Q99N72_MOUSE Loading...

Mcf2 proto-oncogene protein

AlphaFold DB , UniProt , Accession Q99N72, Species MOUSE (Mus musculus, Mouse), Gene Mcf2, Length 928 aa.

						>Q99N72_MOUSE|Q99N72|Mcf2
MAVANPPRGKMRFRRNAASFPGSLHLVLVLRPTSFLQRTFTDIGFRFSQEDFMLKLPVVMLSSVSDLLTYIDDKQLTPELGGTLQYCHSEWIIFRNAIEKFAVTVKEMAQMLQSFGTELAETELPQDILSIEEILAGRAERYHLLKNDLTAVTKEGKVLLMNLQVPATEETVSSSLECTQHINGDWQTIKKLLAQVHDMETAFDGFWEKHQLKMEQYLQLWKFEQDFQEAVTQVEFLLSQQRELGDITGNLAQVKQRLKKLEILDDKSQELLTKARIVILRGHKLASNHHYALDLICQRCNELRYLSDILVNEIRTKRVQLSRTFKVHRLLQQARQCCDQGECLLASQGMDKFQTKEDAQKALQDVDNFLQMAMPFINYDIESLQYEFDVLLSPELKAQMQNIQLKLENIRSAFQNQQAGCKSLKEVPEGAFQNLVPASENVMRSRMIFFSPKHVKKSWRQIRAQSNVKVEAVEDSQEKNSDQSPKLDNSLDILKNHVLDELIQTERAYVRELFTVLLGYRSEMDNPQMFDLMPPLLRNKKDVLFGNMAEIYEFHNNIFMSRLEDCSDAPERVGPCFLERKDDFQMYAKYCQNKPRSELIWRKYSECAFFQECQRKLKHRLGLDSYLLKPVQRITKYQLLLKELLKYSKEGEGTTKLKEALDSMLELLKSVNDSMHQTAINAYVGNINELGKMVLQGSFNVWLGHRKGATKMKDFARFKPMQRHLFLYEKAVMFCKRRFESGEGADRYPSYSFKHCLKMEDVGITEHVKGDNRKFEIRYSEKEEIYIVQAPNVDVKMLWLKEIRKILVQQKELMTAKTQQDQALDQDQLFPQQQNAELCKSSPFCVCEETLFNATEAGAEVEQAGALIKVREAAVLAQAEASSAAWNGMLPSAEGAAAIAEHSYNYFSSNNDHGEDRTQMRHMSEVTF
					

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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	27.9	Very low	32.5	Very low	163 Å²	163	126 Å²	126	80%	0.803	72%	0.72	S	S	*	*				0	166.9	0	-66.9	164.2	-179.3	0	0	109.5	L76 L80	M1-L76 HydrophobicContact CE-CD2 3.48Å; M1-L76 VanDerWaalsContact CE-CD2 3.48Å; M1-L80 HydrophobicContact CE-CD1 3.55Å; M1-L80 HydrophobicContact SD-CD1 3.41Å; M1-L80 WeakPolarHBondContact SD-CD1 3.47Å
2	A	27.4	Very low	32.9	Very low	75 Å²	75	133.8 Å²	133.8	62%	0.62	73%	0.729	S	S	*	*			trans	-125.8	110	170.9	0	0	0	0	0	109.4	A4	A2-A4 PolarHBondContact O-N 3.05Å
3	V	26.8	Very low	33.6	Very low	139 Å²	139	133.4 Å²	133.4	84%	0.842	72%	0.717	S	S	*	*			trans	-76.3	106.9	-178.1	179.9	0	0	0	0	109.4	N5	V3-N5 PolarHBondContact O-N 3.08Å
4	A	28.3	Very low	33.6	Very low	63 Å²	63	139.8 Å²	139.8	52%	0.521	73%	0.726	S	S	.	*			trans	-89.7	89.3	-176.7	0	0	0	0	0	111.5	A2 M11	A2-A4 PolarHBondContact O-N 3.05Å; A4-M11 HydrophobicContact CB-CE 3.94Å
5	N	33.9	Very low	34.1	Very low	149 Å²	149	147 Å²	147	80%	0.797	74%	0.74	S	S	*	*			trans	-135.3	61.3	173	-139.8	-5.1	0	0	0	115.6	V3	V3-N5 PolarHBondContact O-N 3.08Å
6	P	32.3	Very low	34.3	Very low	81 Å²	81	144.6 Å²	144.6	53%	0.526	73%	0.729	S	S	.	*			trans	-94.3	129.6	167.7	35.1	-29.6	0	0	0	111.8	R8	P6-R8 VanDerWaalsContact C-N 3.28Å; P6-R8 PolarHBondContact O-N 2.97Å
