A467 VanDerWaalsContact C-N 3.34Å; L465-A467 PolarHBondContact O-N 3.31Å; L465-Y468 WeakPolarHBondContact O-CB 3.42Å; L465-Y468 PolarHBondContact O-N 2.82Å; L465-V469 WeakPolarHBondContact O-CG2 3.4Å; L465-V469 PolarHBondContact O-N 3.37Å; L465-L519 HydrophobicContact CD1-CB 3.84Å; L465-L519 HydrophobicContact CD1-CD1 3.98Å; L465-L519 HydrophobicContact CD1-CD2 4.4Å; L465-L519 HydrophobicContact CD1-CG 4.31Å; L465-I640 HydrophobicContact CD2-CG1 4.47Å; L465-F643 HydrophobicContact CB-CD1 4.48Å; L465-F643 HydrophobicContact CB-CD2 4.47Å; L465-F643 HydrophobicContact CB-CG 4.34Å; L465-F643 HydrophobicContact CD1-CD2 4.35Å; L465-F643 HydrophobicContact CD1-CE2 3.95Å; L465-F643 HydrophobicContact CD1-CZ 4.28Å; L465-F643 HydrophobicContact CD2-CD2 3.71Å; L465-F643 HydrophobicContact CD2-CE2 4.12Å; L465-F643 HydrophobicContact CD2-CG 4.2Å; L465-F643 HydrophobicContact CG-CD2 4.39Å; L465-F643 HydrophobicContact CG-CE2 4.48Å
466	L	94.5	Very high	91.7	Very high	34 Å²	34	24.2 Å²	24.2	18%	0.178	13%	0.134	C	C	.	.	H	α-helix	trans	-64.8	-38.4	-179.5	-173.6	60.6	0	0	0	112.1	L369 W462 Q463 M464 Y468 V469 L470	L369-L466 HydrophobicContact CD1-CB 4.01Å; L369-L466 HydrophobicContact CD1-CD2 4.05Å; L369-L466 HydrophobicContact CD1-CG 4.01Å; L369-L466 HydrophobicContact CD2-CD2 3.6Å; L369-L466 HydrophobicContact CD2-CG 4.17Å; W462-L466 HydrophobicContact CE3-CB 4.46Å; W462-L466 HydrophobicContact CE3-CD2 4.4Å; W462-L466 HydrophobicContact CZ3-CD2 3.83Å; W462-L466 PolarHBondContact O-N 2.94Å; Q463-L466 PolarHBondContact O-N 3.18Å; M464-L466 VanDerWaalsContact C-N 3.33Å; M464-L466 PolarHBondContact O-N 3.45Å; L466-Y468 VanDerWaalsContact C-N 3.32Å; L466-Y468 PolarHBondContact O-N 3.1Å; L466-V469 PolarHBondContact O-N 3.22Å; L466-L470 HydrophobicContact CD1-CG 4.47Å; L466-L470 HydrophobicContact CG-CD1 4.28Å; L466-L470 WeakPolarHBondContact O-CG 3.45Å; L466-L470 PolarHBondContact O-N 3.27Å
467	A	95.1	Very high	92.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.6	-41.1	173.6	0	0	0	0	0	112	L369 L372 L373 V376 Q463 M464 L465 H471	L369-A467 HydrophobicContact CD1-CB 4.17Å; L372-A467 HydrophobicContact CB-CB 3.82Å; L373-A467 WeakPolarHBondContact CD1-O 3.49Å; V376-A467 HydrophobicContact CG2-CB 4.4Å; Q463-A467 WeakPolarHBondContact O-CB 3.49Å; Q463-A467 PolarHBondContact O-N 2.96Å; M464-A467 PolarHBondContact O-N 3.33Å; L465-A467 VanDerWaalsContact C-N 3.34Å; L465-A467 PolarHBondContact O-N 3.31Å; A467-H471 WeakPolarHBondContact O-CB 3.37Å; A467-H471 PolarHBondContact O-N 2.94Å
468	Y	94.9	Very high	92.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.8	-46.8	173.3	-179.2	-83.7	0	0	0	111.8	R390 A439 L442 F443 L446 M464 L465 L466 L470 H471 V472 E515 L519	R390-Y468 PolarHBondContact NH1-OH 3.09Å; A439-Y468 WeakPolarHBondContact CA-OH 3.34Å; L442-Y468 HydrophobicContact CB-CE2 4.37Å; L442-Y468 HydrophobicContact CD2-CE2 3.78Å; L442-Y468 HydrophobicContact CG-CE2 4.1Å; F443-Y468 HydrophobicContact CB-CE2 4.32Å; F443-Y468 HydrophobicContact CD2-CD1 4.36Å; F443-Y468 AromaticContact CD2-CD2 3.81Å; F443-Y468 HydrophobicContact CD2-CD2 3.81Å; F443-Y468 HydrophobicContact CD2-CE2 4.17Å; F443-Y468 AromaticContact CD2-CG 3.89Å; F443-Y468 HydrophobicContact CD2-CG 3.89Å; F443-Y468 HydrophobicContact CE2-CG 4.3Å; L446-Y468 HydrophobicContact CD2-CD2 4.06Å; M464-Y468 PolarHBondContact O-N 2.87Å; L465-Y468 WeakPolarHBondContact O-CB 3.42Å; L465-Y468 PolarHBondContact O-N 2.82Å; L466-Y468 VanDerWaalsContact C-N 3.32Å; L466-Y468 PolarHBondContact O-N 3.1Å; Y468-L470 PolarHBondContact O-N 3.23Å; Y468-H471 WeakPolarHBondContact O-CB 3.41Å; Y468-H471 PolarHBondContact O-N 3.36Å; Y468-V472 HydrophobicContact CE1-CB 4.37Å; Y468-V472 HydrophobicContact CE1-CG2 4.37Å; Y468-V472 WeakPolarHBondContact O-CB 3.41Å; Y468-V472 PolarHBondContact O-N 2.98Å; Y468-E515 HydrophobicContact CE1-CG 4.2Å; Y468-E515 PolarHBondContact OH-OE1 2.81Å; Y468-L519 HydrophobicContact CD1-CD1 3.4Å; Y468-L519 HydrophobicContact CD1-CD2 3.83Å; Y468-L519 HydrophobicContact CD1-CG 4.21Å; Y468-L519 HydrophobicContact CE1-CD1 3.54Å; Y468-L519 HydrophobicContact CE1-CD2 3.71Å; Y468-L519 HydrophobicContact CE1-CG 4.06Å; Y468-L519 HydrophobicContact CG-CD2 4.48Å
469	V	94.7	Very high	93.1	Very high	12 Å²	12	28.1 Å²	28.1	7%	0.073	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-44	179.7	168.9	0	0	0	0	111.4	L465 L466 V472 L473 F516 L519 V636	L465-V469 WeakPolarHBondContact O-CG2 3.4Å; L465-V469 PolarHBondContact O-N 3.37Å; L466-V469 PolarHBondContact O-N 3.22Å; V469-V472 WeakPolarHBondContact O-CG1 3.15Å; V469-V472 PolarHBondContact O-N 2.69Å; V469-L473 WeakPolarHBondContact O-CG 3.22Å; V469-F516 HydrophobicContact CB-CE1 4.06Å; V469-F516 HydrophobicContact CG1-CE1 3.74Å; V469-F516 HydrophobicContact CG1-CZ 3.84Å; V469-F516 HydrophobicContact CG2-CD1 3.97Å; V469-F516 HydrophobicContact CG2-CE1 3.77Å; V469-L519 HydrophobicContact CG2-CD1 4.05Å; V469-V636 HydrophobicContact CG1-CG1 4.27Å; V469-V636 HydrophobicContact CG1-CG2 3.83Å; V469-V636 HydrophobicContact CG2-CG2 4.38Å
470	L	94	Very high	93.3	Very high	71 Å²	71	28 Å²	28	37%	0.372	15%	0.146	S	C	.	.	H	α-helix	trans	-68.8	-38.5	178.3	-69.5	172.5	0	0	0	112	L369 L373 L466 Y468 V472	L369-L470 HydrophobicContact CD2-CD1 4.18Å; L373-L470 HydrophobicContact CD1-CB 3.84Å; L373-L470 HydrophobicContact CD2-CB 4.31Å; L466-L470 HydrophobicContact CD1-CG 4.47Å; L466-L470 HydrophobicContact CG-CD1 4.28Å; L466-L470 WeakPolarHBondContact O-CG 3.45Å; L466-L470 PolarHBondContact O-N 3.27Å; Y468-L470 PolarHBondContact O-N 3.23Å; L470-V472 VanDerWaalsContact C-N 3.28Å; L470-V472 PolarHBondContact O-N 3.3Å
471	H	91.9	Very high	93.5	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.014	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-34.7	177.9	169.3	62.7	0	0	0	112.6	L373 V376 T377 L380 A467 Y468 P474 F475	L373-H471 HydrophobicContact CD1-CB 3.81Å; V376-H471 HydrophobicContact CG1-CB 4.13Å; T377-H471 VanDerWaalsContact CA-CE1 3.5Å; T377-H471 WeakPolarHBondContact CA-CE1 3.23Å; T377-H471 WeakPolarHBondContact CA-ND1 3.48Å; T377-H471 PolarHBondContact OG1-ND1 3.29Å; L380-H471 VanDerWaalsContact CB-NE2 3.26Å; L380-H471 WeakPolarHBondContact CB-NE2 3.24Å; L380-H471 WeakPolarHBondContact CD2-NE2 3.45Å; A467-H471 WeakPolarHBondContact O-CB 3.37Å; A467-H471 PolarHBondContact O-N 2.94Å; Y468-H471 WeakPolarHBondContact O-CB 3.41Å; Y468-H471 PolarHBondContact O-N 3.36Å; H471-P474 WeakPolarHBondContact O-CD 3.19Å; H471-P474 WeakPolarHBondContact O-CG 3.28Å; H471-F475 AromaticContact CE1-CD2 3.85Å; H471-F475 AromaticContact CE1-CE2 3.22Å; H471-F475 WeakPolarHBondContact CE1-CE2 3.34Å; H471-F475 AromaticContact ND1-CE2 3.73Å; H471-F475 AromaticContact NE2-CE2 3.96Å; H471-F475 VanDerWaalsContact O-CD2 3.32Å; H471-F475 WeakPolarHBondContact O-CD2 3.19Å
472	V	92.7	Very high	93.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-79.1	-26.2	-168.9	87.1	0	0	0	0	115	R390 Y468 V469 L470 F475 S476 L512 E515 F516	R390-V472 VanDerWaalsContact CZ-CG2 3.44Å; Y468-V472 HydrophobicContact CE1-CB 4.37Å; Y468-V472 HydrophobicContact CE1-CG2 4.37Å; Y468-V472 WeakPolarHBondContact O-CB 3.41Å; Y468-V472 PolarHBondContact O-N 2.98Å; V469-V472 WeakPolarHBondContact O-CG1 3.15Å; V469-V472 PolarHBondContact O-N 2.69Å; L470-V472 VanDerWaalsContact C-N 3.28Å; L470-V472 PolarHBondContact O-N 3.3Å; V472-F475 PolarHBondContact O-N 3.44Å; V472-S476 WeakPolarHBondContact O-CB 3.42Å; V472-S476 PolarHBondContact O-N 3.05Å; V472-S476 PolarHBondContact O-OG 3.32Å; V472-L512 HydrophobicContact CG1-CD2 4.47Å; V472-E515 HydrophobicContact CG2-CG 4.41Å; V472-E515 WeakPolarHBondContact CG2-OE1 3.42Å; V472-E515 WeakPolarHBondContact CG2-OE2 3.36Å; V472-F516 HydrophobicContact CG1-CE1 3.66Å; V472-F516 HydrophobicContact CG1-CZ 3.91Å
473	L	93.1	Very high	93.6	Very high	66 Å²	66	27.7 Å²	27.7	35%	0.346	15%	0.153	S	C	.	.	H	α-helix	trans	-54.6	-54.3	-177.7	-65.8	173	0	0	0	113.1	V469 F475 S476 V477 L512 F516	V469-L473 WeakPolarHBondContact O-CG 3.22Å; L473-F475 PolarHBondContact O-N 3.36Å; L473-S476 PolarHBondContact O-N 2.9Å; L473-V477 VanDerWaalsContact O-CG2 3.28Å; L473-V477 WeakPolarHBondContact O-CG2 3.28Å; L473-V477 PolarHBondContact O-N 3.37Å; L473-L512 HydrophobicContact CD2-CD1 3.94Å; L473-L512 HydrophobicContact CD2-CD2 4Å; L473-F516 HydrophobicContact CD2-CZ 4.24Å
474	P	93	Very high	93.6	Very high	66 Å²	66	27.3 Å²	27.3	43%	0.429	15%	0.151	S	C	.	.	H	α-helix	trans	-60.9	-41.5	-178.4	19	-30.8	0	0	0	113.1	H471 V477 I478	H471-P474 WeakPolarHBondContact O-CD 3.19Å; H471-P474 WeakPolarHBondContact O-CG 3.28Å; P474-V477 PolarHBondContact O-N 2.82Å; P474-I478 WeakPolarHBondContact O-CD1 3.17Å; P474-I478 VanDerWaalsContact O-CG1 3.23Å; P474-I478 WeakPolarHBondContact O-CG1 3.34Å; P474-I478 PolarHBondContact O-N 3.21Å
475	F	92.5	Very high	93.5	Very high	23 Å²	23	29.3 Å²	29.3	10%	0.101	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-41.1	178.4	-67	-79.3	0	0	0	112.3	L380 M381 H471 V472 L473 I478 A479	L380-F475 HydrophobicContact CD2-CD2 4.23Å; L380-F475 HydrophobicContact CD2-CE2 4.21Å; L380-F475 HydrophobicContact CD2-CG 4.46Å; L380-F475 HydrophobicContact CD2-CZ 4.38Å; M381-F475 HydrophobicContact CE-CE1 3.32Å; M381-F475 HydrophobicContact CE-CZ 3.45Å; M381-F475 VanDerWaalsContact CE-CZ 3.45Å; M381-F475 HydrophobicContact CG-CZ 4.36Å; M381-F475 HydrophobicContact SD-CE1 4.15Å; M381-F475 HydrophobicContact SD-CZ 3.76Å; H471-F475 AromaticContact CE1-CD2 3.85Å; H471-F475 AromaticContact CE1-CE2 3.22Å; H471-F475 WeakPolarHBondContact CE1-CE2 3.34Å; H471-F475 AromaticContact ND1-CE2 3.73Å; H471-F475 AromaticContact NE2-CE2 3.96Å; H471-F475 VanDerWaalsContact O-CD2 3.32Å; H471-F475 WeakPolarHBondContact O-CD2 3.19Å; V472-F475 PolarHBondContact O-N 3.44Å; L473-F475 PolarHBondContact O-N 3.36Å; F475-I478 PolarHBondContact O-N 3.33Å; F475-A479 VanDerWaalsContact O-CB 3.27Å; F475-A479 WeakPolarHBondContact O-CB 3.46Å; F475-A479 PolarHBondContact O-N 3.22Å
476	S	93.4	Very high	93.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.8	-39.4	-180	-60.2	0	0	0	0	112.1	V472 L473 T480	V472-S476 WeakPolarHBondContact O-CB 3.42Å; V472-S476 PolarHBondContact O-N 3.05Å; V472-S476 PolarHBondContact O-OG 3.32Å; L473-S476 PolarHBondContact O-N 2.9Å; S476-T480 WeakPolarHBondContact O-CB 3.34Å; S476-T480 PolarHBondContact O-N 2.57Å; S476-T480 PolarHBondContact O-OG1 2.58Å
477	V	94.5	Very high	93.4	Very high	61 Å²	61	30 Å²	30	37%	0.37	17%	0.171	S	C	.	.	H	α-helix	trans	-62.2	-50.3	173.8	172	0	0	0	0	110.2	L473 P474 A479 T480 V481 L508	L473-V477 VanDerWaalsContact O-CG2 3.28Å; L473-V477 WeakPolarHBondContact O-CG2 3.28Å; L473-V477 PolarHBondContact O-N 3.37Å; P474-V477 PolarHBondContact O-N 2.82Å; V477-A479 PolarHBondContact O-N 2.74Å; V477-T480 PolarHBondContact O-N 2.74Å; V477-V481 HydrophobicContact CG1-CG2 4.44Å; V477-V481 VanDerWaalsContact O-CG2 3.29Å; V477-V481 WeakPolarHBondContact O-CG2 3.24Å; V477-V481 PolarHBondContact O-N 3.32Å; V477-L508 HydrophobicContact CG2-CD1 4.11Å; V477-L508 HydrophobicContact CG2-CD2 3.8Å
478	I	94.2	Very high	93.3	Very high	86 Å²	86	30 Å²	30	44%	0.441	17%	0.171	S	C	.	.	H	α-helix	trans	-61	-47.8	179.5	-65.9	165.4	0	0	0	110.8	L391 P474 F475 T480 V481 I482	L391-I478 HydrophobicContact CD2-CB 4.25Å; L391-I478 HydrophobicContact CD2-CG2 3.89Å; P474-I478 WeakPolarHBondContact O-CD1 3.17Å; P474-I478 VanDerWaalsContact O-CG1 3.23Å; P474-I478 WeakPolarHBondContact O-CG1 3.34Å; P474-I478 PolarHBondContact O-N 3.21Å; F475-I478 PolarHBondContact O-N 3.33Å; I478-T480 VanDerWaalsContact C-N 3.3Å; I478-T480 PolarHBondContact O-N 3.17Å; I478-V481 PolarHBondContact O-N 2.88Å; I478-I482 HydrophobicContact CG2-CD1 3.69Å; I478-I482 HydrophobicContact CG2-CG1 4.36Å; I478-I482 VanDerWaalsContact O-CG1 3.3Å; I478-I482 WeakPolarHBondContact O-CG1 3.21Å; I478-I482 PolarHBondContact O-N 2.95Å
479	A	92.7	Very high	93.2	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-41.5	178.7	0	0	0	0	0	112	R390 L391 F475 V477 F483	R390-A479 WeakPolarHBondContact O-CB 3.49Å; L391-A479 HydrophobicContact CD2-CB 4.26Å; F475-A479 VanDerWaalsContact O-CB 3.27Å; F475-A479 WeakPolarHBondContact O-CB 3.46Å; F475-A479 PolarHBondContact O-N 3.22Å; V477-A479 PolarHBondContact O-N 2.74Å; A479-F483 VanDerWaalsContact O-CB 3.24Å; A479-F483 WeakPolarHBondContact O-CB 3.37Å; A479-F483 PolarHBondContact O-N 3.16Å
480	T	93.4	Very high	93.1	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-69.6	-40.2	179.8	-53.8	0	0	0	0	111.6	S476 V477 I478 F483 S484 L507 L508	S476-T480 WeakPolarHBondContact O-CB 3.34Å; S476-T480 PolarHBondContact O-N 2.57Å; S476-T480 PolarHBondContact O-OG1 2.58Å; V477-T480 PolarHBondContact O-N 2.74Å; I478-T480 VanDerWaalsContact C-N 3.3Å; I478-T480 PolarHBondContact O-N 3.17Å; T480-F483 PolarHBondContact O-N 3.04Å; T480-S484 VanDerWaalsContact O-CB 3.29Å; T480-S484 WeakPolarHBondContact O-CB 3.48Å; T480-S484 PolarHBondContact O-N 3.09Å; T480-S484 PolarHBondContact O-OG 3.06Å; T480-S484 VanDerWaalsContact O-OG 3.08Å; T480-L507 HydrophobicContact CG2-CB 4.13Å; T480-L508 HydrophobicContact CG2-CB 4.05Å
481	V	93.6	Very high	93	Very high	72 Å²	72	35.2 Å²	35.2	44%	0.436	19%	0.192	S	C	.	.	H	α-helix	trans	-67.8	-40.2	177.8	172	0	0	0	0	111.7	V477 I478 S484 S485	V477-V481 HydrophobicContact CG1-CG2 4.44Å; V477-V481 VanDerWaalsContact O-CG2 3.29Å; V477-V481 WeakPolarHBondContact O-CG2 3.24Å; V477-V481 PolarHBondContact O-N 3.32Å; I478-V481 PolarHBondContact O-N 2.88Å; V481-S484 PolarHBondContact O-OG 3.38Å; V481-S485 VanDerWaalsContact O-CB 3.24Å; V481-S485 WeakPolarHBondContact O-CB 3.49Å; V481-S485 PolarHBondContact O-N 3.26Å; V481-S485 PolarHBondContact O-OG 3.33Å
482	I	93.1	Very high	92.8	Very high	67 Å²	67	36 Å²	36	34%	0.344	20%	0.201	S	C	.	.	H	α-helix	trans	-62.3	-47.3	174.4	-68.4	169.8	0	0	0	109.8	L395 I478 S485 V486	L395-I482 HydrophobicContact CD2-CG2 4.34Å; I478-I482 HydrophobicContact CG2-CD1 3.69Å; I478-I482 HydrophobicContact CG2-CG1 4.36Å; I478-I482 VanDerWaalsContact O-CG1 3.3Å; I478-I482 WeakPolarHBondContact O-CG1 3.21Å; I478-I482 PolarHBondContact O-N 2.95Å; I482-S485 PolarHBondContact O-OG 3.48Å; I482-V486 WeakPolarHBondContact O-CG2 3.42Å; I482-V486 PolarHBondContact O-N 3.2Å
483	F	93.8	Very high	92.6	Very high	3 Å²	3	36.4 Å²	36.4	1%	0.013	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-49.2	179	163.8	-116.9	0	0	0	112.7	N394 G398 L427 T431 A479 T480 V486 C487 L507	N394-F483 VanDerWaalsContact C-CD2 3.47Å; N394-F483 HydrophobicContact CB-CB 3.78Å; N394-F483 HydrophobicContact CB-CD1 4.42Å; N394-F483 HydrophobicContact CB-CD2 4.3Å; N394-F483 HydrophobicContact CB-CG 3.94Å; N394-F483 WeakPolarHBondContact O-CD2 3.43Å; N394-F483 WeakPolarHBondContact O-CE2 3.49Å; G398-F483 VanDerWaalsContact CA-CE2 3.43Å; L427-F483 HydrophobicContact CD2-CE1 4.01Å; L427-F483 HydrophobicContact CD2-CE2 4.27Å; L427-F483 HydrophobicContact CD2-CZ 3.35Å; T431-F483 HydrophobicContact CG2-CE1 4.2Å; A479-F483 VanDerWaalsContact O-CB 3.24Å; A479-F483 WeakPolarHBondContact O-CB 3.37Å; A479-F483 PolarHBondContact O-N 3.16Å; T480-F483 PolarHBondContact O-N 3.04Å; F483-V486 PolarHBondContact O-N 3.14Å; F483-C487 WeakPolarHBondContact CD2-SG 3.17Å; F483-C487 WeakPolarHBondContact CE2-SG 3.38Å; F483-C487 WeakPolarHBondContact O-CB 3.47Å; F483-C487 PolarHBondContact O-N 3.49Å; F483-C487 PolarHBondContact O-SG 3.42Å; F483-L507 HydrophobicContact CD1-CD1 4.47Å; F483-L507 HydrophobicContact CE1-CD1 3.91Å
484	S	92.8	Very high	92.5	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-39.8	-177	66.7	0	0	0	0	111.2	T480 V481 V486 C487 Y488 F500 S504	T480-S484 VanDerWaalsContact O-CB 3.29Å; T480-S484 WeakPolarHBondContact O-CB 3.48Å; T480-S484 PolarHBondContact O-N 3.09Å; T480-S484 PolarHBondContact O-OG 3.06Å; T480-S484 VanDerWaalsContact O-OG 3.08Å; V481-S484 PolarHBondContact O-OG 3.38Å; S484-V486 PolarHBondContact O-N 2.97Å; S484-C487 PolarHBondContact O-N 2.88Å; S484-Y488 WeakPolarHBondContact O-CB 3.24Å; S484-Y488 PolarHBondContact O-N 3.44Å; S484-F500 WeakPolarHBondContact OG-CE2 3.35Å; S484-S504 VanDerWaalsContact CB-OG 3.27Å; S484-S504 WeakPolarHBondContact CB-OG 3.19Å; S484-S504 PolarHBondContact OG-OG 3.47Å
485	S	92.8	Very high	92.2	Very high	44 Å²	44	37.4 Å²	37.4	31%	0.308	21%	0.207	S	C	.	.	H	α-helix	trans	-61.6	-44.9	178.6	58.4	0	0	0	0	111.6	V481 I482	V481-S485 VanDerWaalsContact O-CB 3.24Å; V481-S485 WeakPolarHBondContact O-CB 3.49Å; V481-S485 PolarHBondContact O-N 3.26Å; V481-S485 PolarHBondContact O-OG 3.33Å; I482-S485 PolarHBondContact O-OG 3.48Å
486	V	92.9	Very high	92.2	Very high	50 Å²	50	40.6 Å²	40.6	30%	0.303	22%	0.222	S	C	.	.	H	α-helix	trans	-68.1	-48.4	177	178.3	0	0	0	0	111.1	L395 L399 I402 I482 F483 S484 T490	L395-V486 HydrophobicContact CD1-CB 3.73Å; L395-V486 HydrophobicContact CD1-CG1 3.92Å; L395-V486 HydrophobicContact CD1-CG2 3.74Å; L399-V486 HydrophobicContact CD2-CG1 4.31Å; I402-V486 HydrophobicContact CD1-CG1 4.06Å; I482-V486 WeakPolarHBondContact O-CG2 3.42Å; I482-V486 PolarHBondContact O-N 3.2Å; F483-V486 PolarHBondContact O-N 3.14Å; S484-V486 PolarHBondContact O-N 2.97Å; V486-T490 WeakPolarHBondContact O-CB 3.5Å; V486-T490 PolarHBondContact O-N 3.32Å; V486-T490 PolarHBondContact O-OG1 3.27Å