7	P	35.7	Very low	34.4	Very low	125 Å²	125	140.2 Å²	140.2	81%	0.812	72%	0.721	S	S	*	*	S	Bend	trans	-78.9	67.5	-178	33	-36.7	0	0	0	112.7
8	R	36.6	Very low	34.5	Very low	235 Å²	235	138.1 Å²	138.1	89%	0.887	73%	0.728	S	S	*	*	S	Bend	trans	-179.7	78.8	161.4	-98.1	148.5	-167.2	-157.3	4.9	112.9	P6 K10	P6-R8 VanDerWaalsContact C-N 3.28Å; P6-R8 PolarHBondContact O-N 2.97Å; R8-K10 VanDerWaalsContact C-N 3.29Å; R8-K10 PolarHBondContact O-N 3.06Å
9	G	37.1	Very low	34.9	Very low	86 Å²	86	134.7 Å²	134.7	89%	0.887	72%	0.717	S	S	*	*	S	Bend	trans	56.6	1.4	141.6	0	0	0	0	0	122.4
10	K	34	Very low	35.3	Very low	171 Å²	171	134 Å²	134	74%	0.743	71%	0.707	S	S	*	*			trans	-138.5	111.2	176.6	-68.9	-167.4	175.8	-169.8	0	111.4	R8 R12	R8-K10 VanDerWaalsContact C-N 3.29Å; R8-K10 PolarHBondContact O-N 3.06Å; K10-R12 PolarHBondContact O-N 3.4Å; K10-R12 VanDerWaalsContact O-N 3.07Å
11	M	37.9	Very low	35.6	Very low	99 Å²	99	134.4 Å²	134.4	49%	0.488	72%	0.718	S	S	.	*			trans	-65.2	104.8	167.5	-77.4	-175.6	172.7	0	0	109.5	A4 F13 F45	A4-M11 HydrophobicContact CB-CE 3.94Å; M11-F13 PolarHBondContact O-N 2.98Å; M11-F13 HydrophobicContact SD-CE2 4.42Å; M11-F45 HydrophobicContact SD-CE2 4.23Å
12	R	36.7	Very low	36.7	Very low	219 Å²	219	129.1 Å²	129.1	83%	0.826	71%	0.705	S	S	*	*			trans	-92.4	84.1	172	-79.7	-178	164.1	175.9	-4.1	110.2	K10 R14	K10-R12 PolarHBondContact O-N 3.4Å; K10-R12 VanDerWaalsContact O-N 3.07Å; R12-R14 PolarHBondContact O-N 3.33Å
13	F	42	Very low	37.8	Very low	129 Å²	129	130.2 Å²	130.2	57%	0.566	71%	0.708	S	S	*	*			trans	-65.6	87.2	157.1	-78.7	-79.7	0	0	0	108.6	M11 F52	M11-F13 PolarHBondContact O-N 2.98Å; M11-F13 HydrophobicContact SD-CE2 4.42Å; F13-F52 HydrophobicContact CD2-CZ 4.44Å
14	R	34.1	Very low	39.3	Very low	223 Å²	223	127.7 Å²	127.7	84%	0.842	69%	0.689	S	S	*	*			trans	-61.6	136.9	171.6	-105.3	-176.7	167.8	179.7	-4.4	108.6	R12 N16	R12-R14 PolarHBondContact O-N 3.33Å; R14-N16 PolarHBondContact O-N 3.36Å
15	R	40.4	Very low	40.8	Very low	248 Å²	248	131.5 Å²	131.5	94%	0.936	70%	0.696	S	S	*	*	S	Bend	trans	-45.2	111	171.9	-71.9	178.1	175	167.1	-2.2	110.1
16	N	36.9	Very low	42.4	Very low	108 Å²	108	128 Å²	128	58%	0.578	68%	0.677	S	S	*	*			trans	-163.9	46.5	167.6	-104.8	0.8	0	0	0	111.4	R14 A18 S19	R14-N16 PolarHBondContact O-N 3.36Å; N16-A18 PolarHBondContact O-N 2.9Å; N16-S19 WeakPolarHBondContact CB-OG 3.15Å; N16-S19 PolarHBondContact ND2-OG 3.09Å; N16-S19 WeakPolarHBondContact O-CB 3.46Å; N16-S19 PolarHBondContact O-N 3.26Å