487	C	92.2	Very high	92.2	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-67.3	-47.8	-174.8	-63.1	0	0	0	0	113.3	G398 F483 S484 W489 L491	G398-C487 WeakPolarHBondContact CA-SG 3.33Å; F483-C487 WeakPolarHBondContact CD2-SG 3.17Å; F483-C487 WeakPolarHBondContact CE2-SG 3.38Å; F483-C487 WeakPolarHBondContact O-CB 3.47Å; F483-C487 PolarHBondContact O-N 3.49Å; F483-C487 PolarHBondContact O-SG 3.42Å; S484-C487 PolarHBondContact O-N 2.88Å; C487-W489 PolarHBondContact O-N 3.43Å; C487-L491 HydrophobicContact CB-CD1 4.17Å; C487-L491 VanDerWaalsContact O-CB 3.22Å; C487-L491 WeakPolarHBondContact O-CB 3.47Å; C487-L491 VanDerWaalsContact O-CD1 3.3Å; C487-L491 WeakPolarHBondContact O-CD1 3.41Å; C487-L491 WeakPolarHBondContact O-CG 3.32Å; C487-L491 PolarHBondContact O-N 3.02Å
488	Y	93	Very high	92.1	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-46.7	-170	-171.2	-89.8	0	0	0	112.3	S484 G492 L493 Y494 R499 F500 F503	S484-Y488 WeakPolarHBondContact O-CB 3.24Å; S484-Y488 PolarHBondContact O-N 3.44Å; Y488-G492 PolarHBondContact O-N 3.47Å; Y488-L493 HydrophobicContact CD1-CB 4.41Å; Y488-L493 HydrophobicContact CD2-CB 3.85Å; Y488-L493 HydrophobicContact CD2-CD1 3.45Å; Y488-L493 VanDerWaalsContact CD2-CD1 3.45Å; Y488-L493 HydrophobicContact CD2-CG 4.28Å; Y488-L493 HydrophobicContact CE1-CB 4.23Å; Y488-L493 HydrophobicContact CE2-CB 3.67Å; Y488-L493 HydrophobicContact CE2-CD1 3.87Å; Y488-L493 HydrophobicContact CE2-CG 4.43Å; Y488-L493 HydrophobicContact CG-CB 4.22Å; Y488-L493 HydrophobicContact CG-CD1 4.14Å; Y488-L493 PolarHBondContact O-N 3.41Å; Y488-Y494 VanDerWaalsContact CE1-O 3.23Å; Y488-Y494 WeakPolarHBondContact CE1-O 3.32Å; Y488-Y494 PolarHBondContact OH-O 3Å; Y488-R499 WeakPolarHBondContact OH-CB 3.37Å; Y488-F500 HydrophobicContact CD1-CB 4.03Å; Y488-F500 AromaticContact CD1-CD2 3.84Å; Y488-F500 HydrophobicContact CD1-CD2 3.84Å; Y488-F500 HydrophobicContact CD1-CG 4.39Å; Y488-F500 HydrophobicContact CD2-CD2 4.37Å; Y488-F500 HydrophobicContact CE1-CB 3.86Å; Y488-F500 HydrophobicContact CE1-CD2 4.49Å; Y488-F500 AromaticContact CG-CD2 3.77Å; Y488-F500 HydrophobicContact CG-CD2 3.77Å; Y488-F503 HydrophobicContact CD2-CB 4Å; Y488-F503 AromaticContact CD2-CD1 3.58Å; Y488-F503 HydrophobicContact CD2-CD1 3.58Å; Y488-F503 HydrophobicContact CD2-CD2 4.02Å; Y488-F503 AromaticContact CD2-CE1 3.93Å; Y488-F503 HydrophobicContact CD2-CE1 3.93Å; Y488-F503 HydrophobicContact CD2-CE2 4.36Å; Y488-F503 AromaticContact CD2-CG 3.61Å; Y488-F503 HydrophobicContact CD2-CG 3.61Å; Y488-F503 HydrophobicContact CD2-CZ 4.3Å; Y488-F503 HydrophobicContact CE2-CB 3.89Å; Y488-F503 HydrophobicContact CE2-CD1 4.33Å; Y488-F503 HydrophobicContact CE2-CD2 4.21Å; Y488-F503 AromaticContact CE2-CG 3.92Å; Y488-F503 HydrophobicContact CE2-CG 3.92Å; Y488-F503 HydrophobicContact CG-CD1 4.38Å
489	W	93.3	Very high	92.1	Very high	122 Å²	122	42.4 Å²	42.4	46%	0.462	24%	0.239	S	C	.	.	H	α-helix	trans	-76	-38	-178.2	-63.5	113.4	0	0	0	112.3	C487 G492 V497 F500	C487-W489 PolarHBondContact O-N 3.43Å; W489-G492 PolarHBondContact O-N 3.07Å; W489-V497 HydrophobicContact CH2-CG2 4.42Å; W489-F500 HydrophobicContact CZ2-CB 4.47Å
490	T	92.6	Very high	92.2	Very high	70 Å²	70	44 Å²	44	43%	0.429	25%	0.246	S	C	.	.	H	α-helix	trans	-69.8	-38.3	178.5	-57.9	0	0	0	0	112.4	I402 V486 G492	I402-T490 HydrophobicContact CD1-CG2 4.15Å; I402-T490 HydrophobicContact CG1-CG2 4.27Å; I402-T490 HydrophobicContact CG2-CG2 3.63Å; V486-T490 WeakPolarHBondContact O-CB 3.5Å; V486-T490 PolarHBondContact O-N 3.32Å; V486-T490 PolarHBondContact O-OG1 3.27Å; T490-G492 VanDerWaalsContact C-N 3.26Å; T490-G492 PolarHBondContact O-N 3.45Å
491	L	91.2	Very high	92.2	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-73.3	-19.7	177.5	-67.8	164.8	0	0	0	112.5	I402 L405 L406 V408 L423 C487 L493	I402-L491 HydrophobicContact CG1-CD1 4.48Å; I402-L491 HydrophobicContact CG1-CD2 4.11Å; I402-L491 HydrophobicContact CG1-CG 4.07Å; L405-L491 HydrophobicContact CB-CD2 4.26Å; L406-L491 WeakPolarHBondContact O-CD2 3.45Å; V408-L491 WeakPolarHBondContact CB-O 3.47Å; V408-L491 HydrophobicContact CG2-CB 4.35Å; V408-L491 WeakPolarHBondContact CG2-O 3.43Å; V408-L491 PolarHBondContact N-O 2.79Å; L423-L491 HydrophobicContact CD1-CD1 3.49Å; L423-L491 VanDerWaalsContact CD1-CD1 3.49Å; L423-L491 HydrophobicContact CD2-CD1 3.66Å; L423-L491 HydrophobicContact CG-CD1 4.2Å; C487-L491 HydrophobicContact CB-CD1 4.17Å; C487-L491 VanDerWaalsContact O-CB 3.22Å; C487-L491 WeakPolarHBondContact O-CB 3.47Å; C487-L491 VanDerWaalsContact O-CD1 3.3Å; C487-L491 WeakPolarHBondContact O-CD1 3.41Å; C487-L491 WeakPolarHBondContact O-CG 3.32Å; C487-L491 PolarHBondContact O-N 3.02Å; L491-L493 HydrophobicContact CB-CG 4.48Å
492	G	88.2	Confident	92.3	Very high	20 Å²	20	47.5 Å²	47.5	21%	0.206	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	39.6	178.1	0	0	0	0	0	113.5	Y488 W489 T490	Y488-G492 PolarHBondContact O-N 3.47Å; W489-G492 PolarHBondContact O-N 3.07Å; T490-G492 VanDerWaalsContact C-N 3.26Å; T490-G492 PolarHBondContact O-N 3.45Å
493	L	88.8	Confident	92.3	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.042	25%	0.248	C	C	.	.			trans	-65.1	177.5	170.6	-67	171.3	0	0	0	110.9	L423 Y488 L491 F503 E580	L423-L493 HydrophobicContact CD2-CD1 4.33Å; L423-L493 HydrophobicContact CD2-CD2 4.01Å; Y488-L493 HydrophobicContact CD1-CB 4.41Å; Y488-L493 HydrophobicContact CD2-CB 3.85Å; Y488-L493 HydrophobicContact CD2-CD1 3.45Å; Y488-L493 VanDerWaalsContact CD2-CD1 3.45Å; Y488-L493 HydrophobicContact CD2-CG 4.28Å; Y488-L493 HydrophobicContact CE1-CB 4.23Å; Y488-L493 HydrophobicContact CE2-CB 3.67Å; Y488-L493 HydrophobicContact CE2-CD1 3.87Å; Y488-L493 HydrophobicContact CE2-CG 4.43Å; Y488-L493 HydrophobicContact CG-CB 4.22Å; Y488-L493 HydrophobicContact CG-CD1 4.14Å; Y488-L493 PolarHBondContact O-N 3.41Å; L491-L493 HydrophobicContact CB-CG 4.48Å; L493-F503 HydrophobicContact CD1-CD2 4.45Å; L493-F503 HydrophobicContact CD1-CE2 3.91Å; L493-F503 HydrophobicContact CD1-CZ 4.07Å; L493-E580 WeakPolarHBondContact CB-OE2 3.25Å; L493-E580 HydrophobicContact CD2-CG 4.12Å; L493-E580 WeakPolarHBondContact CD2-OE1 3.49Å; L493-E580 WeakPolarHBondContact CD2-OE2 3.42Å
494	Y	90	Very high	92.4	Very high	56 Å²	56	45 Å²	45	22%	0.22	25%	0.251	C	S	.	.			trans	-51	125.2	-173.2	-165.9	-82.2	0	0	0	112.9	Y488 E496 R499 E580 L584	Y488-Y494 VanDerWaalsContact CE1-O 3.23Å; Y488-Y494 WeakPolarHBondContact CE1-O 3.32Å; Y488-Y494 PolarHBondContact OH-O 3Å; Y494-E496 HydrophobicContact CD1-CB 3.66Å; Y494-E496 HydrophobicContact CE1-CB 3.62Å; Y494-E496 WeakPolarHBondContact CE1-OE2 3.23Å; Y494-E496 PolarHBondContact O-N 3.25Å; Y494-R499 HydrophobicContact CD1-CG 4.26Å; Y494-R499 VanDerWaalsContact CD1-NE 3.35Å; Y494-R499 VanDerWaalsContact CE1-NE 3.33Å; Y494-R499 VanDerWaalsContact CZ-CZ 3.48Å; Y494-R499 VanDerWaalsContact CZ-NH2 3.33Å; Y494-R499 PolarHBondContact OH-NH2 2.84Å; Y494-E580 PolarHBondContact N-OE2 2.87Å; Y494-L584 HydrophobicContact CD2-CD2 3.59Å; Y494-L584 HydrophobicContact CD2-CG 3.87Å; Y494-L584 HydrophobicContact CE2-CD2 4.07Å; Y494-L584 HydrophobicContact CE2-CG 4.39Å
495	P	87.3	Confident	92.5	Very high	97 Å²	97	46.3 Å²	46.3	63%	0.63	26%	0.262	S	S	*	.			trans	-74.9	8.6	-160.3	29.2	-37	0	0	0	116.5
496	E	91.9	Very high	92.7	Very high	89 Å²	89	44.2 Å²	44.2	42%	0.416	25%	0.248	S	C	.	.			trans	-90.8	131.3	-174.1	-177.5	176.7	-163.6	0	0	112.6	Y494 A498 R499 F500	Y494-E496 HydrophobicContact CD1-CB 3.66Å; Y494-E496 HydrophobicContact CE1-CB 3.62Å; Y494-E496 WeakPolarHBondContact CE1-OE2 3.23Å; Y494-E496 PolarHBondContact O-N 3.25Å; E496-A498 VanDerWaalsContact C-N 3.32Å; E496-A498 HydrophobicContact CG-CB 4.3Å; E496-A498 PolarHBondContact O-N 3.04Å; E496-R499 HydrophobicContact CB-CB 4.5Å; E496-R499 HydrophobicContact CB-CG 4.1Å; E496-R499 HydrophobicContact CG-CG 4.33Å; E496-R499 WeakPolarHBondContact O-CB 3.29Å; E496-R499 PolarHBondContact O-N 3.44Å; E496-R499 VanDerWaalsContact O-N 3.1Å; E496-R499 IonicContact OE2-CZ 3.39Å; E496-R499 IonicContact OE2-NE 3.41Å; E496-R499 PolarHBondContact OE2-NE 3.25Å; E496-R499 VanDerWaalsContact OE2-NE 3.11Å; E496-F500 PolarHBondContact O-N 2.97Å; E496-F500 VanDerWaalsContact O-N 3.16Å
497	V	93.1	Very high	92.8	Very high	105 Å²	105	41.8 Å²	41.8	64%	0.636	23%	0.233	S	C	*	.	H	α-helix	trans	-63.4	-34.5	-175.3	-177.7	0	0	0	0	112.6	W489 R499 F500 G501	W489-V497 HydrophobicContact CH2-CG2 4.42Å; V497-R499 VanDerWaalsContact C-N 3.28Å; V497-R499 PolarHBondContact O-N 2.91Å; V497-F500 WeakPolarHBondContact O-CB 3.5Å; V497-F500 PolarHBondContact O-N 3.4Å; V497-G501 PolarHBondContact O-N 2.64Å
498	A	94	Very high	92.9	Very high	52 Å²	52	43 Å²	43	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-61.4	-39.9	176.1	0	0	0	0	0	111.6	E496 G501 Y502	E496-A498 VanDerWaalsContact C-N 3.32Å; E496-A498 HydrophobicContact CG-CB 4.3Å; E496-A498 PolarHBondContact O-N 3.04Å; A498-G501 WeakPolarHBondContact O-CA 3.43Å; A498-G501 PolarHBondContact O-N 3.42Å; A498-G501 VanDerWaalsContact O-N 3.12Å; A498-Y502 HydrophobicContact CB-CE2 4.49Å; A498-Y502 WeakPolarHBondContact O-CD2 3.44Å; A498-Y502 PolarHBondContact O-N 3.18Å
499	R	92.6	Very high	93.1	Very high	29 Å²	29	42.9 Å²	42.9	11%	0.109	24%	0.239	C	C	.	.	H	α-helix	trans	-71.3	-32.7	178.6	-58.2	-157.4	-166.2	-168.4	0.2	113	Y488 Y494 E496 V497 G501 Y502 F503 N579 Y582	Y488-R499 WeakPolarHBondContact OH-CB 3.37Å; Y494-R499 HydrophobicContact CD1-CG 4.26Å; Y494-R499 VanDerWaalsContact CD1-NE 3.35Å; Y494-R499 VanDerWaalsContact CE1-NE 3.33Å; Y494-R499 VanDerWaalsContact CZ-CZ 3.48Å; Y494-R499 VanDerWaalsContact CZ-NH2 3.33Å; Y494-R499 PolarHBondContact OH-NH2 2.84Å; E496-R499 HydrophobicContact CB-CB 4.5Å; E496-R499 HydrophobicContact CB-CG 4.1Å; E496-R499 HydrophobicContact CG-CG 4.33Å; E496-R499 WeakPolarHBondContact O-CB 3.29Å; E496-R499 PolarHBondContact O-N 3.44Å; E496-R499 VanDerWaalsContact O-N 3.1Å; E496-R499 IonicContact OE2-CZ 3.39Å; E496-R499 IonicContact OE2-NE 3.41Å; E496-R499 PolarHBondContact OE2-NE 3.25Å; E496-R499 VanDerWaalsContact OE2-NE 3.11Å; V497-R499 VanDerWaalsContact C-N 3.28Å; V497-R499 PolarHBondContact O-N 2.91Å; R499-G501 VanDerWaalsContact C-N 3.3Å; R499-Y502 PolarHBondContact O-N 3.44Å; R499-F503 VanDerWaalsContact O-CB 3.28Å; R499-F503 WeakPolarHBondContact O-CB 3.34Å; R499-F503 PolarHBondContact O-N 2.92Å; R499-N579 WeakPolarHBondContact CA-OD1 3.24Å; R499-N579 WeakPolarHBondContact CB-OD1 3.48Å; R499-N579 VanDerWaalsContact CD-O 3.24Å; R499-N579 WeakPolarHBondContact CD-O 3.45Å; R499-N579 PolarHBondContact NH1-O 2.88Å; R499-N579 PolarHBondContact O-ND2 3.48Å; R499-Y582 PolarHBondContact NH1-O 3.49Å; R499-Y582 PolarHBondContact NH2-O 3.44Å
500	F	94.6	Very high	93.2	Very high	35 Å²	35	37.1 Å²	37.1	15%	0.154	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-41.7	167	167.3	-102.9	0	0	0	111.8	S484 Y488 W489 E496 V497 F503 S504	S484-F500 WeakPolarHBondContact OG-CE2 3.35Å; Y488-F500 HydrophobicContact CD1-CB 4.03Å; Y488-F500 AromaticContact CD1-CD2 3.84Å; Y488-F500 HydrophobicContact CD1-CD2 3.84Å; Y488-F500 HydrophobicContact CD1-CG 4.39Å; Y488-F500 HydrophobicContact CD2-CD2 4.37Å; Y488-F500 HydrophobicContact CE1-CB 3.86Å; Y488-F500 HydrophobicContact CE1-CD2 4.49Å; Y488-F500 AromaticContact CG-CD2 3.77Å; Y488-F500 HydrophobicContact CG-CD2 3.77Å; W489-F500 HydrophobicContact CZ2-CB 4.47Å; E496-F500 PolarHBondContact O-N 2.97Å; E496-F500 VanDerWaalsContact O-N 3.16Å; V497-F500 WeakPolarHBondContact O-CB 3.5Å; V497-F500 PolarHBondContact O-N 3.4Å; F500-F503 PolarHBondContact O-N 2.95Å; F500-S504 WeakPolarHBondContact CE2-OG 3.35Å; F500-S504 WeakPolarHBondContact CZ-OG 3.03Å; F500-S504 WeakPolarHBondContact O-CB 3.43Å; F500-S504 PolarHBondContact O-N 3.21Å; F500-S504 PolarHBondContact O-OG 3.47Å
501	G	94.6	Very high	93.3	Very high	36 Å²	36	33.8 Å²	33.8	37%	0.371	20%	0.197	S	C	.	.	H	α-helix	trans	-60.2	-48.8	174.5	0	0	0	0	0	112.6	V497 A498 R499 F503 S504 A505	V497-G501 PolarHBondContact O-N 2.64Å; A498-G501 WeakPolarHBondContact O-CA 3.43Å; A498-G501 PolarHBondContact O-N 3.42Å; A498-G501 VanDerWaalsContact O-N 3.12Å; R499-G501 VanDerWaalsContact C-N 3.3Å; G501-F503 PolarHBondContact O-N 3.46Å; G501-S504 PolarHBondContact O-N 3.28Å; G501-A505 PolarHBondContact O-N 3.43Å
502	Y	94.8	Very high	93.5	Very high	111 Å²	111	34 Å²	34	44%	0.435	20%	0.198	S	C	.	.	H	α-helix	trans	-63	-40.9	176.3	-66.7	-53.8	0	0	0	112.8	A498 R499 A505 A506 F621 F625	A498-Y502 HydrophobicContact CB-CE2 4.49Å; A498-Y502 WeakPolarHBondContact O-CD2 3.44Å; A498-Y502 PolarHBondContact O-N 3.18Å; R499-Y502 PolarHBondContact O-N 3.44Å; Y502-A505 PolarHBondContact O-N 2.86Å; Y502-A506 VanDerWaalsContact O-CB 3.24Å; Y502-A506 WeakPolarHBondContact O-CB 3.36Å; Y502-A506 PolarHBondContact O-N 3.45Å; Y502-F621 HydrophobicContact CD1-CE1 4.36Å; Y502-F621 HydrophobicContact CD1-CZ 4.45Å; Y502-F621 HydrophobicContact CD2-CZ 4.38Å; Y502-F621 HydrophobicContact CE1-CE1 4.46Å; Y502-F621 HydrophobicContact CG-CE1 4.43Å; Y502-F621 HydrophobicContact CG-CZ 4.17Å; Y502-F625 AromaticContact CD1-CE2 3.95Å; Y502-F625 HydrophobicContact CD1-CE2 3.95Å; Y502-F625 AromaticContact CD1-CZ 3.89Å; Y502-F625 HydrophobicContact CD1-CZ 3.89Å; Y502-F625 HydrophobicContact CG-CZ 4.4Å
503	F	94.8	Very high	93.9	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-46.3	175	178.1	-95.6	0	0	0	111.5	L424 L427 Y488 L493 R499 F500 G501 A506 L507 L576	L424-F503 HydrophobicContact CD2-CE2 4.35Å; L427-F503 HydrophobicContact CD1-CE2 3.79Å; L427-F503 HydrophobicContact CD1-CZ 3.59Å; Y488-F503 HydrophobicContact CD2-CB 4Å; Y488-F503 AromaticContact CD2-CD1 3.58Å; Y488-F503 HydrophobicContact CD2-CD1 3.58Å; Y488-F503 HydrophobicContact CD2-CD2 4.02Å; Y488-F503 AromaticContact CD2-CE1 3.93Å; Y488-F503 HydrophobicContact CD2-CE1 3.93Å; Y488-F503 HydrophobicContact CD2-CE2 4.36Å; Y488-F503 AromaticContact CD2-CG 3.61Å; Y488-F503 HydrophobicContact CD2-CG 3.61Å; Y488-F503 HydrophobicContact CD2-CZ 4.3Å; Y488-F503 HydrophobicContact CE2-CB 3.89Å; Y488-F503 HydrophobicContact CE2-CD1 4.33Å; Y488-F503 HydrophobicContact CE2-CD2 4.21Å; Y488-F503 AromaticContact CE2-CG 3.92Å; Y488-F503 HydrophobicContact CE2-CG 3.92Å; Y488-F503 HydrophobicContact CG-CD1 4.38Å; L493-F503 HydrophobicContact CD1-CD2 4.45Å; L493-F503 HydrophobicContact CD1-CE2 3.91Å; L493-F503 HydrophobicContact CD1-CZ 4.07Å; R499-F503 VanDerWaalsContact O-CB 3.28Å; R499-F503 WeakPolarHBondContact O-CB 3.34Å; R499-F503 PolarHBondContact O-N 2.92Å; F500-F503 PolarHBondContact O-N 2.95Å; G501-F503 PolarHBondContact O-N 3.46Å; F503-A506 PolarHBondContact O-N 2.92Å; F503-L507 HydrophobicContact CD1-CD1 3.77Å; F503-L507 HydrophobicContact CD2-CD1 4.41Å; F503-L507 HydrophobicContact CE1-CD1 3.28Å; F503-L507 HydrophobicContact CE2-CD1 3.99Å; F503-L507 HydrophobicContact CG-CD1 4.32Å; F503-L507 HydrophobicContact CZ-CD1 3.43Å; F503-L507 VanDerWaalsContact CZ-CD1 3.43Å; F503-L507 WeakPolarHBondContact O-CG 3.34Å; F503-L507 PolarHBondContact O-N 2.74Å; F503-L507 VanDerWaalsContact O-N 3.11Å; F503-L576 HydrophobicContact CD2-CD2 3.56Å; F503-L576 HydrophobicContact CE2-CD2 4.08Å; F503-L576 HydrophobicContact CG-CD2 4.37Å
504	S	95.3	Very high	94.2	Very high	13 Å²	13	32.8 Å²	32.8	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-43	178.7	-57.7	0	0	0	0	112.1	S484 F500 G501 L507 L508	S484-S504 VanDerWaalsContact CB-OG 3.27Å; S484-S504 WeakPolarHBondContact CB-OG 3.19Å; S484-S504 PolarHBondContact OG-OG 3.47Å; F500-S504 WeakPolarHBondContact CE2-OG 3.35Å; F500-S504 WeakPolarHBondContact CZ-OG 3.03Å; F500-S504 WeakPolarHBondContact O-CB 3.43Å; F500-S504 PolarHBondContact O-N 3.21Å; F500-S504 PolarHBondContact O-OG 3.47Å; G501-S504 PolarHBondContact O-N 3.28Å; S504-L507 PolarHBondContact O-N 3.05Å; S504-L508 PolarHBondContact O-N 3.31Å; S504-L508 VanDerWaalsContact O-N 3.08Å
505	A	95.6	Very high	94.4	Very high	28 Å²	28	30.1 Å²	30.1	23%	0.231	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-42.5	175.7	0	0	0	0	0	112	G501 Y502 L507 L508 A509 F625 Y629	G501-A505 PolarHBondContact O-N 3.43Å; Y502-A505 PolarHBondContact O-N 2.86Å; A505-L507 VanDerWaalsContact C-N 3.26Å; A505-L507 PolarHBondContact O-N 2.74Å; A505-L508 PolarHBondContact O-N 2.81Å; A505-A509 PolarHBondContact O-N 3.4Å; A505-F625 HydrophobicContact CB-CE1 3.98Å; A505-Y629 PolarHBondContact O-OH 3.05Å
506	A	95.5	Very high	94.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-31.8	178.8	0	0	0	0	0	112.9	Y502 F503 P510 C572 I575 L576 F625	Y502-A506 VanDerWaalsContact O-CB 3.24Å; Y502-A506 WeakPolarHBondContact O-CB 3.36Å; Y502-A506 PolarHBondContact O-N 3.45Å; F503-A506 PolarHBondContact O-N 2.92Å; A506-P510 WeakPolarHBondContact O-CD 3.03Å; A506-P510 WeakPolarHBondContact O-CG 3.28Å; A506-C572 PolarHBondContact O-SG 3.04Å; A506-I575 HydrophobicContact CB-CG2 3.81Å; A506-L576 HydrophobicContact CB-CD2 3.77Å; A506-L576 HydrophobicContact CB-CG 4.16Å; A506-F625 HydrophobicContact CB-CE1 4.44Å; A506-F625 HydrophobicContact CB-CZ 4.45Å
507	L	94.8	Very high	95	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-85.4	-25.8	177.8	-66	174.8	0	0	0	113.9	L427 T431 T480 F483 F503 S504 A505 A509 P510 H511 L576	L427-L507 HydrophobicContact CB-CD2 3.89Å; T431-L507 HydrophobicContact CG2-CB 4.38Å; T431-L507 HydrophobicContact CG2-CD2 4.17Å; T480-L507 HydrophobicContact CG2-CB 4.13Å; F483-L507 HydrophobicContact CD1-CD1 4.47Å; F483-L507 HydrophobicContact CE1-CD1 3.91Å; F503-L507 HydrophobicContact CD1-CD1 3.77Å; F503-L507 HydrophobicContact CD2-CD1 4.41Å; F503-L507 HydrophobicContact CE1-CD1 3.28Å; F503-L507 HydrophobicContact CE2-CD1 3.99Å; F503-L507 HydrophobicContact CG-CD1 4.32Å; F503-L507 HydrophobicContact CZ-CD1 3.43Å; F503-L507 VanDerWaalsContact CZ-CD1 3.43Å; F503-L507 WeakPolarHBondContact O-CG 3.34Å; F503-L507 PolarHBondContact O-N 2.74Å; F503-L507 VanDerWaalsContact O-N 3.11Å; S504-L507 PolarHBondContact O-N 3.05Å; A505-L507 VanDerWaalsContact C-N 3.26Å; A505-L507 PolarHBondContact O-N 2.74Å; L507-A509 VanDerWaalsContact C-N 3.32Å; L507-A509 PolarHBondContact O-N 3.38Å; L507-P510 WeakPolarHBondContact O-CD 3.4Å; L507-H511 PolarHBondContact O-N 3.28Å; L507-L576 HydrophobicContact CD2-CD1 4.14Å
508	L	95.8	Very high	95.1	Very high	25 Å²	25	18 Å²	18	13%	0.131	11%	0.105	C	C	.	.	H	α-helix	trans	-63.5	-40.7	175.5	177.1	62.4	0	0	0	111.1	V477 T480 S504 A505 H511 L512	V477-L508 HydrophobicContact CG2-CD1 4.11Å; V477-L508 HydrophobicContact CG2-CD2 3.8Å; T480-L508 HydrophobicContact CG2-CB 4.05Å; S504-L508 PolarHBondContact O-N 3.31Å; S504-L508 VanDerWaalsContact O-N 3.08Å; A505-L508 PolarHBondContact O-N 2.81Å; L508-H511 PolarHBondContact O-N 3.43Å; L508-L512 HydrophobicContact CD1-CD1 4.05Å; L508-L512 HydrophobicContact CD1-CG 4.11Å; L508-L512 HydrophobicContact CG-CD1 3.97Å; L508-L512 HydrophobicContact CG-CG 4.41Å; L508-L512 WeakPolarHBondContact O-CG 3.42Å; L508-L512 PolarHBondContact O-N 3.05Å
509	A	96	Very high	95.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64	-51.3	-176.3	0	0	0	0	0	113.3	A505 L507 H511 L512 I513 L628 Y629 I632	A505-A509 PolarHBondContact O-N 3.4Å; L507-A509 VanDerWaalsContact C-N 3.32Å; L507-A509 PolarHBondContact O-N 3.38Å; A509-H511 VanDerWaalsContact C-N 3.28Å; A509-H511 PolarHBondContact O-N 3.17Å; A509-L512 PolarHBondContact O-N 3.4Å; A509-I513 WeakPolarHBondContact O-CB 3.47Å; A509-I513 WeakPolarHBondContact O-CG1 3.5Å; A509-I513 PolarHBondContact O-N 2.85Å; A509-L628 HydrophobicContact CB-CD1 4.05Å; A509-L628 HydrophobicContact CB-CD2 3.88Å; A509-L628 HydrophobicContact CB-CG 3.62Å; A509-Y629 HydrophobicContact CB-CD1 4.45Å; A509-Y629 HydrophobicContact CB-CD2 4.38Å; A509-Y629 HydrophobicContact CB-CE1 4.23Å; A509-Y629 HydrophobicContact CB-CE2 4.16Å; A509-I632 HydrophobicContact CB-CD1 4.18Å
510	P	95.3	Very high	95.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-56.4	-38.5	173	-26.9	34	0	0	0	113.7	T431 P432 A506 L507 I513 G514 F568 C572	T431-P510 WeakPolarHBondContact OG1-CB 3.29Å; P432-P510 VanDerWaalsContact CA-O 3.29Å; P432-P510 WeakPolarHBondContact CA-O 3.42Å; P432-P510 WeakPolarHBondContact CB-O 3.49Å; A506-P510 WeakPolarHBondContact O-CD 3.03Å; A506-P510 WeakPolarHBondContact O-CG 3.28Å; L507-P510 WeakPolarHBondContact O-CD 3.4Å; P510-I513 PolarHBondContact O-N 3.28Å; P510-G514 PolarHBondContact O-N 3.45Å; P510-F568 HydrophobicContact CB-CD2 4.45Å; P510-F568 HydrophobicContact CB-CE2 4.11Å; P510-C572 HydrophobicContact CG-CB 4.19Å; P510-C572 VanDerWaalsContact CG-SG 3.51Å
511	H	95.2	Very high	95.3	Very high	1 Å²	1	14 Å²	14	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-60.8	-47.7	176.3	-172.5	71.8	0	0	0	112	N394 T431 T434 G435 N438 L507 L508 A509 E515	N394-H511 PolarHBondContact ND2-CE1 3.47Å; T431-H511 WeakPolarHBondContact O-CA 3.39Å; T431-H511 PolarHBondContact O-ND1 3.45Å; T434-H511 PolarHBondContact OG1-CE1 2.87Å; T434-H511 VanDerWaalsContact OG1-CE1 3.26Å; T434-H511 PolarHBondContact OG1-ND1 3.25Å; G435-H511 WeakPolarHBondContact CA-O 3.34Å; G435-H511 PolarHBondContact N-CE1 3.01Å; G435-H511 PolarHBondContact N-ND1 3.26Å; N438-H511 PolarHBondContact ND2-NE2 3.35Å; L507-H511 PolarHBondContact O-N 3.28Å; L508-H511 PolarHBondContact O-N 3.43Å; A509-H511 VanDerWaalsContact C-N 3.28Å; A509-H511 PolarHBondContact O-N 3.17Å; H511-E515 PolarHBondContact O-N 3.11Å
512	L	96.1	Very high	95.2	Very high	6 Å²	6	12.3 Å²	12.3	3%	0.031	6%	0.062	C	C	.	.	H	α-helix	trans	-66.7	-37.8	175.3	-69.5	177.1	0	0	0	112.6	V472 L473 L508 A509 E515 F516 I632	V472-L512 HydrophobicContact CG1-CD2 4.47Å; L473-L512 HydrophobicContact CD2-CD1 3.94Å; L473-L512 HydrophobicContact CD2-CD2 4Å; L508-L512 HydrophobicContact CD1-CD1 4.05Å; L508-L512 HydrophobicContact CD1-CG 4.11Å; L508-L512 HydrophobicContact CG-CD1 3.97Å; L508-L512 HydrophobicContact CG-CG 4.41Å; L508-L512 WeakPolarHBondContact O-CG 3.42Å; L508-L512 PolarHBondContact O-N 3.05Å; A509-L512 PolarHBondContact O-N 3.4Å; L512-E515 PolarHBondContact O-N 2.71Å; L512-F516 HydrophobicContact CB-CD2 4.26Å; L512-F516 HydrophobicContact CB-CE2 3.85Å; L512-F516 HydrophobicContact CD2-CE2 4.21Å; L512-F516 HydrophobicContact CD2-CZ 4.08Å; L512-F516 HydrophobicContact CG-CE2 4.46Å; L512-F516 WeakPolarHBondContact O-CD2 3.48Å; L512-F516 VanDerWaalsContact O-CG 3.28Å; L512-F516 WeakPolarHBondContact O-CG 3.28Å; L512-F516 PolarHBondContact O-N 3.19Å; L512-I632 HydrophobicContact CB-CD1 4.04Å; L512-I632 HydrophobicContact CB-CG1 4.3Å; L512-I632 HydrophobicContact CD1-CD1 3.99Å
513	I	96.1	Very high	95	Very high	2 Å²	2	7.2 Å²	7.2	1%	0.01	4%	0.044	C	C	.	.	H	α-helix	trans	-63.1	-46.2	177.6	-72.5	165.5	0	0	0	110.6	A509 P510 E515 F516 L517 F568 L628 F631 I632 L635	A509-I513 WeakPolarHBondContact O-CB 3.47Å; A509-I513 WeakPolarHBondContact O-CG1 3.5Å; A509-I513 PolarHBondContact O-N 2.85Å; P510-I513 PolarHBondContact O-N 3.28Å; I513-E515 VanDerWaalsContact C-N 3.27Å; I513-E515 PolarHBondContact O-N 3.05Å; I513-F516 PolarHBondContact O-N 3.15Å; I513-L517 WeakPolarHBondContact O-CB 2.88Å; I513-L517 PolarHBondContact O-N 3.28Å; I513-F568 HydrophobicContact CD1-CB 3.74Å; I513-F568 HydrophobicContact CD1-CD1 4.45Å; I513-F568 HydrophobicContact CD1-CD2 4.01Å; I513-F568 HydrophobicContact CD1-CG 3.82Å; I513-F568 HydrophobicContact CG2-CD1 3.59Å; I513-F568 HydrophobicContact CG2-CD2 4.31Å; I513-F568 HydrophobicContact CG2-CE1 3.54Å; I513-F568 HydrophobicContact CG2-CE2 4.29Å; I513-F568 HydrophobicContact CG2-CG 3.98Å; I513-F568 HydrophobicContact CG2-CZ 3.91Å; I513-L628 HydrophobicContact CD1-CD1 4.09Å; I513-F631 HydrophobicContact CD1-CB 3.85Å; I513-F631 HydrophobicContact CG1-CB 4.15Å; I513-I632 HydrophobicContact CG1-CG1 3.91Å; I513-L635 HydrophobicContact CB-CD1 4.35Å; I513-L635 HydrophobicContact CG1-CD1 4.4Å; I513-L635 HydrophobicContact CG2-CD1 3.89Å
514	G	94.8	Very high	94.8	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60	-39.2	176.7	0	0	0	0	0	112.5	P432 P510 T518	P432-G514 WeakPolarHBondContact O-CA 3.15Å; P510-G514 PolarHBondContact O-N 3.45Å; G514-T518 WeakPolarHBondContact O-CB 3.45Å; G514-T518 PolarHBondContact O-N 3.42Å; G514-T518 VanDerWaalsContact O-N 3.14Å; G514-T518 PolarHBondContact O-OG1 2.86Å
515	E	95.1	Very high	94.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.2	-52.8	175.2	-179.6	133.8	-141.5	0	0	112.6	R390 G435 A439 Y468 V472 H511 L512 I513 T518 L519	R390-E515 IonicContact CZ-OE1 2.74Å; R390-E515 IonicContact CZ-OE2 3.79Å; R390-E515 IonicContact NH1-OE1 2.66Å; R390-E515 PolarHBondContact NH1-OE1 3.22Å; R390-E515 VanDerWaalsContact NH1-OE1 3.17Å; R390-E515 IonicContact NH2-OE1 3.36Å; R390-E515 PolarHBondContact NH2-OE1 3.28Å; R390-E515 IonicContact NH2-OE2 3.2Å; R390-E515 PolarHBondContact NH2-OE2 3.43Å; G435-E515 WeakPolarHBondContact O-CA 3.43Å; G435-E515 WeakPolarHBondContact O-CB 3.19Å; A439-E515 HydrophobicContact CB-CG 4.17Å; Y468-E515 HydrophobicContact CE1-CG 4.2Å; Y468-E515 PolarHBondContact OH-OE1 2.81Å; V472-E515 HydrophobicContact CG2-CG 4.41Å; V472-E515 WeakPolarHBondContact CG2-OE1 3.42Å; V472-E515 WeakPolarHBondContact CG2-OE2 3.36Å; H511-E515 PolarHBondContact O-N 3.11Å; L512-E515 PolarHBondContact O-N 2.71Å; I513-E515 VanDerWaalsContact C-N 3.27Å; I513-E515 PolarHBondContact O-N 3.05Å; E515-T518 WeakPolarHBondContact O-CB 2.95Å; E515-T518 PolarHBondContact O-N 2.61Å; E515-L519 WeakPolarHBondContact O-CG 3.43Å; E515-L519 PolarHBondContact O-N 2.93Å
516	F	95.8	Very high	94.1	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.018	10%	0.096	C	C	.	.	H	α-helix	trans	-69.8	-35.1	-177.9	-59.4	-35.7	0	0	0	113.1	V469 V472 L473 L512 I513 T518 L519 V520 I632 L635 V636	V469-F516 HydrophobicContact CB-CE1 4.06Å; V469-F516 HydrophobicContact CG1-CE1 3.74Å; V469-F516 HydrophobicContact CG1-CZ 3.84Å; V469-F516 HydrophobicContact CG2-CD1 3.97Å; V469-F516 HydrophobicContact CG2-CE1 3.77Å; V472-F516 HydrophobicContact CG1-CE1 3.66Å; V472-F516 HydrophobicContact CG1-CZ 3.91Å; L473-F516 HydrophobicContact CD2-CZ 4.24Å; L512-F516 HydrophobicContact CB-CD2 4.26Å; L512-F516 HydrophobicContact CB-CE2 3.85Å; L512-F516 HydrophobicContact CD2-CE2 4.21Å; L512-F516 HydrophobicContact CD2-CZ 4.08Å; L512-F516 HydrophobicContact CG-CE2 4.46Å; L512-F516 WeakPolarHBondContact O-CD2 3.48Å; L512-F516 VanDerWaalsContact O-CG 3.28Å; L512-F516 WeakPolarHBondContact O-CG 3.28Å; L512-F516 PolarHBondContact O-N 3.19Å; I513-F516 PolarHBondContact O-N 3.15Å; F516-T518 VanDerWaalsContact C-N 3.3Å; F516-T518 PolarHBondContact O-N 3.26Å; F516-L519 HydrophobicContact CD1-CD1 3.81Å; F516-L519 HydrophobicContact CE1-CD1 4.45Å; F516-L519 WeakPolarHBondContact O-CB 3.38Å; F516-L519 PolarHBondContact O-N 2.75Å; F516-V520 VanDerWaalsContact O-CG2 3.31Å; F516-V520 WeakPolarHBondContact O-CG2 3.07Å; F516-V520 PolarHBondContact O-N 3.07Å; F516-I632 HydrophobicContact CD2-CG2 3.79Å; F516-I632 HydrophobicContact CE2-CG2 3.51Å; F516-L635 HydrophobicContact CB-CB 3.95Å; F516-L635 HydrophobicContact CB-CD1 4.33Å; F516-V636 HydrophobicContact CD2-CG2 4.11Å; F516-V636 HydrophobicContact CE2-CG2 4.31Å; F516-V636 HydrophobicContact CG-CG2 4.22Å
517	L	95.2	Very high	93.9	Very high	31 Å²	31	22.1 Å²	22.1	16%	0.162	12%	0.115	C	C	.	.	H	α-helix	trans	-59.2	-44.7	170.7	-179.6	62.7	0	0	0	110.6	I513 L519 V520 L521 V535 L538 L635	I513-L517 WeakPolarHBondContact O-CB 2.88Å; I513-L517 PolarHBondContact O-N 3.28Å; L517-L519 VanDerWaalsContact C-N 3.33Å; L517-L519 PolarHBondContact O-N 3.05Å; L517-V520 WeakPolarHBondContact O-CB 3.5Å; L517-V520 PolarHBondContact O-N 3.49Å; L517-L521 HydrophobicContact CD1-CD1 3.56Å; L517-L521 HydrophobicContact CG-CD1 3.79Å; L517-L521 WeakPolarHBondContact O-CD1 3.42Å; L517-L521 PolarHBondContact O-N 3.44Å; L517-V535 HydrophobicContact CD2-CG1 4.29Å; L517-V535 HydrophobicContact CG-CG2 4.45Å; L517-L538 HydrophobicContact CD2-CD1 4.36Å; L517-L635 HydrophobicContact CB-CD1 4.39Å; L517-L635 HydrophobicContact CB-CD2 4.46Å; L517-L635 HydrophobicContact CD1-CD2 4.1Å
518	T	96.1	Very high	93.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.4	-41	176.5	-59.1	0	0	0	0	112	M436 A439 V440 G514 E515 F516 L521 L522 V531	M436-T518 VanDerWaalsContact CA-OG1 3.3Å; M436-T518 WeakPolarHBondContact CA-OG1 3.22Å; M436-T518 WeakPolarHBondContact CB-OG1 3.26Å; M436-T518 HydrophobicContact CG-CG2 4.24Å; M436-T518 WeakPolarHBondContact CG-OG1 3.39Å; A439-T518 HydrophobicContact CB-CG2 3.58Å; V440-T518 HydrophobicContact CG2-CG2 3.45Å; V440-T518 VanDerWaalsContact CG2-CG2 3.45Å; G514-T518 WeakPolarHBondContact O-CB 3.45Å; G514-T518 PolarHBondContact O-N 3.42Å; G514-T518 VanDerWaalsContact O-N 3.14Å; G514-T518 PolarHBondContact O-OG1 2.86Å; E515-T518 WeakPolarHBondContact O-CB 2.95Å; E515-T518 PolarHBondContact O-N 2.61Å; F516-T518 VanDerWaalsContact C-N 3.3Å; F516-T518 PolarHBondContact O-N 3.26Å; T518-L521 PolarHBondContact O-N 3.01Å; T518-L522 HydrophobicContact CG2-CD1 3.93Å; T518-L522 HydrophobicContact CG2-CG 4.36Å; T518-L522 WeakPolarHBondContact O-CB 3.38Å; T518-L522 VanDerWaalsContact O-CG 3.31Å; T518-L522 WeakPolarHBondContact O-CG 3.2Å; T518-L522 PolarHBondContact O-N 3.46Å; T518-V531 HydrophobicContact CG2-CG1 3.97Å
519	L	95	Very high	93.7	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-43.7	176	-66.7	174.3	0	0	0	112.7	A439 F443 L465 Y468 V469 E515 F516 L517 L521 L522 G523	A439-L519 HydrophobicContact CB-CD2 4.24Å; A439-L519 HydrophobicContact CB-CG 4.39Å; F443-L519 HydrophobicContact CB-CD2 3.74Å; F443-L519 HydrophobicContact CD1-CD2 3.72Å; F443-L519 HydrophobicContact CD2-CD2 3.29Å; F443-L519 HydrophobicContact CE1-CD2 4.14Å; F443-L519 HydrophobicContact CE2-CD2 3.73Å; F443-L519 HydrophobicContact CG-CD2 3.27Å; F443-L519 HydrophobicContact CZ-CD2 4.13Å; L465-L519 HydrophobicContact CD1-CB 3.84Å; L465-L519 HydrophobicContact CD1-CD1 3.98Å; L465-L519 HydrophobicContact CD1-CD2 4.4Å; L465-L519 HydrophobicContact CD1-CG 4.31Å; Y468-L519 HydrophobicContact CD1-CD1 3.4Å; Y468-L519 HydrophobicContact CD1-CD2 3.83Å; Y468-L519 HydrophobicContact CD1-CG 4.21Å; Y468-L519 HydrophobicContact CE1-CD1 3.54Å; Y468-L519 HydrophobicContact CE1-CD2 3.71Å; Y468-L519 HydrophobicContact CE1-CG 4.06Å; Y468-L519 HydrophobicContact CG-CD2 4.48Å; V469-L519 HydrophobicContact CG2-CD1 4.05Å; E515-L519 WeakPolarHBondContact O-CG 3.43Å; E515-L519 PolarHBondContact O-N 2.93Å; F516-L519 HydrophobicContact CD1-CD1 3.81Å; F516-L519 HydrophobicContact CE1-CD1 4.45Å; F516-L519 WeakPolarHBondContact O-CB 3.38Å; F516-L519 PolarHBondContact O-N 2.75Å; L517-L519 VanDerWaalsContact C-N 3.33Å; L517-L519 PolarHBondContact O-N 3.05Å; L519-L521 VanDerWaalsContact C-N 3.34Å; L519-L521 PolarHBondContact O-N 3.34Å; L519-L522 PolarHBondContact O-N 3.23Å; L519-G523 PolarHBondContact O-N 3.39Å
520	V	94.8	Very high	93.6	Very high	8 Å²	8	32.3 Å²	32.3	5%	0.048	17%	0.17	C	C	.	.	H	α-helix	trans	-56.1	-50.1	174.5	164.1	0	0	0	0	109.9	F516 L517 G523 I524 L635 L638 I642	F516-V520 VanDerWaalsContact O-CG2 3.31Å; F516-V520 WeakPolarHBondContact O-CG2 3.07Å; F516-V520 PolarHBondContact O-N 3.07Å; L517-V520 WeakPolarHBondContact O-CB 3.5Å; L517-V520 PolarHBondContact O-N 3.49Å; V520-G523 WeakPolarHBondContact O-CA 3.44Å; V520-G523 PolarHBondContact O-N 3.12Å; V520-G523 VanDerWaalsContact O-N 3.09Å; V520-I524 PolarHBondContact O-N 3.07Å; V520-L635 HydrophobicContact CG2-CD2 4.43Å; V520-L635 VanDerWaalsContact CG2-O 3.29Å; V520-L635 WeakPolarHBondContact CG2-O 3.26Å; V520-L638 HydrophobicContact CG1-CD2 3.86Å; V520-L638 HydrophobicContact CG1-CG 4.17Å; V520-I642 HydrophobicContact CB-CD1 4.34Å; V520-I642 HydrophobicContact CG1-CD1 3.42Å; V520-I642 VanDerWaalsContact CG1-CD1 3.42Å
521	L	94.4	Very high	93.6	Very high	22 Å²	22	32.3 Å²	32.3	12%	0.115	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-37.2	178.4	-84	94.4	0	0	0	112.9	L517 T518 L519 G523 I524 V525 V531 I534 V535	L517-L521 HydrophobicContact CD1-CD1 3.56Å; L517-L521 HydrophobicContact CG-CD1 3.79Å; L517-L521 WeakPolarHBondContact O-CD1 3.42Å; L517-L521 PolarHBondContact O-N 3.44Å; T518-L521 PolarHBondContact O-N 3.01Å; L519-L521 VanDerWaalsContact C-N 3.34Å; L519-L521 PolarHBondContact O-N 3.34Å; L521-G523 PolarHBondContact O-N 3.09Å; L521-I524 PolarHBondContact O-N 3.42Å; L521-I524 VanDerWaalsContact O-N 3.09Å; L521-V525 PolarHBondContact O-N 2.83Å; L521-V531 HydrophobicContact CB-CB 4.48Å; L521-V531 HydrophobicContact CB-CG1 3.61Å; L521-V531 HydrophobicContact CB-CG2 4.12Å; L521-V531 HydrophobicContact CD2-CG1 4.47Å; L521-I534 HydrophobicContact CD2-CB 4Å; L521-I534 HydrophobicContact CD2-CD1 4.41Å; L521-I534 HydrophobicContact CD2-CG2 3.48Å; L521-I534 VanDerWaalsContact CD2-CG2 3.48Å; L521-V535 HydrophobicContact CD1-CG2 4.1Å; L521-V535 HydrophobicContact CD2-CG2 4.19Å
522	L	93.3	Very high	93.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.5	-20.4	172.8	-74.4	169.2	0	0	0	112.5	F443 R447 T518 L519 P528 V531 R646	F443-L522 HydrophobicContact CB-CD1 4.07Å; F443-L522 HydrophobicContact CD1-CB 4.04Å; F443-L522 HydrophobicContact CD1-CD1 3.83Å; F443-L522 HydrophobicContact CE1-CB 4.32Å; F443-L522 HydrophobicContact CG-CD1 4.38Å; R447-L522 WeakPolarHBondContact CD-O 3.31Å; R447-L522 PolarHBondContact NH1-O 3.13Å; T518-L522 HydrophobicContact CG2-CD1 3.93Å; T518-L522 HydrophobicContact CG2-CG 4.36Å; T518-L522 WeakPolarHBondContact O-CB 3.38Å; T518-L522 VanDerWaalsContact O-CG 3.31Å; T518-L522 WeakPolarHBondContact O-CG 3.2Å; T518-L522 PolarHBondContact O-N 3.46Å; L519-L522 PolarHBondContact O-N 3.23Å; L522-P528 HydrophobicContact CD2-CB 4.04Å; L522-P528 HydrophobicContact CD2-CG 4.3Å; L522-V531 HydrophobicContact CD2-CB 4.2Å; L522-V531 HydrophobicContact CD2-CG1 4.4Å; L522-V531 HydrophobicContact CD2-CG2 3.95Å; L522-V531 HydrophobicContact CG-CB 4.49Å; L522-V531 HydrophobicContact CG-CG1 4.16Å; L522-V531 HydrophobicContact CG-CG2 4.34Å; L522-R646 PolarHBondContact O-NH1 2.95Å; L522-R646 VanDerWaalsContact O-NH1 3.07Å
523	G	89.3	Confident	93.5	Very high	4 Å²	4	37.6 Å²	37.6	4%	0.041	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-39.8	169.6	0	0	0	0	0	112.7	L519 V520 L521 R646	L519-G523 PolarHBondContact O-N 3.39Å; V520-G523 WeakPolarHBondContact O-CA 3.44Å; V520-G523 PolarHBondContact O-N 3.12Å; V520-G523 VanDerWaalsContact O-N 3.09Å; L521-G523 PolarHBondContact O-N 3.09Å; G523-R646 PolarHBondContact O-NH1 3.23Å