17	A	37.1	Very low	44.3	Very low	71 Å²	71	126.3 Å²	126.3	59%	0.587	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-60	-24.4	172.9	0	0	0	0	0	112.6	S19	A17-S19 PolarHBondContact O-N 2.94Å
18	A	35.8	Very low	46.1	Very low	102 Å²	102	122.4 Å²	122.4	84%	0.843	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-74.2	-3.6	174.3	0	0	0	0	0	114.6	N16	N16-A18 PolarHBondContact O-N 2.9Å
19	S	41.2	Very low	47.9	Very low	74 Å²	74	112.2 Å²	112.2	52%	0.517	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-97.6	0.5	-178.3	-54.9	0	0	0	0	114.2	N16 A17	N16-S19 WeakPolarHBondContact CB-OG 3.15Å; N16-S19 PolarHBondContact ND2-OG 3.09Å; N16-S19 WeakPolarHBondContact O-CB 3.46Å; N16-S19 PolarHBondContact O-N 3.26Å; A17-S19 PolarHBondContact O-N 2.94Å
20	F	44.2	Very low	49.6	Very low	119 Å²	119	111.6 Å²	111.6	52%	0.522	58%	0.577	S	S	.	*	S	Bend	trans	-104.1	123.2	175	-70.7	-82.3	0	0	0	109.7	G22 L24	F20-G22 PolarHBondContact O-N 3.35Å; F20-L24 HydrophobicContact CD2-CD1 4.43Å
21	P	40.2	Very low	51.2	Low	144 Å²	144	105.8 Å²	105.8	94%	0.935	55%	0.55	S	S	*	*	S	Bend	trans	-78.9	25.2	-169.2	32.8	-37.6	0	0	0	114.6
22	G	52.4	Low	52.4	Low	51 Å²	51	102.7 Å²	102.7	53%	0.526	54%	0.538	S	S	.	.	S	Bend	trans	-166.3	162.7	179.8	0	0	0	0	0	112.1	F20 L24	F20-G22 PolarHBondContact O-N 3.35Å; G22-L24 PolarHBondContact O-N 3.27Å
23	S	50.6	Low	53.4	Low	99 Å²	99	99.1 Å²	99.1	69%	0.692	54%	0.541	S	S	*	.			trans	-58.5	119.1	175.4	-57.4	0	0	0	0	110.7	H25	S23-H25 VanDerWaalsContact CB-CE1 3.44Å; S23-H25 WeakPolarHBondContact CB-CE1 3.44Å; S23-H25 PolarHBondContact O-CE1 2.89Å; S23-H25 VanDerWaalsContact O-CE1 3.31Å; S23-H25 PolarHBondContact O-ND1 3.07Å
24	L	57.8	Low	54.2	Low	86 Å²	86	95.6 Å²	95.6	45%	0.45	53%	0.532	S	S	.	.			trans	-70	134.2	165.3	-65.5	170.3	0	0	0	108.2	F20 G22 L56	F20-L24 HydrophobicContact CD2-CD1 4.43Å; G22-L24 PolarHBondContact O-N 3.27Å; L24-L56 HydrophobicContact CB-CD1 4.33Å; L24-L56 HydrophobicContact CB-CD2 4.06Å; L24-L56 VanDerWaalsContact O-CD2 3.25Å; L24-L56 WeakPolarHBondContact O-CD2 3.33Å