524	I	90.5	Very high	93.4	Very high	114 Å²	114	40.5 Å²	40.5	59%	0.585	22%	0.22	S	C	*	.	H	α-helix	trans	-88.3	-51.6	-176.6	-57.8	173.1	0	0	0	111.5	V520 L521 I642	V520-I524 PolarHBondContact O-N 3.07Å; L521-I524 PolarHBondContact O-N 3.42Å; L521-I524 VanDerWaalsContact O-N 3.09Å; I524-I642 HydrophobicContact CD1-CD1 3.82Å; I524-I642 HydrophobicContact CD1-CG1 4.4Å; I524-I642 HydrophobicContact CG1-CD1 4.04Å; I524-I642 HydrophobicContact CG1-CG1 4.3Å; I524-I642 HydrophobicContact CG1-CG2 3.7Å
525	V	91	Very high	93.4	Very high	37 Å²	37	40.5 Å²	40.5	22%	0.224	22%	0.22	C	C	.	.			trans	-96.5	123.6	-174.4	-179.2	0	0	0	0	109.4	R447 L521 I530 V531	R447-V525 PolarHBondContact NH1-O 2.92Å; L521-V525 PolarHBondContact O-N 2.83Å; V525-I530 HydrophobicContact CG1-CB 4.19Å; V525-I530 HydrophobicContact CG1-CG2 4.17Å; V525-V531 HydrophobicContact CB-CG2 3.65Å; V525-V531 HydrophobicContact CG1-CG2 3.84Å; V525-V531 HydrophobicContact CG2-CG2 4.47Å
526	Q	85.8	Confident	93.4	Very high	134 Å²	134	41.3 Å²	41.3	63%	0.626	23%	0.226	S	C	*	.	S	Bend	trans	-76.3	-30.5	-177	-67.7	-178.5	-7.2	0	0	112.9	R447 P528	R447-Q526 PolarHBondContact NH1-O 3.32Å; R447-Q526 PolarHBondContact NH2-O 2.85Å; Q526-P528 WeakPolarHBondContact O-CD 3.28Å
527	N	91.7	Very high	93.3	Very high	74 Å²	74	46.9 Å²	46.9	40%	0.396	26%	0.255	S	S	.	.			trans	-86.3	114.1	-178.6	-170	-28.8	0	0	0	111.8	N529 I530 V531	N527-N529 VanDerWaalsContact C-N 3.3Å; N527-N529 PolarHBondContact O-N 3.3Å; N527-N529 WeakPolarHBondContact OD1-CB 3.34Å; N527-N529 PolarHBondContact OD1-N 2.98Å; N527-I530 HydrophobicContact CB-CB 4.41Å; N527-I530 HydrophobicContact CB-CD1 3.93Å; N527-I530 HydrophobicContact CB-CG1 4.06Å; N527-I530 PolarHBondContact O-N 3.4Å; N527-V531 PolarHBondContact O-N 3.03Å
528	P	92.1	Very high	93.2	Very high	32 Å²	32	49.4 Å²	49.4	21%	0.208	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-31.1	-178.1	-21.5	34.3	0	0	0	114.2	V440 P444 L522 Q526 I530 V531 N532	V440-P528 HydrophobicContact CG1-CB 4Å; P444-P528 HydrophobicContact CB-CG 4.03Å; P444-P528 HydrophobicContact CG-CB 4.03Å; P444-P528 HydrophobicContact CG-CG 3.68Å; L522-P528 HydrophobicContact CD2-CB 4.04Å; L522-P528 HydrophobicContact CD2-CG 4.3Å; Q526-P528 WeakPolarHBondContact O-CD 3.28Å; P528-I530 PolarHBondContact O-N 3.25Å; P528-V531 WeakPolarHBondContact O-CB 3.22Å; P528-V531 PolarHBondContact O-N 3.47Å; P528-N532 PolarHBondContact O-N 2.83Å
529	N	93.2	Very high	93	Very high	118 Å²	118	49.4 Å²	49.4	63%	0.631	27%	0.269	S	S	*	.	H	α-helix	trans	-67.1	-39	-179.1	-70.2	-27.4	0	0	0	111.7	N527 V531 N532 S533	N527-N529 VanDerWaalsContact C-N 3.3Å; N527-N529 PolarHBondContact O-N 3.3Å; N527-N529 WeakPolarHBondContact OD1-CB 3.34Å; N527-N529 PolarHBondContact OD1-N 2.98Å; N529-V531 VanDerWaalsContact C-N 3.32Å; N529-N532 WeakPolarHBondContact O-CB 3.32Å; N529-N532 PolarHBondContact O-N 3.43Å; N529-S533 PolarHBondContact O-N 3.41Å; N529-S533 PolarHBondContact O-OG 3.18Å
530	I	94.8	Very high	92.8	Very high	88 Å²	88	54 Å²	54	45%	0.451	29%	0.292	S	S	.	.	H	α-helix	trans	-64.3	-41.5	175.1	-61.4	-179.7	0	0	0	110	V525 N527 P528 N532 S533 I534	V525-I530 HydrophobicContact CG1-CB 4.19Å; V525-I530 HydrophobicContact CG1-CG2 4.17Å; N527-I530 HydrophobicContact CB-CB 4.41Å; N527-I530 HydrophobicContact CB-CD1 3.93Å; N527-I530 HydrophobicContact CB-CG1 4.06Å; N527-I530 PolarHBondContact O-N 3.4Å; P528-I530 PolarHBondContact O-N 3.25Å; I530-N532 VanDerWaalsContact C-N 3.35Å; I530-N532 PolarHBondContact O-N 3.43Å; I530-S533 PolarHBondContact O-N 3.34Å; I530-I534 HydrophobicContact CG2-CD1 3.73Å; I530-I534 HydrophobicContact CG2-CG1 4.38Å; I530-I534 WeakPolarHBondContact O-CG1 3.36Å; I530-I534 PolarHBondContact O-N 3.49Å
531	V	94.7	Very high	92.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.1	-44.2	177.1	176.8	0	0	0	0	111.4	T518 L521 L522 V525 N527 P528 N529 S533 I534 V535	T518-V531 HydrophobicContact CG2-CG1 3.97Å; L521-V531 HydrophobicContact CB-CB 4.48Å; L521-V531 HydrophobicContact CB-CG1 3.61Å; L521-V531 HydrophobicContact CB-CG2 4.12Å; L521-V531 HydrophobicContact CD2-CG1 4.47Å; L522-V531 HydrophobicContact CD2-CB 4.2Å; L522-V531 HydrophobicContact CD2-CG1 4.4Å; L522-V531 HydrophobicContact CD2-CG2 3.95Å; L522-V531 HydrophobicContact CG-CB 4.49Å; L522-V531 HydrophobicContact CG-CG1 4.16Å; L522-V531 HydrophobicContact CG-CG2 4.34Å; V525-V531 HydrophobicContact CB-CG2 3.65Å; V525-V531 HydrophobicContact CG1-CG2 3.84Å; V525-V531 HydrophobicContact CG2-CG2 4.47Å; N527-V531 PolarHBondContact O-N 3.03Å; P528-V531 WeakPolarHBondContact O-CB 3.22Å; P528-V531 PolarHBondContact O-N 3.47Å; N529-V531 VanDerWaalsContact C-N 3.32Å; V531-S533 VanDerWaalsContact C-N 3.34Å; V531-S533 PolarHBondContact O-N 2.94Å; V531-I534 PolarHBondContact O-N 3.42Å; V531-V535 HydrophobicContact CG1-CG2 3.96Å; V531-V535 WeakPolarHBondContact O-CG2 3.4Å; V531-V535 PolarHBondContact O-N 3.36Å
532	N	94.1	Very high	92.6	Very high	40 Å²	40	55 Å²	55	21%	0.214	30%	0.303	C	S	.	.	H	α-helix	trans	-55.6	-47.7	176.9	-171.4	59.9	0	0	0	111.8	M436 V440 P528 N529 I530 I534 A536	M436-N532 WeakPolarHBondContact CE-OD1 3.43Å; M436-N532 PolarHBondContact SD-OD1 2.96Å; V440-N532 HydrophobicContact CG1-CB 4.41Å; V440-N532 HydrophobicContact CG2-CB 4.24Å; P528-N532 PolarHBondContact O-N 2.83Å; N529-N532 WeakPolarHBondContact O-CB 3.32Å; N529-N532 PolarHBondContact O-N 3.43Å; I530-N532 VanDerWaalsContact C-N 3.35Å; I530-N532 PolarHBondContact O-N 3.43Å; N532-I534 PolarHBondContact O-N 2.95Å; N532-A536 VanDerWaalsContact O-CB 3.28Å; N532-A536 WeakPolarHBondContact O-CB 3.25Å; N532-A536 PolarHBondContact O-N 3.32Å
533	S	95	Very high	92.5	Very high	79 Å²	79	55.2 Å²	55.2	55%	0.552	30%	0.304	S	S	*	.	H	α-helix	trans	-63.2	-42.4	177.5	-59.1	0	0	0	0	112.9	N529 I530 V531 L537	N529-S533 PolarHBondContact O-N 3.41Å; N529-S533 PolarHBondContact O-OG 3.18Å; I530-S533 PolarHBondContact O-N 3.34Å; V531-S533 VanDerWaalsContact C-N 3.34Å; V531-S533 PolarHBondContact O-N 2.94Å; S533-L537 WeakPolarHBondContact O-CB 3.26Å; S533-L537 PolarHBondContact O-N 3.3Å; S533-L537 VanDerWaalsContact O-N 3.11Å
534	I	95.1	Very high	92.6	Very high	63 Å²	63	59 Å²	59	32%	0.323	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-47.1	-179.6	-66.4	168.5	0	0	0	110.9	L521 I530 V531 N532 L537 L538	L521-I534 HydrophobicContact CD2-CB 4Å; L521-I534 HydrophobicContact CD2-CD1 4.41Å; L521-I534 HydrophobicContact CD2-CG2 3.48Å; L521-I534 VanDerWaalsContact CD2-CG2 3.48Å; I530-I534 HydrophobicContact CG2-CD1 3.73Å; I530-I534 HydrophobicContact CG2-CG1 4.38Å; I530-I534 WeakPolarHBondContact O-CG1 3.36Å; I530-I534 PolarHBondContact O-N 3.49Å; V531-I534 PolarHBondContact O-N 3.42Å; N532-I534 PolarHBondContact O-N 2.95Å; I534-L537 PolarHBondContact O-N 3.37Å; I534-L538 HydrophobicContact CG2-CD1 3.79Å; I534-L538 HydrophobicContact CG2-CG 4.28Å; I534-L538 WeakPolarHBondContact O-CB 3.3Å; I534-L538 WeakPolarHBondContact O-CG 3.24Å; I534-L538 PolarHBondContact O-N 2.83Å
535	V	94.5	Very high	92.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.9	-38.3	-177.5	174.8	0	0	0	0	111.3	M436 L517 L521 V531 L538 S539	M436-V535 HydrophobicContact CB-CG1 3.79Å; M436-V535 HydrophobicContact CG-CB 3.9Å; M436-V535 HydrophobicContact CG-CG1 3.7Å; M436-V535 HydrophobicContact SD-CB 3.58Å; M436-V535 VanDerWaalsContact SD-CB 3.58Å; M436-V535 HydrophobicContact SD-CG1 3.67Å; L517-V535 HydrophobicContact CD2-CG1 4.29Å; L517-V535 HydrophobicContact CG-CG2 4.45Å; L521-V535 HydrophobicContact CD1-CG2 4.1Å; L521-V535 HydrophobicContact CD2-CG2 4.19Å; V531-V535 HydrophobicContact CG1-CG2 3.96Å; V531-V535 WeakPolarHBondContact O-CG2 3.4Å; V531-V535 PolarHBondContact O-N 3.36Å; V535-L538 PolarHBondContact O-N 3.35Å; V535-S539 WeakPolarHBondContact O-CB 3.15Å; V535-S539 PolarHBondContact O-N 2.84Å; V535-S539 PolarHBondContact O-OG 3.17Å
536	A	94	Very high	92.5	Very high	16 Å²	16	53.1 Å²	53.1	13%	0.132	29%	0.29	C	S	.	.	H	α-helix	trans	-59.4	-46.5	172.8	0	0	0	0	0	111.5	Y433 M436 N532 S539 I540	Y433-A536 HydrophobicContact CD2-CB 4.11Å; Y433-A536 HydrophobicContact CE2-CB 3.76Å; M436-A536 HydrophobicContact CE-CB 4.4Å; M436-A536 HydrophobicContact SD-CB 4.24Å; N532-A536 VanDerWaalsContact O-CB 3.28Å; N532-A536 WeakPolarHBondContact O-CB 3.25Å; N532-A536 PolarHBondContact O-N 3.32Å; A536-S539 PolarHBondContact O-N 3.06Å; A536-I540 WeakPolarHBondContact O-CG1 3.5Å; A536-I540 PolarHBondContact O-N 3.15Å
537	L	94.7	Very high	92.5	Very high	122 Å²	122	46.8 Å²	46.8	64%	0.639	26%	0.261	S	S	*	.	H	α-helix	trans	-63	-44.7	177.6	-175.9	64.6	0	0	0	112	S533 I534 S539 S541	S533-L537 WeakPolarHBondContact O-CB 3.26Å; S533-L537 PolarHBondContact O-N 3.3Å; S533-L537 VanDerWaalsContact O-N 3.11Å; I534-L537 PolarHBondContact O-N 3.37Å; L537-S539 VanDerWaalsContact C-N 3.34Å; L537-S539 PolarHBondContact O-N 3.24Å; L537-S541 WeakPolarHBondContact O-CB 3.25Å; L537-S541 PolarHBondContact O-N 3.19Å; L537-S541 PolarHBondContact O-OG 3.27Å
538	L	93.1	Very high	92.1	Very high	83 Å²	83	43.4 Å²	43.4	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-41	176.9	-74.1	170.6	0	0	0	112	L517 I534 V535 S541 G542	L517-L538 HydrophobicContact CD2-CD1 4.36Å; I534-L538 HydrophobicContact CG2-CD1 3.79Å; I534-L538 HydrophobicContact CG2-CG 4.28Å; I534-L538 WeakPolarHBondContact O-CB 3.3Å; I534-L538 WeakPolarHBondContact O-CG 3.24Å; I534-L538 PolarHBondContact O-N 2.83Å; V535-L538 PolarHBondContact O-N 3.35Å; L538-S541 PolarHBondContact O-OG 3Å; L538-G542 PolarHBondContact O-N 3.38Å
539	S	91.4	Very high	91.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-67.1	-44.1	-178.8	-58	0	0	0	0	111.8	V535 A536 L537 L543 Q569	V535-S539 WeakPolarHBondContact O-CB 3.15Å; V535-S539 PolarHBondContact O-N 2.84Å; V535-S539 PolarHBondContact O-OG 3.17Å; A536-S539 PolarHBondContact O-N 3.06Å; L537-S539 VanDerWaalsContact C-N 3.34Å; L537-S539 PolarHBondContact O-N 3.24Å; S539-L543 PolarHBondContact O-N 2.96Å; S539-Q569 PolarHBondContact O-NE2 3.5Å
540	I	91.8	Very high	91.4	Very high	100 Å²	100	42.6 Å²	42.6	51%	0.513	24%	0.235	S	C	.	.	H	α-helix	trans	-74.9	-45	-179.4	-64.2	168.8	0	0	0	111.4	A536 G542 L543 L544	A536-I540 WeakPolarHBondContact O-CG1 3.5Å; A536-I540 PolarHBondContact O-N 3.15Å; I540-G542 VanDerWaalsContact C-N 3.35Å; I540-G542 PolarHBondContact O-N 3.39Å; I540-L543 WeakPolarHBondContact O-CB 3.46Å; I540-L543 PolarHBondContact O-N 2.98Å; I540-L544 PolarHBondContact O-N 3.27Å; I540-L544 VanDerWaalsContact O-N 3.07Å
541	S	91.9	Very high	90.8	Very high	45 Å²	45	44 Å²	44	32%	0.315	24%	0.235	S	C	.	.	H	α-helix	trans	-64.5	-39.5	178.1	59	0	0	0	0	112.1	L537 L538 L543 L544 I545	L537-S541 WeakPolarHBondContact O-CB 3.25Å; L537-S541 PolarHBondContact O-N 3.19Å; L537-S541 PolarHBondContact O-OG 3.27Å; L538-S541 PolarHBondContact O-OG 3Å; S541-L543 VanDerWaalsContact C-N 3.29Å; S541-L543 PolarHBondContact O-N 2.89Å; S541-L544 PolarHBondContact O-N 3.43Å; S541-I545 WeakPolarHBondContact O-CG1 3.49Å; S541-I545 PolarHBondContact O-N 3.27Å
542	G	91.9	Very high	90.3	Very high	6 Å²	6	45.1 Å²	45.1	6%	0.062	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-35.2	174	0	0	0	0	0	112.6	L538 I540 G546	L538-G542 PolarHBondContact O-N 3.38Å; I540-G542 VanDerWaalsContact C-N 3.35Å; I540-G542 PolarHBondContact O-N 3.39Å; G542-G546 WeakPolarHBondContact O-CA 3.22Å; G542-G546 PolarHBondContact O-N 3.43Å
543	L	92.3	Very high	89.7	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-68.2	-43.5	175.6	-178.8	70.5	0	0	0	112.5	Y425 V428 S539 I540 S541 I545 S547 Q569	Y425-L543 HydrophobicContact CD1-CD2 3.77Å; Y425-L543 HydrophobicContact CD2-CD1 4.07Å; Y425-L543 HydrophobicContact CD2-CD2 3.87Å; Y425-L543 HydrophobicContact CD2-CG 3.83Å; Y425-L543 HydrophobicContact CE1-CD2 3.43Å; Y425-L543 VanDerWaalsContact CE1-CD2 3.43Å; Y425-L543 HydrophobicContact CE1-CG 4.24Å; Y425-L543 HydrophobicContact CE2-CD1 4.14Å; Y425-L543 HydrophobicContact CE2-CD2 3.57Å; Y425-L543 HydrophobicContact CE2-CG 3.42Å; Y425-L543 VanDerWaalsContact CE2-CG 3.42Å; Y425-L543 HydrophobicContact CG-CD2 3.97Å; Y425-L543 HydrophobicContact CG-CG 4.41Å; Y425-L543 WeakPolarHBondContact O-CD2 3.22Å; V428-L543 HydrophobicContact CB-CD1 3.89Å; V428-L543 HydrophobicContact CG1-CD1 3.76Å; S539-L543 PolarHBondContact O-N 2.96Å; I540-L543 WeakPolarHBondContact O-CB 3.46Å; I540-L543 PolarHBondContact O-N 2.98Å; S541-L543 VanDerWaalsContact C-N 3.29Å; S541-L543 PolarHBondContact O-N 2.89Å; L543-I545 VanDerWaalsContact C-N 3.25Å; L543-I545 PolarHBondContact O-N 2.66Å; L543-S547 WeakPolarHBondContact O-CB 3.13Å; L543-S547 PolarHBondContact O-N 2.97Å; L543-S547 PolarHBondContact O-OG 2.66Å; L543-Q569 HydrophobicContact CB-CG 4.17Å; L543-Q569 HydrophobicContact CD1-CB 4.39Å; L543-Q569 HydrophobicContact CD1-CG 4.39Å
544	L	91.4	Very high	89	Confident	84 Å²	84	45.5 Å²	45.5	44%	0.44	23%	0.233	S	C	.	.	H	α-helix	trans	-58.3	-39.8	179.4	-179.7	63.9	0	0	0	111.8	I540 S541 I550	I540-L544 PolarHBondContact O-N 3.27Å; I540-L544 VanDerWaalsContact O-N 3.07Å; S541-L544 PolarHBondContact O-N 3.43Å; L544-I550 HydrophobicContact CD1-CB 4.16Å; L544-I550 HydrophobicContact CD1-CD1 3.42Å; L544-I550 VanDerWaalsContact CD1-CD1 3.42Å; L544-I550 HydrophobicContact CD1-CG1 4.37Å; L544-I550 HydrophobicContact CD1-CG2 3.92Å
545	I	90.9	Very high	88.6	Confident	26 Å²	26	48.7 Å²	48.7	13%	0.133	25%	0.246	C	C	.	.	H	α-helix	trans	-89.8	-36.4	-175.9	-57.6	168.4	0	0	0	111.3	S541 L543 M556 L560 L563	S541-I545 WeakPolarHBondContact O-CG1 3.49Å; S541-I545 PolarHBondContact O-N 3.27Å; L543-I545 VanDerWaalsContact C-N 3.25Å; L543-I545 PolarHBondContact O-N 2.66Å; I545-M556 HydrophobicContact CG2-SD 4.3Å; I545-M556 WeakPolarHBondContact O-CE 3.32Å; I545-L560 HydrophobicContact CD1-CD2 4.13Å; I545-L560 HydrophobicContact CG2-CB 4.36Å; I545-L560 WeakPolarHBondContact CG2-O 3.45Å; I545-L563 HydrophobicContact CD1-CD2 3.36Å; I545-L563 HydrophobicContact CG2-CB 4.4Å; I545-L563 HydrophobicContact CG2-CD2 4.2Å
546	G	87.2	Confident	88.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-87.2	-31.5	-171.8	0	0	0	0	0	115.5	G542 G548 I553 T567 K570	G542-G546 WeakPolarHBondContact O-CA 3.22Å; G542-G546 PolarHBondContact O-N 3.43Å; G546-G548 VanDerWaalsContact C-N 3.34Å; G546-G548 PolarHBondContact O-N 2.63Å; G546-I553 WeakPolarHBondContact O-CD1 3.16Å; G546-T567 WeakPolarHBondContact CA-OG1 3.35Å; G546-K570 WeakPolarHBondContact O-CA 3.29Å; G546-K570 VanDerWaalsContact O-CB 3.26Å; G546-K570 WeakPolarHBondContact O-CB 3.37Å
547	S	86.6	Confident	88	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.007	26%	0.261	C	S	.	.	S	Bend	trans	-66.7	-30.2	-168.8	57.7	0	0	0	0	114.9	L543 F549 C573	L543-S547 WeakPolarHBondContact O-CB 3.13Å; L543-S547 PolarHBondContact O-N 2.97Å; L543-S547 PolarHBondContact O-OG 2.66Å; S547-F549 PolarHBondContact O-N 2.62Å; S547-F549 PolarHBondContact OG-N 3.19Å; S547-C573 VanDerWaalsContact CB-SG 3.58Å
548	G	83.4	Confident	87.9	Confident	3 Å²	3	51.5 Å²	51.5	3%	0.031	26%	0.261	C	S	.	.	S	Bend	trans	73.4	-2.3	-170.7	0	0	0	0	0	115	G546 R551	G546-G548 VanDerWaalsContact C-N 3.34Å; G546-G548 PolarHBondContact O-N 2.63Å; G548-R551 CarbonylContact C-O 3.54Å; G548-R551 WeakPolarHBondContact CA-O 3.49Å
549	F	84.6	Confident	87.8	Confident	31 Å²	31	52 Å²	52	14%	0.136	27%	0.269	C	S	.	.	S	Bend	trans	-80.9	-46.7	-175.9	-64.6	-31.3	0	0	0	113.6	V421 L424 Y425 S547 C573 V577	V421-F549 HydrophobicContact CG1-CB 3.73Å; V421-F549 HydrophobicContact CG1-CD1 3.87Å; V421-F549 HydrophobicContact CG1-CD2 4.06Å; V421-F549 HydrophobicContact CG1-CE1 4.46Å; V421-F549 HydrophobicContact CG1-CG 3.64Å; L424-F549 HydrophobicContact CB-CE2 3.92Å; L424-F549 HydrophobicContact CB-CZ 4.1Å; L424-F549 HydrophobicContact CD1-CZ 4.35Å; Y425-F549 HydrophobicContact CD2-CB 4.31Å; Y425-F549 AromaticContact CD2-CD2 3.95Å; Y425-F549 HydrophobicContact CD2-CD2 3.95Å; Y425-F549 HydrophobicContact CG-CD2 4.43Å; S547-F549 PolarHBondContact O-N 2.62Å; S547-F549 PolarHBondContact OG-N 3.19Å; F549-C573 HydrophobicContact CE2-CB 4.31Å; F549-C573 HydrophobicContact CZ-CB 4.24Å; F549-V577 HydrophobicContact CE1-CG2 3.29Å; F549-V577 HydrophobicContact CZ-CG2 3.31Å
550	I	85.2	Confident	87.7	Confident	103 Å²	103	55.2 Å²	55.2	53%	0.528	29%	0.286	S	S	.	.	S	Bend	trans	-76	-40.4	-179.7	-67.7	174.7	0	0	0	110.5	Y425 L544	Y425-I550 HydrophobicContact CD2-CD1 4.49Å; Y425-I550 HydrophobicContact CE1-CD1 4.35Å; Y425-I550 HydrophobicContact CE2-CD1 3.51Å; Y425-I550 HydrophobicContact CE2-CG1 3.96Å; Y425-I550 VanDerWaalsContact CZ-CD1 3.44Å; Y425-I550 VanDerWaalsContact OH-CD1 3.23Å; Y425-I550 WeakPolarHBondContact OH-CD1 3.29Å; L544-I550 HydrophobicContact CD1-CB 4.16Å; L544-I550 HydrophobicContact CD1-CD1 3.42Å; L544-I550 VanDerWaalsContact CD1-CD1 3.42Å; L544-I550 HydrophobicContact CD1-CG1 4.37Å; L544-I550 HydrophobicContact CD1-CG2 3.92Å
551	R	83.8	Confident	87.6	Confident	116 Å²	116	53.5 Å²	53.5	44%	0.438	28%	0.275	S	S	.	.	S	Bend	trans	-138.3	131.3	176.4	-178.8	175.6	-175.8	165.8	8.3	108.5	G548 I553 E555 M556	G548-R551 CarbonylContact C-O 3.54Å; G548-R551 WeakPolarHBondContact CA-O 3.49Å; R551-I553 PolarHBondContact O-N 3.3Å; R551-E555 PolarHBondContact NE-O 3.34Å; R551-E555 PolarHBondContact NH2-O 3.32Å; R551-M556 HydrophobicContact CB-CE 3.87Å; R551-M556 HydrophobicContact CG-CE 4.18Å; R551-M556 HydrophobicContact CG-CG 3.84Å; R551-M556 WeakPolarHBondContact O-CE 3.25Å
552	N	83.3	Confident	87.6	Confident	25 Å²	25	55.9 Å²	55.9	13%	0.134	28%	0.283	C	S	.	.			trans	-61.9	129.5	179.5	-168.7	0.2	0	0	0	109.9	Q554 E555 M556 K612 T613	N552-Q554 PolarHBondContact O-N 3.49Å; N552-E555 HydrophobicContact CB-CB 4.24Å; N552-E555 HydrophobicContact CB-CG 4.14Å; N552-E555 PolarHBondContact ND2-OE1 2.97Å; N552-E555 VanDerWaalsContact ND2-OE1 3.17Å; N552-E555 PolarHBondContact O-N 2.87Å; N552-M556 WeakPolarHBondContact O-CG 3.49Å; N552-M556 PolarHBondContact O-N 3.48Å; N552-K612 PolarHBondContact ND2-O 2.87Å; N552-T613 PolarHBondContact OD1-O 3.18Å
553	I	80.4	Confident	87.5	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.041	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-60	-34.7	-172.9	-61.2	177.4	0	0	0	110.8	G546 R551 E555 M556 K561 K570	G546-I553 WeakPolarHBondContact O-CD1 3.16Å; R551-I553 PolarHBondContact O-N 3.3Å; I553-E555 VanDerWaalsContact C-N 3.33Å; I553-E555 PolarHBondContact O-N 3.38Å; I553-M556 HydrophobicContact CG1-CE 4.44Å; I553-M556 PolarHBondContact O-N 3.39Å; I553-K561 HydrophobicContact CG2-CG 4.44Å; I553-K561 WeakPolarHBondContact O-CE 3.47Å; I553-K570 HydrophobicContact CD1-CD 4.3Å; I553-K570 HydrophobicContact CD1-CG 4.08Å
554	Q	82	Confident	87.3	Confident	118 Å²	118	59.6 Å²	59.6	55%	0.551	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-68.7	-31.7	179.5	-65	-166.8	-30.2	0	0	113.1	N552 M556 K561 P615	N552-Q554 PolarHBondContact O-N 3.49Å; Q554-M556 VanDerWaalsContact C-N 3.33Å; Q554-K561 WeakPolarHBondContact O-CE 3.22Å; Q554-K561 PolarHBondContact O-NZ 3.23Å; Q554-P615 VanDerWaalsContact CD-CG 3.43Å; Q554-P615 HydrophobicContact CG-CG 4.28Å
555	E	85.6	Confident	87.2	Confident	131 Å²	131	60.5 Å²	60.5	61%	0.612	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-89	0.8	-179.2	-63.3	167.8	-152.1	0	0	112.8	R551 N552 I553	R551-E555 PolarHBondContact NE-O 3.34Å; R551-E555 PolarHBondContact NH2-O 3.32Å; N552-E555 HydrophobicContact CB-CB 4.24Å; N552-E555 HydrophobicContact CB-CG 4.14Å; N552-E555 PolarHBondContact ND2-OE1 2.97Å; N552-E555 VanDerWaalsContact ND2-OE1 3.17Å; N552-E555 PolarHBondContact O-N 2.87Å; I553-E555 VanDerWaalsContact C-N 3.33Å; I553-E555 PolarHBondContact O-N 3.38Å
556	M	86.8	Confident	87.3	Confident	12 Å²	12	66.6 Å²	66.6	6%	0.059	33%	0.326	C	S	.	.	S	Bend	trans	-74.8	147.3	174.4	-64.7	-158.5	-166	0	0	111.9	I545 R551 N552 I553 Q554 L560 K561	I545-M556 HydrophobicContact CG2-SD 4.3Å; I545-M556 WeakPolarHBondContact O-CE 3.32Å; R551-M556 HydrophobicContact CB-CE 3.87Å; R551-M556 HydrophobicContact CG-CE 4.18Å; R551-M556 HydrophobicContact CG-CG 3.84Å; R551-M556 WeakPolarHBondContact O-CE 3.25Å; N552-M556 WeakPolarHBondContact O-CG 3.49Å; N552-M556 PolarHBondContact O-N 3.48Å; I553-M556 HydrophobicContact CG1-CE 4.44Å; I553-M556 PolarHBondContact O-N 3.39Å; Q554-M556 VanDerWaalsContact C-N 3.33Å; M556-L560 HydrophobicContact CB-CB 4.48Å; M556-L560 HydrophobicContact SD-CB 4.36Å; M556-K561 HydrophobicContact CB-CB 4.35Å; M556-K561 WeakPolarHBondContact O-CE 3.47Å
557	P	90.7	Very high	87.6	Confident	57 Å²	57	67.3 Å²	67.3	37%	0.37	33%	0.33	S	S	.	.			trans	-58.1	149.1	169.8	-18.1	33	0	0	0	110.1	P559 L560 K561	P557-P559 VanDerWaalsContact C-CD 3.46Å; P557-L560 HydrophobicContact CG-CD1 4.44Å; P557-L560 PolarHBondContact O-N 2.91Å; P557-L560 VanDerWaalsContact O-N 3.13Å; P557-K561 PolarHBondContact O-N 3.36Å
558	I	90.9	Very high	88	Confident	128 Å²	128	68.1 Å²	68.1	66%	0.656	33%	0.333	S	S	*	.	H	α-helix	trans	-46.6	-48.6	-174.3	-57.3	165.6	0	0	0	114	L560 K561 I562	I558-L560 PolarHBondContact O-N 3.14Å; I558-K561 WeakPolarHBondContact O-CB 3.27Å; I558-K561 PolarHBondContact O-N 3.21Å; I558-I562 HydrophobicContact CG2-CD1 4.06Å; I558-I562 WeakPolarHBondContact O-CG1 3.39Å; I558-I562 PolarHBondContact O-N 3.38Å
559	P	91.6	Very high	88.5	Confident	92 Å²	92	68.1 Å²	68.1	60%	0.597	33%	0.333	S	S	*	.	H	α-helix	trans	-66.1	-41.2	-177.2	24.9	-34.7	0	0	0	113	P557 K561 I562 L563	P557-P559 VanDerWaalsContact C-CD 3.46Å; P559-K561 VanDerWaalsContact C-N 3.33Å; P559-I562 PolarHBondContact O-N 3.19Å; P559-L563 PolarHBondContact O-N 3.42Å
560	L	90.4	Very high	88.9	Confident	69 Å²	69	66.9 Å²	66.9	36%	0.361	33%	0.327	S	S	.	.	H	α-helix	trans	-69.4	-35.3	178	-65.3	178.9	0	0	0	111.3	I545 M556 P557 I558 L563 G564	I545-L560 HydrophobicContact CD1-CD2 4.13Å; I545-L560 HydrophobicContact CG2-CB 4.36Å; I545-L560 WeakPolarHBondContact CG2-O 3.45Å; M556-L560 HydrophobicContact CB-CB 4.48Å; M556-L560 HydrophobicContact SD-CB 4.36Å; P557-L560 HydrophobicContact CG-CD1 4.44Å; P557-L560 PolarHBondContact O-N 2.91Å; P557-L560 VanDerWaalsContact O-N 3.13Å; I558-L560 PolarHBondContact O-N 3.14Å; L560-L563 PolarHBondContact O-N 3.45Å; L560-G564 PolarHBondContact O-N 2.89Å
561	K	88.7	Confident	89.3	Confident	65 Å²	65	63.4 Å²	63.4	28%	0.283	31%	0.307	S	S	.	.	H	α-helix	trans	-58.7	-49	173.2	-175.4	179	-66.3	179.7	0	110.9	I553 Q554 M556 P557 I558 P559 G564 Y565	I553-K561 HydrophobicContact CG2-CG 4.44Å; I553-K561 WeakPolarHBondContact O-CE 3.47Å; Q554-K561 WeakPolarHBondContact O-CE 3.22Å; Q554-K561 PolarHBondContact O-NZ 3.23Å; M556-K561 HydrophobicContact CB-CB 4.35Å; M556-K561 WeakPolarHBondContact O-CE 3.47Å; P557-K561 PolarHBondContact O-N 3.36Å; I558-K561 WeakPolarHBondContact O-CB 3.27Å; I558-K561 PolarHBondContact O-N 3.21Å; P559-K561 VanDerWaalsContact C-N 3.33Å; K561-G564 PolarHBondContact O-N 3.24Å; K561-Y565 HydrophobicContact CG-CE2 4.02Å; K561-Y565 WeakPolarHBondContact O-CD2 3.43Å; K561-Y565 PolarHBondContact O-N 3.35Å
562	I	91.6	Very high	89.9	Confident	94 Å²	94	57.9 Å²	57.9	48%	0.482	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-47.2	176.6	-65.7	166.7	0	0	0	110.7	I558 P559 G564 Y565 F566	I558-I562 HydrophobicContact CG2-CD1 4.06Å; I558-I562 WeakPolarHBondContact O-CG1 3.39Å; I558-I562 PolarHBondContact O-N 3.38Å; P559-I562 PolarHBondContact O-N 3.19Å; I562-G564 VanDerWaalsContact C-N 3.26Å; I562-G564 PolarHBondContact O-N 3.22Å; I562-Y565 PolarHBondContact O-N 3.09Å; I562-Y565 VanDerWaalsContact O-N 3.1Å; I562-F566 HydrophobicContact CG2-CD2 4.36Å; I562-F566 HydrophobicContact CG2-CE2 3.88Å
563	L	90.1	Very high	90.4	Very high	87 Å²	87	56.7 Å²	56.7	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-58.7	-40.3	178.6	-162.1	96.6	0	0	0	111.5	I545 P559 L560 Y565 F566	I545-L563 HydrophobicContact CD1-CD2 3.36Å; I545-L563 HydrophobicContact CG2-CB 4.4Å; I545-L563 HydrophobicContact CG2-CD2 4.2Å; P559-L563 PolarHBondContact O-N 3.42Å; L560-L563 PolarHBondContact O-N 3.45Å; L563-Y565 VanDerWaalsContact C-N 3.28Å; L563-Y565 PolarHBondContact O-N 3.08Å; L563-F566 PolarHBondContact O-N 3.41Å
564	G	87.9	Confident	91	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-36.8	176.4	0	0	0	0	0	113.3	L560 K561 I562 F566 T567 K570	L560-G564 PolarHBondContact O-N 2.89Å; K561-G564 PolarHBondContact O-N 3.24Å; I562-G564 VanDerWaalsContact C-N 3.26Å; I562-G564 PolarHBondContact O-N 3.22Å; G564-F566 VanDerWaalsContact C-N 3.28Å; G564-F566 PolarHBondContact O-N 3.06Å; G564-T567 PolarHBondContact O-N 2.89Å; G564-T567 PolarHBondContact O-OG1 3.14Å; G564-K570 WeakPolarHBondContact O-CB 3.14Å; G564-K570 WeakPolarHBondContact O-CD 3.38Å
565	Y	90.3	Very high	91.6	Very high	104 Å²	104	50.8 Å²	50.8	41%	0.408	25%	0.252	S	S	.	.	H	α-helix	trans	-67.9	-23	175.1	-76.1	-84.4	0	0	0	113.7	K561 I562 L563 T567 K570 Y571	K561-Y565 HydrophobicContact CG-CE2 4.02Å; K561-Y565 WeakPolarHBondContact O-CD2 3.43Å; K561-Y565 PolarHBondContact O-N 3.35Å; I562-Y565 PolarHBondContact O-N 3.09Å; I562-Y565 VanDerWaalsContact O-N 3.1Å; L563-Y565 VanDerWaalsContact C-N 3.28Å; L563-Y565 PolarHBondContact O-N 3.08Å; Y565-T567 VanDerWaalsContact C-N 3.35Å; Y565-K570 HydrophobicContact CD1-CD 4.13Å; Y565-K570 VanDerWaalsContact CD1-CE 3.42Å; Y565-K570 VanDerWaalsContact CE1-CE 3.42Å; Y565-K570 HydrophobicContact CG-CD 4.43Å; Y565-Y571 VanDerWaalsContact O-CE2 3.3Å; Y565-Y571 WeakPolarHBondContact O-CE2 3.27Å; Y565-Y571 PolarHBondContact O-OH 3.42Å
566	F	92.4	Very high	92	Very high	154 Å²	154	44.6 Å²	44.6	68%	0.675	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.3	175.9	-70.1	-54.1	0	0	0	114.1	I562 L563 G564 F631	I562-F566 HydrophobicContact CG2-CD2 4.36Å; I562-F566 HydrophobicContact CG2-CE2 3.88Å; L563-F566 PolarHBondContact O-N 3.41Å; G564-F566 VanDerWaalsContact C-N 3.28Å; G564-F566 PolarHBondContact O-N 3.06Å; F566-F631 WeakPolarHBondContact O-CZ 3.41Å
567	T	93.3	Very high	92.3	Very high	15 Å²	15	44 Å²	44	9%	0.092	22%	0.221	C	C	.	.			trans	-87.7	135.2	-178.1	64.3	0	0	0	0	111.7	G546 G564 Y565 Q569 K570 Y571	G546-T567 WeakPolarHBondContact CA-OG1 3.35Å; G564-T567 PolarHBondContact O-N 2.89Å; G564-T567 PolarHBondContact O-OG1 3.14Å; Y565-T567 VanDerWaalsContact C-N 3.35Å; T567-Q569 PolarHBondContact O-N 3.38Å; T567-K570 PolarHBondContact O-N 3.35Å; T567-Y571 VanDerWaalsContact O-CD2 3.28Å; T567-Y571 WeakPolarHBondContact O-CD2 3.34Å
568	F	94.5	Very high	92.4	Very high	17 Å²	17	41.8 Å²	41.8	8%	0.075	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-26.8	171.9	64.7	-93.4	0	0	0	111.7	P432 P510 I513 K570 Y571 C572 L628 F631	P432-F568 HydrophobicContact CB-CE2 4.4Å; P432-F568 HydrophobicContact CB-CZ 4.1Å; P432-F568 HydrophobicContact CG-CE2 4.34Å; P432-F568 HydrophobicContact CG-CZ 4.25Å; P510-F568 HydrophobicContact CB-CD2 4.45Å; P510-F568 HydrophobicContact CB-CE2 4.11Å; I513-F568 HydrophobicContact CD1-CB 3.74Å; I513-F568 HydrophobicContact CD1-CD1 4.45Å; I513-F568 HydrophobicContact CD1-CD2 4.01Å; I513-F568 HydrophobicContact CD1-CG 3.82Å; I513-F568 HydrophobicContact CG2-CD1 3.59Å; I513-F568 HydrophobicContact CG2-CD2 4.31Å; I513-F568 HydrophobicContact CG2-CE1 3.54Å; I513-F568 HydrophobicContact CG2-CE2 4.29Å; I513-F568 HydrophobicContact CG2-CG 3.98Å; I513-F568 HydrophobicContact CG2-CZ 3.91Å; F568-K570 VanDerWaalsContact C-N 3.3Å; F568-K570 PolarHBondContact O-N 3Å; F568-Y571 PolarHBondContact O-N 3.47Å; F568-C572 PolarHBondContact O-N 3.28Å; F568-L628 HydrophobicContact CB-CD1 4.15Å; F568-F631 HydrophobicContact CB-CD2 3.88Å; F568-F631 HydrophobicContact CB-CE2 4.02Å; F568-F631 HydrophobicContact CB-CG 4.18Å; F568-F631 HydrophobicContact CB-CZ 4.42Å
569	Q	94.4	Very high	92.6	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.019	18%	0.177	C	C	.	.	H	α-helix	trans	-58.5	-40.2	179.1	-67.1	91	-28.8	0	0	111.6	V428 S539 L543 T567 C572 C573	V428-Q569 HydrophobicContact CG1-CB 4.04Å; V428-Q569 HydrophobicContact CG1-CG 3.98Å; S539-Q569 PolarHBondContact O-NE2 3.5Å; L543-Q569 HydrophobicContact CB-CG 4.17Å; L543-Q569 HydrophobicContact CD1-CB 4.39Å; L543-Q569 HydrophobicContact CD1-CG 4.39Å; T567-Q569 PolarHBondContact O-N 3.38Å; Q569-C572 PolarHBondContact O-N 2.97Å; Q569-C573 WeakPolarHBondContact O-CB 3.43Å; Q569-C573 PolarHBondContact O-N 3.3Å; Q569-C573 PolarHBondContact O-SG 3.41Å
570	K	93.1	Very high	92.6	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-55.8	-55	175.9	175.8	-177	171.5	57.9	0	112.2	G546 I553 G564 Y565 T567 F568 C572 C573 E574	G546-K570 WeakPolarHBondContact O-CA 3.29Å; G546-K570 VanDerWaalsContact O-CB 3.26Å; G546-K570 WeakPolarHBondContact O-CB 3.37Å; I553-K570 HydrophobicContact CD1-CD 4.3Å; I553-K570 HydrophobicContact CD1-CG 4.08Å; G564-K570 WeakPolarHBondContact O-CB 3.14Å; G564-K570 WeakPolarHBondContact O-CD 3.38Å; Y565-K570 HydrophobicContact CD1-CD 4.13Å; Y565-K570 VanDerWaalsContact CD1-CE 3.42Å; Y565-K570 VanDerWaalsContact CE1-CE 3.42Å; Y565-K570 HydrophobicContact CG-CD 4.43Å; T567-K570 PolarHBondContact O-N 3.35Å; F568-K570 VanDerWaalsContact C-N 3.3Å; F568-K570 PolarHBondContact O-N 3Å; K570-C572 VanDerWaalsContact C-N 3.31Å; K570-C572 PolarHBondContact O-N 3.41Å; K570-C573 PolarHBondContact O-N 3.1Å; K570-E574 WeakPolarHBondContact CE-OE1 3.44Å; K570-E574 IonicContact NZ-OE1 3.82Å; K570-E574 PolarHBondContact NZ-OE1 3.23Å; K570-E574 WeakPolarHBondContact O-CG 3.29Å; K570-E574 PolarHBondContact O-N 3.37Å
571	Y	94.1	Very high	92.6	Very high	30 Å²	30	28.6 Å²	28.6	12%	0.118	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-38.1	-176.4	-58.8	-75.7	0	0	0	111.4	Y565 T567 F568 I575 N624 I627 F631	Y565-Y571 VanDerWaalsContact O-CE2 3.3Å; Y565-Y571 WeakPolarHBondContact O-CE2 3.27Å; Y565-Y571 PolarHBondContact O-OH 3.42Å; T567-Y571 VanDerWaalsContact O-CD2 3.28Å; T567-Y571 WeakPolarHBondContact O-CD2 3.34Å; F568-Y571 PolarHBondContact O-N 3.47Å; Y571-I575 VanDerWaalsContact O-CD1 3.31Å; Y571-I575 WeakPolarHBondContact O-CD1 3.34Å; Y571-I575 WeakPolarHBondContact O-CG1 3.46Å; Y571-I575 PolarHBondContact O-N 2.96Å; Y571-I575 VanDerWaalsContact O-N 3.15Å; Y571-N624 WeakPolarHBondContact CD1-OD1 3.28Å; Y571-I627 HydrophobicContact CD1-CB 4.09Å; Y571-I627 HydrophobicContact CD1-CD1 4.08Å; Y571-I627 HydrophobicContact CD1-CG2 3.88Å; Y571-I627 HydrophobicContact CD2-CG2 3.7Å; Y571-I627 HydrophobicContact CE1-CB 4.2Å; Y571-I627 HydrophobicContact CE1-CD1 3.6Å; Y571-I627 HydrophobicContact CE1-CG1 4.49Å; Y571-I627 HydrophobicContact CE1-CG2 3.75Å; Y571-I627 HydrophobicContact CE2-CG2 3.58Å; Y571-I627 HydrophobicContact CG-CB 4.3Å; Y571-I627 HydrophobicContact CG-CG2 3.85Å; Y571-F631 HydrophobicContact CD2-CE2 4.06Å; Y571-F631 HydrophobicContact CE2-CE2 4.21Å; Y571-F631 HydrophobicContact CE2-CZ 4.48Å
572	C	95.1	Very high	92.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-47.3	174.4	-173	0	0	0	0	112.3	V428 A506 P510 F568 Q569 K570 I575 L576 L628	V428-C572 HydrophobicContact CG1-CB 4.26Å; V428-C572 HydrophobicContact CG2-CB 4.45Å; A506-C572 PolarHBondContact O-SG 3.04Å; P510-C572 HydrophobicContact CG-CB 4.19Å; P510-C572 VanDerWaalsContact CG-SG 3.51Å; F568-C572 PolarHBondContact O-N 3.28Å; Q569-C572 PolarHBondContact O-N 2.97Å; K570-C572 VanDerWaalsContact C-N 3.31Å; K570-C572 PolarHBondContact O-N 3.41Å; C572-I575 PolarHBondContact O-N 3.01Å; C572-L576 WeakPolarHBondContact O-CG 3.27Å; C572-L576 PolarHBondContact O-N 3.03Å; C572-L628 HydrophobicContact CB-CD1 4.02Å; C572-L628 HydrophobicContact CB-CD2 4.05Å
573	C	93.7	Very high	92.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.7	-45.7	177.3	-72.7	0	0	0	0	111.8	S547 F549 Q569 K570 I575 L576 V577	S547-C573 VanDerWaalsContact CB-SG 3.58Å; F549-C573 HydrophobicContact CE2-CB 4.31Å; F549-C573 HydrophobicContact CZ-CB 4.24Å; Q569-C573 WeakPolarHBondContact O-CB 3.43Å; Q569-C573 PolarHBondContact O-N 3.3Å; Q569-C573 PolarHBondContact O-SG 3.41Å; K570-C573 PolarHBondContact O-N 3.1Å; C573-I575 VanDerWaalsContact C-N 3.3Å; C573-I575 PolarHBondContact O-N 3.39Å; C573-L576 PolarHBondContact O-N 2.89Å; C573-V577 WeakPolarHBondContact O-CB 3.24Å; C573-V577 WeakPolarHBondContact O-CG2 3.47Å; C573-V577 PolarHBondContact O-N 3.3Å
574	E	93	Very high	92.2	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-58.7	-41.1	177	-73.6	-174.8	-175.5	0	0	111.9	K570 V578 C614 A617 R620 N624	K570-E574 WeakPolarHBondContact CE-OE1 3.44Å; K570-E574 IonicContact NZ-OE1 3.82Å; K570-E574 PolarHBondContact NZ-OE1 3.23Å; K570-E574 WeakPolarHBondContact O-CG 3.29Å; K570-E574 PolarHBondContact O-N 3.37Å; E574-V578 VanDerWaalsContact O-CG2 3.27Å; E574-V578 WeakPolarHBondContact O-CG2 3.24Å; E574-V578 PolarHBondContact O-N 2.97Å; E574-V578 VanDerWaalsContact O-N 3.1Å; E574-C614 HydrophobicContact CG-CB 3.98Å; E574-A617 HydrophobicContact CB-CB 4.11Å; E574-A617 HydrophobicContact CG-CB 4.24Å; E574-R620 IonicContact OE1-NH1 2.92Å; E574-R620 IonicContact OE1-NH2 3.88Å; E574-R620 IonicContact OE2-CZ 3.03Å; E574-R620 IonicContact OE2-NH1 3.55Å; E574-R620 PolarHBondContact OE2-NH1 3.02Å; E574-R620 IonicContact OE2-NH2 2.69Å; E574-N624 WeakPolarHBondContact CB-ND2 3.21Å; E574-N624 PolarHBondContact OE2-ND2 3.31Å
575	I	94.6	Very high	92.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-51.3	174.5	-69.5	161.8	0	0	0	110.8	A506 Y571 C572 C573 V577 V578 N579 F621 N624 F625 L628	A506-I575 HydrophobicContact CB-CG2 3.81Å; Y571-I575 VanDerWaalsContact O-CD1 3.31Å; Y571-I575 WeakPolarHBondContact O-CD1 3.34Å; Y571-I575 WeakPolarHBondContact O-CG1 3.46Å; Y571-I575 PolarHBondContact O-N 2.96Å; Y571-I575 VanDerWaalsContact O-N 3.15Å; C572-I575 PolarHBondContact O-N 3.01Å; C573-I575 VanDerWaalsContact C-N 3.3Å; C573-I575 PolarHBondContact O-N 3.39Å; I575-V577 VanDerWaalsContact C-N 3.32Å; I575-V577 PolarHBondContact O-N 2.72Å; I575-V578 PolarHBondContact O-N 3.36Å; I575-N579 WeakPolarHBondContact O-CB 3.23Å; I575-N579 PolarHBondContact O-N 3.48Å; I575-F621 HydrophobicContact CB-CE2 4.44Å; I575-F621 HydrophobicContact CG2-CE2 3.89Å; I575-F621 HydrophobicContact CG2-CZ 4.32Å; I575-N624 HydrophobicContact CD1-CB 3.96Å; I575-N624 HydrophobicContact CG1-CB 3.67Å; I575-F625 HydrophobicContact CB-CE2 4.44Å; I575-F625 HydrophobicContact CD1-CB 4.45Å; I575-F625 HydrophobicContact CD1-CD1 4.1Å; I575-F625 HydrophobicContact CD1-CD2 3.96Å; I575-F625 HydrophobicContact CD1-CE1 4.33Å; I575-F625 HydrophobicContact CD1-CE2 4.21Å; I575-F625 HydrophobicContact CD1-CG 3.91Å; I575-F625 HydrophobicContact CD1-CZ 4.39Å; I575-F625 HydrophobicContact CG1-CD2 4.11Å; I575-F625 HydrophobicContact CG1-CE2 4.17Å; I575-F625 HydrophobicContact CG2-CD2 4.18Å; I575-F625 HydrophobicContact CG2-CE1 4.25Å; I575-F625 HydrophobicContact CG2-CE2 3.4Å; I575-F625 HydrophobicContact CG2-CZ 3.44Å; I575-F625 VanDerWaalsContact CG2-CZ 3.44Å; I575-L628 HydrophobicContact CD1-CB 4.34Å; I575-L628 HydrophobicContact CD1-CD2 3.75Å
576	L	94.3	Very high	91.8	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-37.7	-175.9	-70.9	173.7	0	0	0	112.3	L424 V428 F503 A506 L507 C572 C573 N579 E580	L424-L576 HydrophobicContact CD1-CB 4.12Å; L424-L576 HydrophobicContact CD2-CB 3.94Å; L424-L576 HydrophobicContact CD2-CD1 4.26Å; L424-L576 HydrophobicContact CD2-CG 4.49Å; V428-L576 HydrophobicContact CG2-CD1 3.43Å; V428-L576 VanDerWaalsContact CG2-CD1 3.43Å; F503-L576 HydrophobicContact CD2-CD2 3.56Å; F503-L576 HydrophobicContact CE2-CD2 4.08Å; F503-L576 HydrophobicContact CG-CD2 4.37Å; A506-L576 HydrophobicContact CB-CD2 3.77Å; A506-L576 HydrophobicContact CB-CG 4.16Å; L507-L576 HydrophobicContact CD2-CD1 4.14Å; C572-L576 WeakPolarHBondContact O-CG 3.27Å; C572-L576 PolarHBondContact O-N 3.03Å; C573-L576 PolarHBondContact O-N 2.89Å; L576-N579 PolarHBondContact O-N 3.11Å; L576-E580 WeakPolarHBondContact O-CB 3.34Å; L576-E580 PolarHBondContact O-N 3.44Å
577	V	93.2	Very high	91.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66	-48	177.2	171.2	0	0	0	0	110.9	L424 F549 C573 I575 N579 E580 F581 F609 I610	L424-V577 HydrophobicContact CD1-CG2 4.19Å; F549-V577 HydrophobicContact CE1-CG2 3.29Å; F549-V577 HydrophobicContact CZ-CG2 3.31Å; C573-V577 WeakPolarHBondContact O-CB 3.24Å; C573-V577 WeakPolarHBondContact O-CG2 3.47Å; C573-V577 PolarHBondContact O-N 3.3Å; I575-V577 VanDerWaalsContact C-N 3.32Å; I575-V577 PolarHBondContact O-N 2.72Å; V577-N579 VanDerWaalsContact C-N 3.34Å; V577-N579 PolarHBondContact O-N 3.28Å; V577-E580 PolarHBondContact O-N 2.87Å; V577-F581 HydrophobicContact CB-CD2 4.48Å; V577-F581 HydrophobicContact CG1-CD2 3.99Å; V577-F581 WeakPolarHBondContact O-CB 3.41Å; V577-F581 VanDerWaalsContact O-CD2 3.31Å; V577-F581 WeakPolarHBondContact O-CD2 3.4Å; V577-F581 PolarHBondContact O-N 3.41Å; V577-F609 HydrophobicContact CG1-CD1 4.31Å; V577-F609 HydrophobicContact CG1-CE1 4.23Å; V577-I610 HydrophobicContact CG1-CG1 3.98Å
578	V	93.4	Very high	90.3	Very high	11 Å²	11	23.8 Å²	23.8	7%	0.067	13%	0.131	C	C	.	.	H	α-helix	trans	-63.9	-43.7	177.1	174	0	0	0	0	110.3	E574 I575 E580 Y582 I610 A617 T618 F621	E574-V578 VanDerWaalsContact O-CG2 3.27Å; E574-V578 WeakPolarHBondContact O-CG2 3.24Å; E574-V578 PolarHBondContact O-N 2.97Å; E574-V578 VanDerWaalsContact O-N 3.1Å; I575-V578 PolarHBondContact O-N 3.36Å; V578-E580 VanDerWaalsContact C-N 3.35Å; V578-E580 PolarHBondContact O-N 3.34Å; V578-Y582 WeakPolarHBondContact O-CB 3.47Å; V578-Y582 PolarHBondContact O-N 2.96Å; V578-Y582 VanDerWaalsContact O-N 3.12Å; V578-I610 HydrophobicContact CG2-CG2 4.1Å; V578-A617 HydrophobicContact CG2-CB 3.63Å; V578-T618 HydrophobicContact CG2-CG2 4.5Å; V578-F621 HydrophobicContact CB-CD2 3.8Å; V578-F621 HydrophobicContact CB-CE2 4.16Å; V578-F621 HydrophobicContact CG1-CD2 3.61Å; V578-F621 HydrophobicContact CG1-CE2 4.08Å; V578-F621 HydrophobicContact CG1-CG 4.32Å
579	N	94.1	Very high	89	Confident	8 Å²	8	24.7 Å²	24.7	4%	0.043	14%	0.144	C	C	.	.	H	α-helix	trans	-60.9	-41.6	-179.8	-171.7	58.5	0	0	0	112.5	R499 I575 L576 V577 F621	R499-N579 WeakPolarHBondContact CA-OD1 3.24Å; R499-N579 WeakPolarHBondContact CB-OD1 3.48Å; R499-N579 VanDerWaalsContact CD-O 3.24Å; R499-N579 WeakPolarHBondContact CD-O 3.45Å; R499-N579 PolarHBondContact NH1-O 2.88Å; R499-N579 PolarHBondContact O-ND2 3.48Å; I575-N579 WeakPolarHBondContact O-CB 3.23Å; I575-N579 PolarHBondContact O-N 3.48Å; L576-N579 PolarHBondContact O-N 3.11Å; V577-N579 VanDerWaalsContact C-N 3.34Å; V577-N579 PolarHBondContact O-N 3.28Å; N579-F621 HydrophobicContact CB-CE2 4.27Å
580	E	91.8	Very high	87.4	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.019	17%	0.171	C	C	.	.	H	α-helix	trans	-80.2	-51.4	-179.8	177.8	59.1	-171.4	0	0	112.3	R420 L493 Y494 L576 V577 V578 L584	R420-E580 WeakPolarHBondContact CD-OE1 3.3Å; R420-E580 IonicContact CZ-OE1 3.59Å; R420-E580 IonicContact NE-OE1 3.13Å; R420-E580 PolarHBondContact NE-OE1 2.96Å; R420-E580 IonicContact NH2-OE1 2.92Å; L493-E580 WeakPolarHBondContact CB-OE2 3.25Å; L493-E580 HydrophobicContact CD2-CG 4.12Å; L493-E580 WeakPolarHBondContact CD2-OE1 3.49Å; L493-E580 WeakPolarHBondContact CD2-OE2 3.42Å; Y494-E580 PolarHBondContact N-OE2 2.87Å; L576-E580 WeakPolarHBondContact O-CB 3.34Å; L576-E580 PolarHBondContact O-N 3.44Å; V577-E580 PolarHBondContact O-N 2.87Å; V578-E580 VanDerWaalsContact C-N 3.35Å; V578-E580 PolarHBondContact O-N 3.34Å; E580-L584 HydrophobicContact CG-CD1 4.28Å; E580-L584 WeakPolarHBondContact O-CD1 3.4Å; E580-L584 WeakPolarHBondContact O-CG 3.36Å
581	F	91.5	Very high	85.5	Confident	0 Å²	0	33 Å²	33	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-82.5	-18.9	-167.8	-71.2	-91	0	0	0	114.4	V417 R420 V421 L424 V577 G583 L584 F586 G606 F609 I610	V417-F581 HydrophobicContact CG1-CE1 4.1Å; V417-F581 HydrophobicContact CG1-CZ 4.28Å; V417-F581 HydrophobicContact CG2-CE1 4.43Å; R420-F581 HydrophobicContact CB-CE2 4.43Å; R420-F581 HydrophobicContact CB-CZ 3.9Å; V421-F581 HydrophobicContact CG2-CZ 4.36Å; L424-F581 HydrophobicContact CD1-CE2 4.32Å; V577-F581 HydrophobicContact CB-CD2 4.48Å; V577-F581 HydrophobicContact CG1-CD2 3.99Å; V577-F581 WeakPolarHBondContact O-CB 3.41Å; V577-F581 VanDerWaalsContact O-CD2 3.31Å; V577-F581 WeakPolarHBondContact O-CD2 3.4Å; V577-F581 PolarHBondContact O-N 3.41Å; F581-G583 PolarHBondContact O-N 3.08Å; F581-G583 VanDerWaalsContact O-N 3.13Å; F581-L584 PolarHBondContact O-N 2.99Å; F581-L584 VanDerWaalsContact O-N 3.16Å; F581-F586 AromaticContact CD1-CE2 3.9Å; F581-F586 HydrophobicContact CD1-CE2 3.9Å; F581-F586 AromaticContact CD1-CZ 3.62Å; F581-F586 HydrophobicContact CD1-CZ 3.62Å; F581-F586 HydrophobicContact CE1-CE2 4.04Å; F581-F586 AromaticContact CE1-CZ 3.61Å; F581-F586 HydrophobicContact CE1-CZ 3.61Å; F581-G606 WeakPolarHBondContact O-CA 3.38Å; F581-F609 HydrophobicContact CD1-CB 4.26Å; F581-F609 AromaticContact CD1-CD1 3.76Å; F581-F609 HydrophobicContact CD1-CD1 3.76Å; F581-F609 HydrophobicContact CD1-CG 4.23Å; F581-F609 AromaticContact CD2-CD1 3.92Å; F581-F609 HydrophobicContact CD2-CD1 3.92Å; F581-F609 HydrophobicContact CD2-CE1 4.17Å; F581-F609 AromaticContact CE1-CD1 3.67Å; F581-F609 HydrophobicContact CE1-CD1 3.67Å; F581-F609 HydrophobicContact CE1-CE1 4.12Å; F581-F609 HydrophobicContact CE1-CG 4.11Å; F581-F609 AromaticContact CE2-CD1 3.83Å; F581-F609 HydrophobicContact CE2-CD1 3.83Å; F581-F609 AromaticContact CE2-CE1 3.7Å; F581-F609 HydrophobicContact CE2-CE1 3.7Å; F581-F609 AromaticContact CG-CD1 3.89Å; F581-F609 HydrophobicContact CG-CD1 3.89Å; F581-F609 AromaticContact CZ-CD1 3.71Å; F581-F609 HydrophobicContact CZ-CD1 3.71Å; F581-F609 AromaticContact CZ-CE1 3.68Å; F581-F609 HydrophobicContact CZ-CE1 3.68Å; F581-F609 HydrophobicContact CZ-CG 4.48Å; F581-F609 HydrophobicContact CZ-CZ 4.44Å; F581-I610 HydrophobicContact CB-CD1 3.89Å; F581-I610 HydrophobicContact CB-CG1 3.81Å
582	Y	89.2	Confident	83.6	Confident	127 Å²	127	39 Å²	39	50%	0.498	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	115.8	-176.4	-166.3	-93.4	0	0	0	111.3	R499 V578 V607 I610 T618	R499-Y582 PolarHBondContact NH1-O 3.49Å; R499-Y582 PolarHBondContact NH2-O 3.44Å; V578-Y582 WeakPolarHBondContact O-CB 3.47Å; V578-Y582 PolarHBondContact O-N 2.96Å; V578-Y582 VanDerWaalsContact O-N 3.12Å; Y582-V607 HydrophobicContact CD2-CG1 4.28Å; Y582-V607 HydrophobicContact CE2-CG1 4.44Å; Y582-I610 HydrophobicContact CD2-CD1 4.46Å; Y582-T618 HydrophobicContact CD2-CG2 4.13Å; Y582-T618 HydrophobicContact CE2-CG2 4.21Å
583	G	85.4	Confident	81.6	Confident	50 Å²	50	42.9 Å²	42.9	52%	0.515	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	7	-178.1	0	0	0	0	0	115.7	F581	F581-G583 PolarHBondContact O-N 3.08Å; F581-G583 VanDerWaalsContact O-N 3.13Å
584	L	87.4	Confident	79.4	Confident	21 Å²	21	46.8 Å²	46.8	11%	0.11	30%	0.297	C	S	.	.			trans	-82.7	137.1	170	-75.7	179.9	0	0	0	111.6	Y494 E580 F581 F586 G606	Y494-L584 HydrophobicContact CD2-CD2 3.59Å; Y494-L584 HydrophobicContact CD2-CG 3.87Å; Y494-L584 HydrophobicContact CE2-CD2 4.07Å; Y494-L584 HydrophobicContact CE2-CG 4.39Å; E580-L584 HydrophobicContact CG-CD1 4.28Å; E580-L584 WeakPolarHBondContact O-CD1 3.4Å; E580-L584 WeakPolarHBondContact O-CG 3.36Å; F581-L584 PolarHBondContact O-N 2.99Å; F581-L584 VanDerWaalsContact O-N 3.16Å; L584-F586 HydrophobicContact CB-CE1 4.48Å; L584-F586 HydrophobicContact CB-CZ 4.23Å; L584-F586 HydrophobicContact CD1-CE1 4.35Å; L584-F586 HydrophobicContact CD1-CZ 4.26Å; L584-G606 PolarHBondContact O-N 2.87Å
585	N	85.9	Confident	77.5	Confident	118 Å²	118	52.7 Å²	52.7	63%	0.631	33%	0.327	S	S	*	.	B	Isolated β-bridge	trans	-114.9	128.2	168.8	-70.2	-25	0	0	0	109
586	F	83.7	Confident	75.5	Confident	12 Å²	12	60.2 Å²	60.2	5%	0.053	37%	0.366	C	S	.	.			trans	-99.7	142.9	179.1	-56.4	-67.5	0	0	0	111.2	T412 A416 V417 F581 L584 T604	T412-F586 HydrophobicContact CG2-CB 3.4Å; T412-F586 HydrophobicContact CG2-CG 4.2Å; A416-F586 HydrophobicContact CB-CD1 4.09Å; A416-F586 HydrophobicContact CB-CE1 4.46Å; V417-F586 HydrophobicContact CG2-CD2 4.06Å; V417-F586 HydrophobicContact CG2-CE2 3.82Å; V417-F586 HydrophobicContact CG2-CZ 4.09Å; F581-F586 AromaticContact CD1-CE2 3.9Å; F581-F586 HydrophobicContact CD1-CE2 3.9Å; F581-F586 AromaticContact CD1-CZ 3.62Å; F581-F586 HydrophobicContact CD1-CZ 3.62Å; F581-F586 HydrophobicContact CE1-CE2 4.04Å; F581-F586 AromaticContact CE1-CZ 3.61Å; F581-F586 HydrophobicContact CE1-CZ 3.61Å; L584-F586 HydrophobicContact CB-CE1 4.48Å; L584-F586 HydrophobicContact CB-CZ 4.23Å; L584-F586 HydrophobicContact CD1-CE1 4.35Å; L584-F586 HydrophobicContact CD1-CZ 4.26Å; F586-T604 PolarHBondContact N-O 3.05Å
587	T	80.6	Confident	73.6	Confident	73 Å²	73	66 Å²	66	45%	0.448	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-91.2	125	176.5	40	0	0	0	0	109.9	N410 N411 T412	N410-T587 PolarHBondContact O-N 3.06Å; N410-T587 PolarHBondContact O-OG1 3.35Å; N411-T587 CarbonylContact C-O 3.49Å; N411-T587 VanDerWaalsContact CA-O 3.28Å; N411-T587 WeakPolarHBondContact CA-O 3.47Å; N411-T587 PolarHBondContact OD1-OG1 3.36Å; T412-T587 PolarHBondContact N-O 3.42Å; T412-T587 PolarHBondContact OG1-O 2.66Å
588	C	74.3	Confident	72	Confident	18 Å²	18	71 Å²	71	12%	0.122	42%	0.42	C	S	.	.			trans	-101	91	170.7	167.9	0	0	0	0	109.7	T412 M595 C601	T412-C588 VanDerWaalsContact OG1-CA 3.3Å; T412-C588 WeakPolarHBondContact OG1-CA 3.4Å; T412-C588 WeakPolarHBondContact OG1-CB 3.16Å; C588-M595 HydrophobicContact CB-SD 4.4Å; C588-C601 HydrophobicContact CB-CB 3.76Å; C588-C601 WeakPolarHBondContact CB-SG 3.38Å; C588-C601 WeakPolarHBondContact SG-CB 3.45Å; C588-C601 CovalentContact SG-SG 2.01Å; C588-C601 PolarHBondContact SG-SG 3.15Å
589	G	66.8	Low	70.7	Confident	35 Å²	35	76.1 Å²	76.1	36%	0.361	45%	0.453	S	S	.	.	S	Bend	trans	61.9	178.2	169.1	0	0	0	0	0	114.5
590	G	60	Low	69.2	Low	55 Å²	55	81.6 Å²	81.6	57%	0.567	48%	0.48	S	S	*	.			trans	-71.2	155.4	173	0	0	0	0	0	111.2	N592 T593	G590-N592 PolarHBondContact O-N 2.92Å; G590-T593 PolarHBondContact O-N 3.47Å; G590-T593 PolarHBondContact O-OG1 2.87Å
591	S	54.2	Low	68.1	Low	127 Å²	127	81.7 Å²	81.7	89%	0.888	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-5.1	-176.7	39.6	0	0	0	0	116.9
592	N	53.9	Low	67	Low	157 Å²	157	85.3 Å²	85.3	84%	0.84	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	2	-173.4	-70.2	0.5	0	0	0	114.4	G590	G590-N592 PolarHBondContact O-N 2.92Å
593	T	52	Low	66.4	Low	81 Å²	81	80.7 Å²	80.7	50%	0.497	50%	0.495	S	S	.	.	S	Bend	trans	-104.2	116.4	172	39.1	0	0	0	0	109.5	G590 M595	G590-T593 PolarHBondContact O-N 3.47Å; G590-T593 PolarHBondContact O-OG1 2.87Å; T593-M595 PolarHBondContact O-N 2.85Å; T593-M595 VanDerWaalsContact O-N 3.08Å
594	S	49.4	Very low	66.1	Low	82 Å²	82	80.6 Å²	80.6	57%	0.573	48%	0.484	S	S	*	.			trans	-47.3	114.1	179.3	39.3	0	0	0	0	111.4	L596 N597	S594-L596 PolarHBondContact O-N 2.97Å; S594-N597 PolarHBondContact O-N 3.33Å
595	M	52	Low	66	Low	126 Å²	126	83.9 Å²	83.9	62%	0.621	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-11.2	177.5	-74.8	-84.6	-152.9	0	0	114.9	C588 T593	C588-M595 HydrophobicContact CB-SD 4.4Å; T593-M595 PolarHBondContact O-N 2.85Å; T593-M595 VanDerWaalsContact O-N 3.08Å
596	L	52.9	Low	66	Low	158 Å²	158	78.3 Å²	78.3	83%	0.827	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-17.9	-175.7	-93.1	91.5	0	0	0	115.8	S594	S594-L596 PolarHBondContact O-N 2.97Å
597	N	54.9	Low	66.2	Low	124 Å²	124	80.4 Å²	80.4	66%	0.663	48%	0.483	S	S	*	.	S	Bend	trans	-100.5	-4.3	-166.6	-77.5	0.8	0	0	0	116	S594	S594-N597 PolarHBondContact O-N 3.33Å
598	H	59.5	Low	66.6	Low	105 Å²	105	80.9 Å²	80.9	49%	0.486	48%	0.48	S	S	.	.			trans	-114.9	114.6	173.7	-77	-56.6	0	0	0	111.3	M600 C601	H598-M600 PolarHBondContact O-N 2.89Å; H598-C601 HydrophobicContact CB-CB 4.44Å; H598-C601 WeakPolarHBondContact O-CB 2.93Å; H598-C601 PolarHBondContact O-N 3.38Å
599	P	65.1	Low	67.2	Low	117 Å²	117	80.8 Å²	80.8	76%	0.76	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-60.6	-22.3	-178.1	23.4	-32.9	0	0	0	112.9	C601 A602	P599-C601 VanDerWaalsContact C-N 3.33Å; P599-A602 WeakPolarHBondContact O-CB 3.35Å
600	M	62.9	Low	68.2	Low	123 Å²	123	79.1 Å²	79.1	61%	0.606	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-75.1	-17.6	175.1	-69.5	-159.6	174.1	0	0	114.3	H598 A602	H598-M600 PolarHBondContact O-N 2.89Å; M600-A602 VanDerWaalsContact C-N 3.3Å
601	C	68	Low	69.5	Low	7 Å²	7	81 Å²	81	5%	0.047	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-86.4	0.3	176.4	-74.5	0	0	0	0	114.1	C588 H598 P599 I603	C588-C601 HydrophobicContact CB-CB 3.76Å; C588-C601 WeakPolarHBondContact CB-SG 3.38Å; C588-C601 WeakPolarHBondContact SG-CB 3.45Å; C588-C601 CovalentContact SG-SG 2.01Å; C588-C601 PolarHBondContact SG-SG 3.15Å; H598-C601 HydrophobicContact CB-CB 4.44Å; H598-C601 WeakPolarHBondContact O-CB 2.93Å; H598-C601 PolarHBondContact O-N 3.38Å; P599-C601 VanDerWaalsContact C-N 3.33Å; C601-I603 PolarHBondContact O-N 3.49Å
602	A	70.2	Confident	70.9	Confident	75 Å²	75	81.3 Å²	81.3	62%	0.62	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-65.3	-19.5	176.2	0	0	0	0	0	113.3	P599 M600	P599-A602 WeakPolarHBondContact O-CB 3.35Å; M600-A602 VanDerWaalsContact C-N 3.3Å
603	I	74.9	Confident	72.4	Confident	31 Å²	31	74.6 Å²	74.6	16%	0.159	40%	0.404	C	S	.	.			trans	-109.2	98.7	-179.1	-55.2	179.1	0	0	0	108.3	C601 Q608 F609 K612	C601-I603 PolarHBondContact O-N 3.49Å; I603-Q608 HydrophobicContact CG2-CB 4.39Å; I603-F609 HydrophobicContact CD1-CD2 4.16Å; I603-F609 HydrophobicContact CG2-CB 3.98Å; I603-K612 HydrophobicContact CD1-CD 4.31Å
604	T	79.1	Confident	73.9	Confident	48 Å²	48	70.9 Å²	70.9	29%	0.294	38%	0.382	S	S	.	.			trans	-100.2	-28.1	177.8	54.3	0	0	0	0	112	F586 Q608	F586-T604 PolarHBondContact N-O 3.05Å; T604-Q608 VanDerWaalsContact N-OE1 3.17Å
605	Q	85.6	Confident	75.5	Confident	90 Å²	90	68.6 Å²	68.6	42%	0.421	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-111.1	139.1	-179.4	-62.9	177.5	-8.6	0	0	110.9	V607 Q608	Q605-V607 VanDerWaalsContact C-N 3.25Å; Q605-V607 HydrophobicContact CB-CG2 3.87Å; Q605-V607 PolarHBondContact O-N 3.49Å; Q605-Q608 HydrophobicContact CB-CG 4.14Å; Q605-Q608 WeakPolarHBondContact O-CB 3.31Å; Q605-Q608 PolarHBondContact O-N 3.44Å; Q605-Q608 VanDerWaalsContact O-N 3.09Å
606	G	86.3	Confident	77	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.3	-31.8	178.1	0	0	0	0	0	113.5	F581 L584 Q608 F609 I610	F581-G606 WeakPolarHBondContact O-CA 3.38Å; L584-G606 PolarHBondContact O-N 2.87Å; G606-Q608 VanDerWaalsContact C-N 3.3Å; G606-Q608 PolarHBondContact O-N 3.03Å; G606-F609 WeakPolarHBondContact O-CB 3.33Å; G606-F609 PolarHBondContact O-N 3.37Å; G606-F609 VanDerWaalsContact O-N 3.09Å; G606-I610 WeakPolarHBondContact O-CG1 3.27Å; G606-I610 PolarHBondContact O-N 2.89Å
607	V	88.5	Confident	78.6	Confident	57 Å²	57	56.1 Å²	56.1	35%	0.345	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-34	173.9	-80.1	0	0	0	0	113.4	Y582 Q605 F609 I610 E611	Y582-V607 HydrophobicContact CD2-CG1 4.28Å; Y582-V607 HydrophobicContact CE2-CG1 4.44Å; Q605-V607 VanDerWaalsContact C-N 3.25Å; Q605-V607 HydrophobicContact CB-CG2 3.87Å; Q605-V607 PolarHBondContact O-N 3.49Å; V607-F609 VanDerWaalsContact C-N 3.28Å; V607-F609 PolarHBondContact O-N 3.06Å; V607-I610 PolarHBondContact O-N 3.38Å; V607-E611 PolarHBondContact O-N 2.82Å
608	Q	87.4	Confident	80.1	Confident	82 Å²	82	52.5 Å²	52.5	38%	0.383	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-34.9	174.7	-65.9	172.3	-27.8	0	0	111.4	I603 T604 Q605 G606 K612	I603-Q608 HydrophobicContact CG2-CB 4.39Å; T604-Q608 VanDerWaalsContact N-OE1 3.17Å; Q605-Q608 HydrophobicContact CB-CG 4.14Å; Q605-Q608 WeakPolarHBondContact O-CB 3.31Å; Q605-Q608 PolarHBondContact O-N 3.44Å; Q605-Q608 VanDerWaalsContact O-N 3.09Å; G606-Q608 VanDerWaalsContact C-N 3.3Å; G606-Q608 PolarHBondContact O-N 3.03Å; Q608-K612 WeakPolarHBondContact O-CB 3.29Å; Q608-K612 PolarHBondContact O-N 3.44Å
609	F	87.3	Confident	81.6	Confident	16 Å²	16	51.9 Å²	51.9	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-67.8	-45.7	174	-176.8	-102.3	0	0	0	111.4	V417 V421 V577 F581 I603 G606 V607 E611 K612 T613	V417-F609 HydrophobicContact CG1-CD2 3.58Å; V417-F609 HydrophobicContact CG1-CE2 3.5Å; V417-F609 VanDerWaalsContact CG1-CE2 3.5Å; V417-F609 HydrophobicContact CG1-CG 4.18Å; V417-F609 HydrophobicContact CG1-CZ 4.04Å; V421-F609 HydrophobicContact CG2-CE1 3.89Å; V421-F609 HydrophobicContact CG2-CE2 4.09Å; V421-F609 HydrophobicContact CG2-CZ 3.29Å; V577-F609 HydrophobicContact CG1-CD1 4.31Å; V577-F609 HydrophobicContact CG1-CE1 4.23Å; F581-F609 HydrophobicContact CD1-CB 4.26Å; F581-F609 AromaticContact CD1-CD1 3.76Å; F581-F609 HydrophobicContact CD1-CD1 3.76Å; F581-F609 HydrophobicContact CD1-CG 4.23Å; F581-F609 AromaticContact CD2-CD1 3.92Å; F581-F609 HydrophobicContact CD2-CD1 3.92Å; F581-F609 HydrophobicContact CD2-CE1 4.17Å; F581-F609 AromaticContact CE1-CD1 3.67Å; F581-F609 HydrophobicContact CE1-CD1 3.67Å; F581-F609 HydrophobicContact CE1-CE1 4.12Å; F581-F609 HydrophobicContact CE1-CG 4.11Å; F581-F609 AromaticContact CE2-CD1 3.83Å; F581-F609 HydrophobicContact CE2-CD1 3.83Å; F581-F609 AromaticContact CE2-CE1 3.7Å; F581-F609 HydrophobicContact CE2-CE1 3.7Å; F581-F609 AromaticContact CG-CD1 3.89Å; F581-F609 HydrophobicContact CG-CD1 3.89Å; F581-F609 AromaticContact CZ-CD1 3.71Å; F581-F609 HydrophobicContact CZ-CD1 3.71Å; F581-F609 AromaticContact CZ-CE1 3.68Å; F581-F609 HydrophobicContact CZ-CE1 3.68Å; F581-F609 HydrophobicContact CZ-CG 4.48Å; F581-F609 HydrophobicContact CZ-CZ 4.44Å; I603-F609 HydrophobicContact CD1-CD2 4.16Å; I603-F609 HydrophobicContact CG2-CB 3.98Å; G606-F609 WeakPolarHBondContact O-CB 3.33Å; G606-F609 PolarHBondContact O-N 3.37Å; G606-F609 VanDerWaalsContact O-N 3.09Å; V607-F609 VanDerWaalsContact C-N 3.28Å; V607-F609 PolarHBondContact O-N 3.06Å; F609-E611 PolarHBondContact O-N 3.47Å; F609-K612 PolarHBondContact O-N 3.25Å; F609-T613 HydrophobicContact CD2-CG2 4.35Å; F609-T613 HydrophobicContact CE1-CG2 4.07Å; F609-T613 HydrophobicContact CE2-CG2 3.76Å; F609-T613 HydrophobicContact CZ-CG2 3.57Å; F609-T613 PolarHBondContact O-N 3.44Å; F609-T613 VanDerWaalsContact O-N 3.09Å; F609-T613 PolarHBondContact O-OG1 3.04Å
610	I	88.5	Confident	82.9	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.2	-49	179.6	-61.7	167.2	0	0	0	111	V577 V578 F581 Y582 G606 V607 K612 T613 C614 A617 T618	V577-I610 HydrophobicContact CG1-CG1 3.98Å; V578-I610 HydrophobicContact CG2-CG2 4.1Å; F581-I610 HydrophobicContact CB-CD1 3.89Å; F581-I610 HydrophobicContact CB-CG1 3.81Å; Y582-I610 HydrophobicContact CD2-CD1 4.46Å; G606-I610 WeakPolarHBondContact O-CG1 3.27Å; G606-I610 PolarHBondContact O-N 2.89Å; V607-I610 PolarHBondContact O-N 3.38Å; I610-K612 VanDerWaalsContact C-N 3.28Å; I610-K612 PolarHBondContact O-N 3.44Å; I610-T613 PolarHBondContact O-N 3.09Å; I610-C614 CarbonylContact O-C 3.58Å; I610-C614 WeakPolarHBondContact O-CA 3.24Å; I610-C614 PolarHBondContact O-N 3.09Å; I610-A617 HydrophobicContact CG2-CB 4.4Å; I610-T618 HydrophobicContact CD1-CG2 4.44Å; I610-T618 HydrophobicContact CG2-CG2 3.99Å
611	E	86.7	Confident	84.3	Confident	95 Å²	95	45.9 Å²	45.9	44%	0.444	25%	0.253	S	S	.	.	H	α-helix	trans	-65.6	-31.5	-180	-71.4	-58	147	0	0	112.6	V607 F609 P615	V607-E611 PolarHBondContact O-N 2.82Å; F609-E611 PolarHBondContact O-N 3.47Å; E611-P615 WeakPolarHBondContact O-CD 3.03Å; E611-P615 WeakPolarHBondContact OE2-CA 3.3Å
612	K	84.7	Confident	85.4	Confident	134 Å²	134	50.9 Å²	50.9	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-69.3	-43.8	177.8	-174.8	174.8	-178.4	176.7	0	112.5	N552 I603 Q608 F609 I610	N552-K612 PolarHBondContact ND2-O 2.87Å; I603-K612 HydrophobicContact CD1-CD 4.31Å; Q608-K612 WeakPolarHBondContact O-CB 3.29Å; Q608-K612 PolarHBondContact O-N 3.44Å; F609-K612 PolarHBondContact O-N 3.25Å; I610-K612 VanDerWaalsContact C-N 3.28Å; I610-K612 PolarHBondContact O-N 3.44Å
613	T	83.9	Confident	86.5	Confident	15 Å²	15	49.3 Å²	49.3	9%	0.092	27%	0.271	C	S	.	.	H	α-helix	trans	-90.1	-40.9	-175	57.4	0	0	0	0	112.9	N552 F609 I610	N552-T613 PolarHBondContact OD1-O 3.18Å; F609-T613 HydrophobicContact CD2-CG2 4.35Å; F609-T613 HydrophobicContact CE1-CG2 4.07Å; F609-T613 HydrophobicContact CE2-CG2 3.76Å; F609-T613 HydrophobicContact CZ-CG2 3.57Å; F609-T613 PolarHBondContact O-N 3.44Å; F609-T613 VanDerWaalsContact O-N 3.09Å; F609-T613 PolarHBondContact O-OG1 3.04Å; I610-T613 PolarHBondContact O-N 3.09Å
614	C	84.5	Confident	87.4	Confident	3 Å²	3	48 Å²	48	2%	0.02	26%	0.264	C	S	.	.	S	Bend	trans	-142.6	68.7	-168.5	-58.5	0	0	0	0	110.6	E574 I610 G616 A617	E574-C614 HydrophobicContact CG-CB 3.98Å; I610-C614 CarbonylContact O-C 3.58Å; I610-C614 WeakPolarHBondContact O-CA 3.24Å; I610-C614 PolarHBondContact O-N 3.09Å; C614-G616 PolarHBondContact O-N 3.37Å; C614-A617 HydrophobicContact CB-CB 3.85Å; C614-A617 WeakPolarHBondContact O-CB 3.24Å; C614-A617 PolarHBondContact O-N 3.28Å
615	P	82.1	Confident	88.2	Confident	35 Å²	35	47.2 Å²	47.2	23%	0.227	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	138	-178.5	21.4	-30.8	0	0	0	111.6	Q554 E611 A617 R620	Q554-P615 VanDerWaalsContact CD-CG 3.43Å; Q554-P615 HydrophobicContact CG-CG 4.28Å; E611-P615 WeakPolarHBondContact O-CD 3.03Å; E611-P615 WeakPolarHBondContact OE2-CA 3.3Å; P615-A617 PolarHBondContact O-N 3.4Å; P615-R620 PolarHBondContact O-NH2 2.96Å
616	G	84.4	Confident	88.7	Confident	22 Å²	22	49.5 Å²	49.5	23%	0.227	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	5.2	-176.1	0	0	0	0	0	115.6	C614 T618 S619 R620	C614-G616 PolarHBondContact O-N 3.37Å; G616-T618 PolarHBondContact O-N 3.16Å; G616-S619 PolarHBondContact O-N 3.13Å; G616-S619 PolarHBondContact O-OG 2.88Å; G616-R620 WeakPolarHBondContact O-CG 3.24Å; G616-R620 PolarHBondContact O-N 3.46Å; G616-R620 PolarHBondContact O-NE 3.4Å
617	A	86.7	Confident	89.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.1	175	0	0	0	0	0	112.5	E574 V578 I610 C614 P615 S619 R620 F621	E574-A617 HydrophobicContact CB-CB 4.11Å; E574-A617 HydrophobicContact CG-CB 4.24Å; V578-A617 HydrophobicContact CG2-CB 3.63Å; I610-A617 HydrophobicContact CG2-CB 4.4Å; C614-A617 HydrophobicContact CB-CB 3.85Å; C614-A617 WeakPolarHBondContact O-CB 3.24Å; C614-A617 PolarHBondContact O-N 3.28Å; P615-A617 PolarHBondContact O-N 3.4Å; A617-S619 PolarHBondContact O-N 3.49Å; A617-R620 CarbonylContact O-C 3.55Å; A617-R620 PolarHBondContact O-N 2.79Å; A617-F621 PolarHBondContact O-N 3.46Å
618	T	86.9	Confident	89.5	Confident	48 Å²	48	49.8 Å²	49.8	29%	0.294	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-49.6	174.6	47.5	0	0	0	0	111.9	V578 Y582 I610 G616	V578-T618 HydrophobicContact CG2-CG2 4.5Å; Y582-T618 HydrophobicContact CD2-CG2 4.13Å; Y582-T618 HydrophobicContact CE2-CG2 4.21Å; I610-T618 HydrophobicContact CD1-CG2 4.44Å; I610-T618 HydrophobicContact CG2-CG2 3.99Å; G616-T618 PolarHBondContact O-N 3.16Å
619	S	90.4	Very high	89.9	Confident	92 Å²	92	49.5 Å²	49.5	64%	0.643	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-30.2	177.6	67.6	0	0	0	0	113.6	G616 A617	G616-S619 PolarHBondContact O-N 3.13Å; G616-S619 PolarHBondContact O-OG 2.88Å; A617-S619 PolarHBondContact O-N 3.49Å
620	R	91.4	Very high	90.3	Very high	77 Å²	77	50.5 Å²	50.5	29%	0.291	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	6.1	-175.5	-66.5	-177.2	-70	133.2	0.7	113.5	E574 P615 G616 A617 T622 A623 N624	E574-R620 IonicContact OE1-NH1 2.92Å; E574-R620 IonicContact OE1-NH2 3.88Å; E574-R620 IonicContact OE2-CZ 3.03Å; E574-R620 IonicContact OE2-NH1 3.55Å; E574-R620 PolarHBondContact OE2-NH1 3.02Å; E574-R620 IonicContact OE2-NH2 2.69Å; P615-R620 PolarHBondContact O-NH2 2.96Å; G616-R620 WeakPolarHBondContact O-CG 3.24Å; G616-R620 PolarHBondContact O-N 3.46Å; G616-R620 PolarHBondContact O-NE 3.4Å; A617-R620 CarbonylContact O-C 3.55Å; A617-R620 PolarHBondContact O-N 2.79Å; R620-T622 PolarHBondContact O-N 2.84Å; R620-A623 PolarHBondContact O-N 2.96Å; R620-N624 WeakPolarHBondContact O-CB 3.36Å; R620-N624 PolarHBondContact O-N 3.08Å; R620-N624 PolarHBondContact O-OD1 2.93Å
621	F	92	Very high	90.6	Very high	36 Å²	36	53 Å²	53	16%	0.158	29%	0.292	C	S	.	.	H	α-helix	trans	-54.5	-47.3	-174.3	-174.8	-100.7	0	0	0	113.4	Y502 I575 V578 N579 A617 N624 F625	Y502-F621 HydrophobicContact CD1-CE1 4.36Å; Y502-F621 HydrophobicContact CD1-CZ 4.45Å; Y502-F621 HydrophobicContact CD2-CZ 4.38Å; Y502-F621 HydrophobicContact CE1-CE1 4.46Å; Y502-F621 HydrophobicContact CG-CE1 4.43Å; Y502-F621 HydrophobicContact CG-CZ 4.17Å; I575-F621 HydrophobicContact CB-CE2 4.44Å; I575-F621 HydrophobicContact CG2-CE2 3.89Å; I575-F621 HydrophobicContact CG2-CZ 4.32Å; V578-F621 HydrophobicContact CB-CD2 3.8Å; V578-F621 HydrophobicContact CB-CE2 4.16Å; V578-F621 HydrophobicContact CG1-CD2 3.61Å; V578-F621 HydrophobicContact CG1-CE2 4.08Å; V578-F621 HydrophobicContact CG1-CG 4.32Å; N579-F621 HydrophobicContact CB-CE2 4.27Å; A617-F621 PolarHBondContact O-N 3.46Å; F621-N624 PolarHBondContact O-N 3.12Å; F621-F625 HydrophobicContact CD1-CD2 4.42Å; F621-F625 HydrophobicContact CD1-CE2 4.39Å; F621-F625 HydrophobicContact CE1-CD2 4.13Å; F621-F625 AromaticContact CE1-CE2 3.7Å; F621-F625 HydrophobicContact CE1-CE2 3.7Å; F621-F625 HydrophobicContact CE2-CE2 4.16Å; F621-F625 HydrophobicContact CZ-CD2 4.37Å; F621-F625 AromaticContact CZ-CE2 3.59Å; F621-F625 HydrophobicContact CZ-CE2 3.59Å; F621-F625 PolarHBondContact O-N 3.49Å
622	T	91.6	Very high	91	Very high	112 Å²	112	49.6 Å²	49.6	69%	0.687	28%	0.276	S	S	*	.	H	α-helix	trans	-68.7	-41.8	178.9	52.3	0	0	0	0	112.4	R620 N624 F625 L626	R620-T622 PolarHBondContact O-N 2.84Å; T622-N624 VanDerWaalsContact C-N 3.31Å; T622-N624 PolarHBondContact O-N 2.9Å; T622-F625 PolarHBondContact O-N 3.42Å; T622-L626 PolarHBondContact O-N 2.88Å
623	A	94.3	Very high	91.5	Very high	42 Å²	42	46.5 Å²	46.5	35%	0.347	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-36.9	176.1	0	0	0	0	0	111.9	R620 F625 L626 I627	R620-A623 PolarHBondContact O-N 2.96Å; A623-F625 VanDerWaalsContact C-N 3.33Å; A623-F625 PolarHBondContact O-N 3.28Å; A623-L626 WeakPolarHBondContact O-CB 3.49Å; A623-L626 PolarHBondContact O-N 3.06Å; A623-I627 WeakPolarHBondContact O-CG1 3.49Å; A623-I627 PolarHBondContact O-N 3.12Å
624	N	94.2	Very high	92.1	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-38.6	178.1	-74.4	-11.3	0	0	0	111.5	Y571 E574 I575 R620 F621 T622 I627 L628	Y571-N624 WeakPolarHBondContact CD1-OD1 3.28Å; E574-N624 WeakPolarHBondContact CB-ND2 3.21Å; E574-N624 PolarHBondContact OE2-ND2 3.31Å; I575-N624 HydrophobicContact CD1-CB 3.96Å; I575-N624 HydrophobicContact CG1-CB 3.67Å; R620-N624 WeakPolarHBondContact O-CB 3.36Å; R620-N624 PolarHBondContact O-N 3.08Å; R620-N624 PolarHBondContact O-OD1 2.93Å; F621-N624 PolarHBondContact O-N 3.12Å; T622-N624 VanDerWaalsContact C-N 3.31Å; T622-N624 PolarHBondContact O-N 2.9Å; N624-I627 PolarHBondContact O-N 2.89Å; N624-L628 WeakPolarHBondContact O-CB 3.35Å; N624-L628 PolarHBondContact O-N 2.72Å
625	F	94.8	Very high	92.7	Very high	33 Å²	33	49.3 Å²	49.3	15%	0.145	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-44.8	172.8	-93.3	-75.2	0	0	0	112	Y502 A505 A506 I575 F621 T622 A623 I627 L628 Y629	Y502-F625 AromaticContact CD1-CE2 3.95Å; Y502-F625 HydrophobicContact CD1-CE2 3.95Å; Y502-F625 AromaticContact CD1-CZ 3.89Å; Y502-F625 HydrophobicContact CD1-CZ 3.89Å; Y502-F625 HydrophobicContact CG-CZ 4.4Å; A505-F625 HydrophobicContact CB-CE1 3.98Å; A506-F625 HydrophobicContact CB-CE1 4.44Å; A506-F625 HydrophobicContact CB-CZ 4.45Å; I575-F625 HydrophobicContact CB-CE2 4.44Å; I575-F625 HydrophobicContact CD1-CB 4.45Å; I575-F625 HydrophobicContact CD1-CD1 4.1Å; I575-F625 HydrophobicContact CD1-CD2 3.96Å; I575-F625 HydrophobicContact CD1-CE1 4.33Å; I575-F625 HydrophobicContact CD1-CE2 4.21Å; I575-F625 HydrophobicContact CD1-CG 3.91Å; I575-F625 HydrophobicContact CD1-CZ 4.39Å; I575-F625 HydrophobicContact CG1-CD2 4.11Å; I575-F625 HydrophobicContact CG1-CE2 4.17Å; I575-F625 HydrophobicContact CG2-CD2 4.18Å; I575-F625 HydrophobicContact CG2-CE1 4.25Å; I575-F625 HydrophobicContact CG2-CE2 3.4Å; I575-F625 HydrophobicContact CG2-CZ 3.44Å; I575-F625 VanDerWaalsContact CG2-CZ 3.44Å; F621-F625 HydrophobicContact CD1-CD2 4.42Å; F621-F625 HydrophobicContact CD1-CE2 4.39Å; F621-F625 HydrophobicContact CE1-CD2 4.13Å; F621-F625 AromaticContact CE1-CE2 3.7Å; F621-F625 HydrophobicContact CE1-CE2 3.7Å; F621-F625 HydrophobicContact CE2-CE2 4.16Å; F621-F625 HydrophobicContact CZ-CD2 4.37Å; F621-F625 AromaticContact CZ-CE2 3.59Å; F621-F625 HydrophobicContact CZ-CE2 3.59Å; F621-F625 PolarHBondContact O-N 3.49Å; T622-F625 PolarHBondContact O-N 3.42Å; A623-F625 VanDerWaalsContact C-N 3.33Å; A623-F625 PolarHBondContact O-N 3.28Å; F625-I627 VanDerWaalsContact C-N 3.35Å; F625-I627 PolarHBondContact O-N 2.85Å; F625-L628 PolarHBondContact O-N 3.29Å; F625-Y629 HydrophobicContact CD1-CD2 4.23Å; F625-Y629 AromaticContact CD1-CE2 3.97Å; F625-Y629 HydrophobicContact CD1-CE2 3.97Å; F625-Y629 HydrophobicContact CE1-CE2 4.38Å; F625-Y629 WeakPolarHBondContact O-CD2 3.43Å; F625-Y629 PolarHBondContact O-N 3.27Å
626	L	95.6	Very high	93.3	Very high	137 Å²	137	48.8 Å²	48.8	72%	0.717	29%	0.288	S	S	*	.	H	α-helix	trans	-58.6	-46.7	177	-172.9	85.7	0	0	0	111.3	T622 A623 G630	T622-L626 PolarHBondContact O-N 2.88Å; A623-L626 WeakPolarHBondContact O-CB 3.49Å; A623-L626 PolarHBondContact O-N 3.06Å; L626-G630 PolarHBondContact O-N 3.15Å
627	I	95.3	Very high	93.8	Very high	63 Å²	63	52.9 Å²	52.9	32%	0.323	30%	0.303	S	S	.	.	H	α-helix	trans	-67.9	-45.2	-179.1	-63.8	165.7	0	0	0	110.8	Y571 A623 N624 F625 Y629 G630 F631	Y571-I627 HydrophobicContact CD1-CB 4.09Å; Y571-I627 HydrophobicContact CD1-CD1 4.08Å; Y571-I627 HydrophobicContact CD1-CG2 3.88Å; Y571-I627 HydrophobicContact CD2-CG2 3.7Å; Y571-I627 HydrophobicContact CE1-CB 4.2Å; Y571-I627 HydrophobicContact CE1-CD1 3.6Å; Y571-I627 HydrophobicContact CE1-CG1 4.49Å; Y571-I627 HydrophobicContact CE1-CG2 3.75Å; Y571-I627 HydrophobicContact CE2-CG2 3.58Å; Y571-I627 HydrophobicContact CG-CB 4.3Å; Y571-I627 HydrophobicContact CG-CG2 3.85Å; A623-I627 WeakPolarHBondContact O-CG1 3.49Å; A623-I627 PolarHBondContact O-N 3.12Å; N624-I627 PolarHBondContact O-N 2.89Å; F625-I627 VanDerWaalsContact C-N 3.35Å; F625-I627 PolarHBondContact O-N 2.85Å; I627-Y629 PolarHBondContact O-N 2.9Å; I627-G630 PolarHBondContact O-N 3.4Å; I627-F631 HydrophobicContact CG2-CE2 4.01Å; I627-F631 VanDerWaalsContact O-CD2 3.23Å; I627-F631 WeakPolarHBondContact O-CD2 3.46Å; I627-F631 PolarHBondContact O-N 3.1Å
628	L	96	Very high	94.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-48.7	179.2	177.6	59.7	0	0	0	111.5	A509 I513 F568 C572 I575 N624 F625 G630 F631	A509-L628 HydrophobicContact CB-CD1 4.05Å; A509-L628 HydrophobicContact CB-CD2 3.88Å; A509-L628 HydrophobicContact CB-CG 3.62Å; I513-L628 HydrophobicContact CD1-CD1 4.09Å; F568-L628 HydrophobicContact CB-CD1 4.15Å; C572-L628 HydrophobicContact CB-CD1 4.02Å; C572-L628 HydrophobicContact CB-CD2 4.05Å; I575-L628 HydrophobicContact CD1-CB 4.34Å; I575-L628 HydrophobicContact CD1-CD2 3.75Å; N624-L628 WeakPolarHBondContact O-CB 3.35Å; N624-L628 PolarHBondContact O-N 2.72Å; F625-L628 PolarHBondContact O-N 3.29Å; L628-G630 VanDerWaalsContact C-N 3.3Å; L628-G630 PolarHBondContact O-N 3.02Å; L628-F631 PolarHBondContact O-N 2.99Å
629	Y	96.1	Very high	94.6	Very high	77 Å²	77	54.7 Å²	54.7	30%	0.302	31%	0.311	S	S	.	.	H	α-helix	trans	-73.5	-20.8	176.9	-83.7	-88.6	0	0	0	113.1	A505 A509 F625 I627 F631 I632 P633	A505-Y629 PolarHBondContact O-OH 3.05Å; A509-Y629 HydrophobicContact CB-CD1 4.45Å; A509-Y629 HydrophobicContact CB-CD2 4.38Å; A509-Y629 HydrophobicContact CB-CE1 4.23Å; A509-Y629 HydrophobicContact CB-CE2 4.16Å; F625-Y629 HydrophobicContact CD1-CD2 4.23Å; F625-Y629 AromaticContact CD1-CE2 3.97Å; F625-Y629 HydrophobicContact CD1-CE2 3.97Å; F625-Y629 HydrophobicContact CE1-CE2 4.38Å; F625-Y629 WeakPolarHBondContact O-CD2 3.43Å; F625-Y629 PolarHBondContact O-N 3.27Å; I627-Y629 PolarHBondContact O-N 2.9Å; Y629-F631 VanDerWaalsContact C-N 3.28Å; Y629-F631 PolarHBondContact O-N 3.4Å; Y629-I632 HydrophobicContact CD1-CD1 3.77Å; Y629-I632 HydrophobicContact CE1-CD1 4.2Å; Y629-I632 PolarHBondContact O-N 3.31Å; Y629-P633 WeakPolarHBondContact O-CD 3.33Å
630	G	95.6	Very high	94.8	Very high	37 Å²	37	52.5 Å²	52.5	38%	0.381	29%	0.291	S	S	.	.	H	α-helix	trans	-64.4	-25.9	174.5	0	0	0	0	0	114.4	L626 I627 L628 I632 P633 A634	L626-G630 PolarHBondContact O-N 3.15Å; I627-G630 PolarHBondContact O-N 3.4Å; L628-G630 VanDerWaalsContact C-N 3.3Å; L628-G630 PolarHBondContact O-N 3.02Å; G630-I632 VanDerWaalsContact C-N 3.3Å; G630-I632 PolarHBondContact O-N 2.92Å; G630-P633 WeakPolarHBondContact O-CD 3.19Å; G630-P633 WeakPolarHBondContact O-CG 3.49Å; G630-A634 PolarHBondContact O-N 3.24Å
631	F	95.2	Very high	94.9	Very high	53 Å²	53	52.5 Å²	52.5	23%	0.232	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-32.6	174.3	-77.7	-84.4	0	0	0	113	I513 F566 F568 Y571 I627 L628 Y629 A634 L635	I513-F631 HydrophobicContact CD1-CB 3.85Å; I513-F631 HydrophobicContact CG1-CB 4.15Å; F566-F631 WeakPolarHBondContact O-CZ 3.41Å; F568-F631 HydrophobicContact CB-CD2 3.88Å; F568-F631 HydrophobicContact CB-CE2 4.02Å; F568-F631 HydrophobicContact CB-CG 4.18Å; F568-F631 HydrophobicContact CB-CZ 4.42Å; Y571-F631 HydrophobicContact CD2-CE2 4.06Å; Y571-F631 HydrophobicContact CE2-CE2 4.21Å; Y571-F631 HydrophobicContact CE2-CZ 4.48Å; I627-F631 HydrophobicContact CG2-CE2 4.01Å; I627-F631 VanDerWaalsContact O-CD2 3.23Å; I627-F631 WeakPolarHBondContact O-CD2 3.46Å; I627-F631 PolarHBondContact O-N 3.1Å; L628-F631 PolarHBondContact O-N 2.99Å; Y629-F631 VanDerWaalsContact C-N 3.28Å; Y629-F631 PolarHBondContact O-N 3.4Å; F631-A634 PolarHBondContact O-N 3.01Å; F631-L635 WeakPolarHBondContact O-CB 3.03Å; F631-L635 WeakPolarHBondContact O-CG 3.31Å; F631-L635 PolarHBondContact O-N 3.38Å
632	I	95.4	Very high	95	Very high	22 Å²	22	52 Å²	52	11%	0.113	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-58.8	-177.5	-67.7	166.4	0	0	0	112.2	A509 L512 I513 F516 Y629 G630 A634 L635 V636	A509-I632 HydrophobicContact CB-CD1 4.18Å; L512-I632 HydrophobicContact CB-CD1 4.04Å; L512-I632 HydrophobicContact CB-CG1 4.3Å; L512-I632 HydrophobicContact CD1-CD1 3.99Å; I513-I632 HydrophobicContact CG1-CG1 3.91Å; F516-I632 HydrophobicContact CD2-CG2 3.79Å; F516-I632 HydrophobicContact CE2-CG2 3.51Å; Y629-I632 HydrophobicContact CD1-CD1 3.77Å; Y629-I632 HydrophobicContact CE1-CD1 4.2Å; Y629-I632 PolarHBondContact O-N 3.31Å; G630-I632 VanDerWaalsContact C-N 3.3Å; G630-I632 PolarHBondContact O-N 2.92Å; I632-A634 VanDerWaalsContact C-N 3.26Å; I632-A634 PolarHBondContact O-N 2.86Å; I632-L635 PolarHBondContact O-N 2.85Å; I632-V636 WeakPolarHBondContact O-CG2 3.49Å; I632-V636 PolarHBondContact O-N 3.38Å
633	P	96	Very high	95.1	Very high	69 Å²	69	46.8 Å²	46.8	45%	0.448	27%	0.267	S	S	.	.	H	α-helix	trans	-63	-33.6	178.2	25.7	-33.3	0	0	0	111.8	Y629 G630 L635 V636 I637	Y629-P633 WeakPolarHBondContact O-CD 3.33Å; G630-P633 WeakPolarHBondContact O-CD 3.19Å; G630-P633 WeakPolarHBondContact O-CG 3.49Å; P633-L635 PolarHBondContact O-N 2.79Å; P633-V636 PolarHBondContact O-N 2.87Å; P633-I637 WeakPolarHBondContact O-CB 3.38Å; P633-I637 WeakPolarHBondContact O-CD1 3.5Å; P633-I637 VanDerWaalsContact O-CG1 3.23Å; P633-I637 WeakPolarHBondContact O-CG1 2.9Å; P633-I637 PolarHBondContact O-N 2.98Å
634	A	95.9	Very high	94.9	Very high	55 Å²	55	51.7 Å²	51.7	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-45.2	175.7	0	0	0	0	0	112.2	G630 F631 I632 I637 L638	G630-A634 PolarHBondContact O-N 3.24Å; F631-A634 PolarHBondContact O-N 3.01Å; I632-A634 VanDerWaalsContact C-N 3.26Å; I632-A634 PolarHBondContact O-N 2.86Å; A634-I637 PolarHBondContact O-N 3.34Å; A634-L638 VanDerWaalsContact O-CB 3.31Å; A634-L638 WeakPolarHBondContact O-CB 3.34Å; A634-L638 PolarHBondContact O-N 2.93Å
635	L	95.9	Very high	94.7	Very high	23 Å²	23	55 Å²	55	12%	0.12	30%	0.3	C	S	.	.	H	α-helix	trans	-65.8	-38.7	175.9	-73.8	168.7	0	0	0	112.3	I513 F516 L517 V520 F631 I632 P633 L638 G639	I513-L635 HydrophobicContact CB-CD1 4.35Å; I513-L635 HydrophobicContact CG1-CD1 4.4Å; I513-L635 HydrophobicContact CG2-CD1 3.89Å; F516-L635 HydrophobicContact CB-CB 3.95Å; F516-L635 HydrophobicContact CB-CD1 4.33Å; L517-L635 HydrophobicContact CB-CD1 4.39Å; L517-L635 HydrophobicContact CB-CD2 4.46Å; L517-L635 HydrophobicContact CD1-CD2 4.1Å; V520-L635 HydrophobicContact CG2-CD2 4.43Å; V520-L635 VanDerWaalsContact CG2-O 3.29Å; V520-L635 WeakPolarHBondContact CG2-O 3.26Å; F631-L635 WeakPolarHBondContact O-CB 3.03Å; F631-L635 WeakPolarHBondContact O-CG 3.31Å; F631-L635 PolarHBondContact O-N 3.38Å; I632-L635 PolarHBondContact O-N 2.85Å; P633-L635 PolarHBondContact O-N 2.79Å; L635-L638 PolarHBondContact O-N 2.97Å; L635-G639 PolarHBondContact O-N 2.9Å
636	V	95	Very high	94.3	Very high	24 Å²	24	54 Å²	54	15%	0.145	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-45.6	176.8	175.1	0	0	0	0	111	V469 F516 I632 P633 G639 I640	V469-V636 HydrophobicContact CG1-CG1 4.27Å; V469-V636 HydrophobicContact CG1-CG2 3.83Å; V469-V636 HydrophobicContact CG2-CG2 4.38Å; F516-V636 HydrophobicContact CD2-CG2 4.11Å; F516-V636 HydrophobicContact CE2-CG2 4.31Å; F516-V636 HydrophobicContact CG-CG2 4.22Å; I632-V636 WeakPolarHBondContact O-CG2 3.49Å; I632-V636 PolarHBondContact O-N 3.38Å; P633-V636 PolarHBondContact O-N 2.87Å; V636-G639 PolarHBondContact O-N 3.24Å; V636-I640 HydrophobicContact CG1-CD1 4.19Å; V636-I640 WeakPolarHBondContact O-CG1 3.29Å; V636-I640 PolarHBondContact O-N 2.85Å
637	I	95.8	Very high	93.6	Very high	108 Å²	108	49.3 Å²	49.3	55%	0.554	27%	0.271	S	S	*	.	H	α-helix	trans	-62.7	-45.9	177.3	-67.9	164.1	0	0	0	110.5	P633 A634 G639 I640 V641	P633-I637 WeakPolarHBondContact O-CB 3.38Å; P633-I637 WeakPolarHBondContact O-CD1 3.5Å; P633-I637 VanDerWaalsContact O-CG1 3.23Å; P633-I637 WeakPolarHBondContact O-CG1 2.9Å; P633-I637 PolarHBondContact O-N 2.98Å; A634-I637 PolarHBondContact O-N 3.34Å; I637-G639 VanDerWaalsContact C-N 3.28Å; I637-G639 PolarHBondContact O-N 3.46Å; I637-I640 PolarHBondContact O-N 3.44Å; I637-V641 WeakPolarHBondContact O-CG2 3.35Å; I637-V641 PolarHBondContact O-N 3.07Å
638	L	95.7	Very high	92.7	Very high	84 Å²	84	50.6 Å²	50.6	44%	0.44	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-42.6	175.3	179.5	62.4	0	0	0	111.2	V520 A634 L635 V641 I642	V520-L638 HydrophobicContact CG1-CD2 3.86Å; V520-L638 HydrophobicContact CG1-CG 4.17Å; A634-L638 VanDerWaalsContact O-CB 3.31Å; A634-L638 WeakPolarHBondContact O-CB 3.34Å; A634-L638 PolarHBondContact O-N 2.93Å; L635-L638 PolarHBondContact O-N 2.97Å; L638-V641 PolarHBondContact O-N 3.34Å; L638-I642 HydrophobicContact CD1-CD1 4.06Å; L638-I642 HydrophobicContact CD1-CG1 4.41Å; L638-I642 HydrophobicContact CD2-CD1 4.5Å; L638-I642 HydrophobicContact CG-CD1 3.81Å; L638-I642 WeakPolarHBondContact O-CG1 3.48Å; L638-I642 PolarHBondContact O-N 3.28Å
639	G	94.3	Very high	91.6	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-47.7	174.1	0	0	0	0	0	112.1	L635 V636 I637 V641 I642 F643	L635-G639 PolarHBondContact O-N 2.9Å; V636-G639 PolarHBondContact O-N 3.24Å; I637-G639 VanDerWaalsContact C-N 3.28Å; I637-G639 PolarHBondContact O-N 3.46Å; G639-V641 VanDerWaalsContact C-N 3.31Å; G639-V641 PolarHBondContact O-N 2.86Å; G639-I642 PolarHBondContact O-N 2.92Å; G639-F643 VanDerWaalsContact O-CD2 3.25Å; G639-F643 WeakPolarHBondContact O-CD2 3.43Å; G639-F643 PolarHBondContact O-N 3.47Å
640	I	94.5	Very high	90.3	Very high	46 Å²	46	54 Å²	54	24%	0.236	30%	0.295	C	S	.	.	H	α-helix	trans	-58.1	-44.7	177.2	-68.1	165.6	0	0	0	110.9	W462 L465 V636 I637 F643 K644	W462-I640 HydrophobicContact CB-CG2 4.09Å; W462-I640 HydrophobicContact CD2-CG2 4.39Å; W462-I640 HydrophobicContact CE3-CG2 4.4Å; W462-I640 HydrophobicContact CG-CG2 4.27Å; L465-I640 HydrophobicContact CD2-CG1 4.47Å; V636-I640 HydrophobicContact CG1-CD1 4.19Å; V636-I640 WeakPolarHBondContact O-CG1 3.29Å; V636-I640 PolarHBondContact O-N 2.85Å; I637-I640 PolarHBondContact O-N 3.44Å; I640-F643 PolarHBondContact O-N 3.11Å; I640-K644 WeakPolarHBondContact O-CB 3.33Å; I640-K644 PolarHBondContact O-N 2.9Å
641	V	94.9	Very high	88.4	Confident	78 Å²	78	54.6 Å²	54.6	47%	0.473	29%	0.293	S	S	.	.	H	α-helix	trans	-61.5	-48.3	177.3	174	0	0	0	0	110.8	I637 L638 G639 F643 K644 V645	I637-V641 WeakPolarHBondContact O-CG2 3.35Å; I637-V641 PolarHBondContact O-N 3.07Å; L638-V641 PolarHBondContact O-N 3.34Å; G639-V641 VanDerWaalsContact C-N 3.31Å; G639-V641 PolarHBondContact O-N 2.86Å; V641-F643 PolarHBondContact O-N 2.56Å; V641-K644 PolarHBondContact O-N 3.49Å; V641-V645 HydrophobicContact CG1-CG2 4.4Å; V641-V645 VanDerWaalsContact O-CG2 3.32Å; V641-V645 WeakPolarHBondContact O-CG2 3.19Å; V641-V645 PolarHBondContact O-N 3.16Å
642	I	94	Very high	85.7	Confident	25 Å²	25	58 Å²	58	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-44.3	179.3	-72.6	161.9	0	0	0	111.3	V520 I524 L638 G639 K644 V645 R646	V520-I642 HydrophobicContact CB-CD1 4.34Å; V520-I642 HydrophobicContact CG1-CD1 3.42Å; V520-I642 VanDerWaalsContact CG1-CD1 3.42Å; I524-I642 HydrophobicContact CD1-CD1 3.82Å; I524-I642 HydrophobicContact CD1-CG1 4.4Å; I524-I642 HydrophobicContact CG1-CD1 4.04Å; I524-I642 HydrophobicContact CG1-CG1 4.3Å; I524-I642 HydrophobicContact CG1-CG2 3.7Å; L638-I642 HydrophobicContact CD1-CD1 4.06Å; L638-I642 HydrophobicContact CD1-CG1 4.41Å; L638-I642 HydrophobicContact CD2-CD1 4.5Å; L638-I642 HydrophobicContact CG-CD1 3.81Å; L638-I642 WeakPolarHBondContact O-CG1 3.48Å; L638-I642 PolarHBondContact O-N 3.28Å; G639-I642 PolarHBondContact O-N 2.92Å; I642-K644 VanDerWaalsContact C-N 3.32Å; I642-K644 PolarHBondContact O-N 2.82Å; I642-V645 CarbonylContact O-C 3.55Å; I642-V645 PolarHBondContact O-N 2.72Å; I642-R646 VanDerWaalsContact O-CB 3.3Å; I642-R646 WeakPolarHBondContact O-CB 3.22Å; I642-R646 PolarHBondContact O-N 3.1Å
643	F	92	Very high	85.2	Confident	3 Å²	3	59.8 Å²	59.8	1%	0.013	31%	0.314	C	S	.	.	H	α-helix	trans	-69.9	-31	179.9	-84.4	-102.9	0	0	0	112.3	F443 R447 K461 W462 L465 G639 I640 V641 R646 D647	F443-F643 AromaticContact CE1-CE1 3.95Å; F443-F643 HydrophobicContact CE1-CE1 3.95Å; F443-F643 AromaticContact CE1-CZ 3.49Å; F443-F643 HydrophobicContact CE1-CZ 3.49Å; F443-F643 VanDerWaalsContact CE1-CZ 3.49Å; F443-F643 AromaticContact CZ-CE1 3.71Å; F443-F643 HydrophobicContact CZ-CE1 3.71Å; F443-F643 HydrophobicContact CZ-CE2 4.45Å; F443-F643 AromaticContact CZ-CZ 3.49Å; F443-F643 HydrophobicContact CZ-CZ 3.49Å; F443-F643 VanDerWaalsContact CZ-CZ 3.49Å; R447-F643 HydrophobicContact CG-CE1 4.33Å; K461-F643 HydrophobicContact CB-CB 4.48Å; K461-F643 HydrophobicContact CB-CD1 4.23Å; W462-F643 HydrophobicContact CB-CB 4.12Å; L465-F643 HydrophobicContact CB-CD1 4.48Å; L465-F643 HydrophobicContact CB-CD2 4.47Å; L465-F643 HydrophobicContact CB-CG 4.34Å; L465-F643 HydrophobicContact CD1-CD2 4.35Å; L465-F643 HydrophobicContact CD1-CE2 3.95Å; L465-F643 HydrophobicContact CD1-CZ 4.28Å; L465-F643 HydrophobicContact CD2-CD2 3.71Å; L465-F643 HydrophobicContact CD2-CE2 4.12Å; L465-F643 HydrophobicContact CD2-CG 4.2Å; L465-F643 HydrophobicContact CG-CD2 4.39Å; L465-F643 HydrophobicContact CG-CE2 4.48Å; G639-F643 VanDerWaalsContact O-CD2 3.25Å; G639-F643 WeakPolarHBondContact O-CD2 3.43Å; G639-F643 PolarHBondContact O-N 3.47Å; I640-F643 PolarHBondContact O-N 3.11Å; V641-F643 PolarHBondContact O-N 2.56Å; F643-R646 PolarHBondContact O-N 3.4Å; F643-D647 PolarHBondContact O-N 2.01Å
644	K	91.2	Very high	84.6	Confident	144 Å²	144	59.3 Å²	59.3	63%	0.626	31%	0.307	S	S	*	.	H	α-helix	trans	-67.8	-40.7	170.9	-167.5	174	-176.2	176.6	0	111.7	I640 V641 I642 D647 Y648	I640-K644 WeakPolarHBondContact O-CB 3.33Å; I640-K644 PolarHBondContact O-N 2.9Å; V641-K644 PolarHBondContact O-N 3.49Å; I642-K644 VanDerWaalsContact C-N 3.32Å; I642-K644 PolarHBondContact O-N 2.82Å; K644-D647 WeakPolarHBondContact O-CB 3.42Å; K644-D647 PolarHBondContact O-N 3.28Å; K644-Y648 PolarHBondContact O-N 3.44Å
645	V	89.4	Confident	84	Confident	73 Å²	73	59.5 Å²	59.5	44%	0.442	30%	0.299	S	S	.	.	H	α-helix	trans	-67.8	-38.2	173.4	173.1	0	0	0	0	111.1	V641 I642 D647 Y648 L649	V641-V645 HydrophobicContact CG1-CG2 4.4Å; V641-V645 VanDerWaalsContact O-CG2 3.32Å; V641-V645 WeakPolarHBondContact O-CG2 3.19Å; V641-V645 PolarHBondContact O-N 3.16Å; I642-V645 CarbonylContact O-C 3.55Å; I642-V645 PolarHBondContact O-N 2.72Å; V645-D647 VanDerWaalsContact C-N 3.3Å; V645-D647 PolarHBondContact O-N 3.29Å; V645-Y648 CarbonylContact O-C 3.3Å; V645-Y648 WeakPolarHBondContact O-CA 3.22Å; V645-Y648 VanDerWaalsContact O-CB 3.31Å; V645-Y648 WeakPolarHBondContact O-CB 3.3Å; V645-Y648 PolarHBondContact O-N 3.32Å; V645-Y648 VanDerWaalsContact O-N 3.08Å; V645-L649 HydrophobicContact CG1-CD1 3.89Å; V645-L649 HydrophobicContact CG1-CG 4.11Å; V645-L649 WeakPolarHBondContact O-CG 3.03Å; V645-L649 PolarHBondContact O-N 3.4Å
646	R	86.4	Confident	83.3	Confident	13 Å²	13	61.6 Å²	61.6	5%	0.049	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-39.2	175.9	-178.6	-168.1	177.9	114.8	-3.5	111.7	D451 L522 G523 I642 F643 Y648 L649 I650	D451-R646 IonicContact OD1-CZ 3.31Å; D451-R646 IonicContact OD1-NE 3.77Å; D451-R646 PolarHBondContact OD1-NE 2.8Å; D451-R646 VanDerWaalsContact OD1-NE 3.16Å; D451-R646 IonicContact OD1-NH2 3.53Å; D451-R646 IonicContact OD2-CZ 2.71Å; D451-R646 IonicContact OD2-NE 3.88Å; D451-R646 IonicContact OD2-NH2 3.39Å; D451-R646 PolarHBondContact OD2-NH2 3.32Å; L522-R646 PolarHBondContact O-NH1 2.95Å; L522-R646 VanDerWaalsContact O-NH1 3.07Å; G523-R646 PolarHBondContact O-NH1 3.23Å; I642-R646 VanDerWaalsContact O-CB 3.3Å; I642-R646 WeakPolarHBondContact O-CB 3.22Å; I642-R646 PolarHBondContact O-N 3.1Å; F643-R646 PolarHBondContact O-N 3.4Å; R646-Y648 PolarHBondContact O-N 3.03Å; R646-L649 PolarHBondContact O-N 2.93Å; R646-I650 HydrophobicContact CG-CD1 3.69Å; R646-I650 HydrophobicContact CG-CG1 4.24Å; R646-I650 WeakPolarHBondContact O-CB 3.36Å; R646-I650 WeakPolarHBondContact O-CG1 3.41Å; R646-I650 PolarHBondContact O-N 3.36Å
647	D	80.2	Confident	82.6	Confident	37 Å²	37	64 Å²	64	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-57.3	-43	174	-153.7	14.6	0	0	0	110.3	S454 H460 K461 F643 K644 V645 S651	S454-D647 PolarHBondContact OG-OD1 2.88Å; H460-D647 IonicContact ND1-OD2 3.78Å; K461-D647 HydrophobicContact CD-CB 4.05Å; K461-D647 WeakPolarHBondContact CE-OD1 3.29Å; K461-D647 HydrophobicContact CG-CB 4.25Å; F643-D647 PolarHBondContact O-N 2.01Å; K644-D647 WeakPolarHBondContact O-CB 3.42Å; K644-D647 PolarHBondContact O-N 3.28Å; V645-D647 VanDerWaalsContact C-N 3.3Å; V645-D647 PolarHBondContact O-N 3.29Å; D647-S651 VanDerWaalsContact O-CB 3.31Å; D647-S651 WeakPolarHBondContact O-CB 3.48Å; D647-S651 PolarHBondContact O-N 3.17Å; D647-S651 VanDerWaalsContact O-N 3.1Å; D647-S651 PolarHBondContact O-OG 3.43Å
648	Y	76.7	Confident	81.7	Confident	91 Å²	91	61.1 Å²	61.1	36%	0.357	30%	0.304	S	S	.	.	H	α-helix	trans	-69.9	-36	174.3	-166.3	-112.7	0	0	0	114.2	K644 V645 R646 S651 R652	K644-Y648 PolarHBondContact O-N 3.44Å; V645-Y648 CarbonylContact O-C 3.3Å; V645-Y648 WeakPolarHBondContact O-CA 3.22Å; V645-Y648 VanDerWaalsContact O-CB 3.31Å; V645-Y648 WeakPolarHBondContact O-CB 3.3Å; V645-Y648 PolarHBondContact O-N 3.32Å; V645-Y648 VanDerWaalsContact O-N 3.08Å; R646-Y648 PolarHBondContact O-N 3.03Å; Y648-S651 WeakPolarHBondContact CA-OG 3.45Å; Y648-S651 PolarHBondContact O-OG 3.38Å; Y648-R652 HydrophobicContact CD1-CG 4.21Å; Y648-R652 VanDerWaalsContact CE1-CD 3.4Å; Y648-R652 HydrophobicContact CE1-CG 3.96Å; Y648-R652 HydrophobicContact CE2-CG 4.4Å; Y648-R652 WeakPolarHBondContact O-CB 3.44Å; Y648-R652 VanDerWaalsContact O-CG 3.31Å; Y648-R652 WeakPolarHBondContact O-CG 3.44Å; Y648-R652 PolarHBondContact O-N 3.3Å; Y648-R652 PolarHBondContact OH-NE 2.81Å; Y648-R652 PolarHBondContact OH-NH2 2.62Å
649	L	72.9	Confident	80.7	Confident	109 Å²	109	59.4 Å²	59.4	57%	0.571	29%	0.294	S	S	*	.	H	α-helix	trans	-75.5	-28.7	180	-74.7	172.3	0	0	0	113.8	V645 R646 R652	V645-L649 HydrophobicContact CG1-CD1 3.89Å; V645-L649 HydrophobicContact CG1-CG 4.11Å; V645-L649 WeakPolarHBondContact O-CG 3.03Å; V645-L649 PolarHBondContact O-N 3.4Å; R646-L649 PolarHBondContact O-N 2.93Å; L649-R652 VanDerWaalsContact O-OXT 3.05Å
650	I	68.7	Low	79.7	Confident	38 Å²	38	63.9 Å²	63.9	20%	0.195	32%	0.316	C	S	.	.	H	α-helix	trans	-86.5	-28	177.2	-68.5	177.2	0	0	0	110.7	D451 K461 R646	D451-I650 WeakPolarHBondContact OD1-CD1 3.06Å; K461-I650 VanDerWaalsContact NZ-CD1 3.33Å; R646-I650 HydrophobicContact CG-CD1 3.69Å; R646-I650 HydrophobicContact CG-CG1 4.24Å; R646-I650 WeakPolarHBondContact O-CB 3.36Å; R646-I650 WeakPolarHBondContact O-CG1 3.41Å; R646-I650 PolarHBondContact O-N 3.36Å
651	S	57.1	Low	78.4	Confident	51 Å²	51	65.4 Å²	65.4	36%	0.357	32%	0.323	S	S	.	.	H	α-helix	trans	-82.3	-22.7	170.4	58.3	0	0	0	0	113.6	R106 D647 Y648	R106-S651 PolarHBondContact N-O 3.03Å; D647-S651 VanDerWaalsContact O-CB 3.31Å; D647-S651 WeakPolarHBondContact O-CB 3.48Å; D647-S651 PolarHBondContact O-N 3.17Å; D647-S651 VanDerWaalsContact O-N 3.1Å; D647-S651 PolarHBondContact O-OG 3.43Å; Y648-S651 WeakPolarHBondContact CA-OG 3.45Å; Y648-S651 PolarHBondContact O-OG 3.38Å
652	R	37.6	Very low	76.9	Confident	123 Å²	123	64.3 Å²	64.3	46%	0.464	31%	0.309	S	S	.	.			trans	-78	0	165.4	-86.9	-166.1	165.5	178	4.8	111.3	R105 R106 T107 Y648 L649	R105-R652 CarbonylContact C-O 3.58Å; R105-R652 WeakPolarHBondContact CA-O 3.47Å; R105-R652 WeakPolarHBondContact CB-O 3.23Å; R105-R652 WeakPolarHBondContact CD-OXT 3.28Å; R105-R652 WeakPolarHBondContact CG-O 3.38Å; R105-R652 WeakPolarHBondContact CG-OXT 3.3Å; R106-R652 HydrophobicContact CB-CG 4.2Å; R106-R652 PolarHBondContact N-O 3.19Å; T107-R652 WeakPolarHBondContact CG2-O 3.12Å; T107-R652 PolarHBondContact N-O 3.08Å; T107-R652 PolarHBondContact OG1-O 3.33Å; Y648-R652 HydrophobicContact CD1-CG 4.21Å; Y648-R652 VanDerWaalsContact CE1-CD 3.4Å; Y648-R652 HydrophobicContact CE1-CG 3.96Å; Y648-R652 HydrophobicContact CE2-CG 4.4Å; Y648-R652 WeakPolarHBondContact O-CB 3.44Å; Y648-R652 VanDerWaalsContact O-CG 3.31Å; Y648-R652 WeakPolarHBondContact O-CG 3.44Å; Y648-R652 PolarHBondContact O-N 3.3Å; Y648-R652 PolarHBondContact OH-NE 2.81Å; Y648-R652 PolarHBondContact OH-NH2 2.62Å; L649-R652 VanDerWaalsContact O-OXT 3.05Å

Retrieved 652 of 652 residues in 173.7 ms (Link to these results)

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