25	H	59.6	Low	55	Low	143 Å²	143	92.8 Å²	92.8	66%	0.662	53%	0.526	S	S	*	.			trans	-123	-27	-178.8	-63.7	103.5	0	0	0	113.4	S23 P57	S23-H25 VanDerWaalsContact CB-CE1 3.44Å; S23-H25 WeakPolarHBondContact CB-CE1 3.44Å; S23-H25 PolarHBondContact O-CE1 2.89Å; S23-H25 VanDerWaalsContact O-CE1 3.31Å; S23-H25 PolarHBondContact O-ND1 3.07Å; H25-P57 VanDerWaalsContact O-CD 3.27Å; H25-P57 WeakPolarHBondContact O-CD 3.48Å; H25-P57 VanDerWaalsContact O-CG 3.24Å; H25-P57 WeakPolarHBondContact O-CG 3.31Å
26	L	68.6	Low	55.3	Low	75 Å²	75	86.7 Å²	86.7	39%	0.393	51%	0.511	S	S	.	.			trans	-152.5	142.9	-175	179.4	62.3	0	0	0	109.1	L28 P57 V59 Y70	L26-L28 HydrophobicContact CD1-CD2 4.28Å; L26-L28 HydrophobicContact CD2-CD2 3.84Å; L26-L28 HydrophobicContact CD2-CG 4.32Å; L26-L28 HydrophobicContact CG-CD2 3.92Å; L26-L28 HydrophobicContact CG-CG 4.34Å; L26-P57 HydrophobicContact CD1-CB 4.08Å; L26-P57 HydrophobicContact CD1-CG 3.93Å; L26-V59 HydrophobicContact CD1-CG2 3.94Å; L26-Y70 HydrophobicContact CD2-CD1 4.27Å
27	V	72.2	Confident	56.1	Low	46 Å²	46	86.9 Å²	86.9	28%	0.279	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	114.3	172.7	-176	0	0	0	0	109.3	V29 P57 V58 V59	V27-V29 HydrophobicContact CG1-CG2 4.05Å; V27-P57 PolarHBondContact N-O 2.93Å; V27-V58 HydrophobicContact CB-CG1 4.35Å; V27-V58 HydrophobicContact CB-CG2 4.25Å; V27-V58 HydrophobicContact CG1-CG1 4.42Å; V27-V58 CarbonylContact O-C 3.19Å; V27-V58 WeakPolarHBondContact O-CA 3.41Å; V27-V59 PolarHBondContact O-N 3.36Å
28	L	73.4	Confident	57.1	Low	42 Å²	42	87.3 Å²	87.3	22%	0.22	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.3	173.7	-57.6	-176.9	0	0	0	109.6	L26 V59 L61 L67 Y70 I71	L26-L28 HydrophobicContact CD1-CD2 4.28Å; L26-L28 HydrophobicContact CD2-CD2 3.84Å; L26-L28 HydrophobicContact CD2-CG 4.32Å; L26-L28 HydrophobicContact CG-CD2 3.92Å; L26-L28 HydrophobicContact CG-CG 4.34Å; L28-V59 HydrophobicContact CD2-CB 3.8Å; L28-V59 HydrophobicContact CD2-CG1 4.38Å; L28-V59 HydrophobicContact CD2-CG2 4.39Å; L28-L61 HydrophobicContact CB-CD1 4.01Å; L28-L61 HydrophobicContact CD1-CD1 4.39Å; L28-L67 HydrophobicContact CB-CD1 4.25Å; L28-L67 HydrophobicContact CD1-CD1 3.66Å; L28-Y70 HydrophobicContact CD1-CG 4.08Å; L28-Y70 HydrophobicContact CD2-CD1 4.14Å; L28-Y70 HydrophobicContact CD2-CD2 4.41Å; L28-Y70 HydrophobicContact CD2-CG 4.05Å; L28-I71 HydrophobicContact CD1-CD1 3.78Å; L28-I71 HydrophobicContact CD1-CG1 3.91Å
29	V	74.5	Confident	57.7	Low	21 Å²	21	85.5 Å²	85.5	13%	0.127	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	109.4	-179.2	-177.4	0	0	0	0	109.2	V27 R31 F45 V58 V59 M60 L61	V27-V29 HydrophobicContact CG1-CG2 4.05Å; V29-R31 PolarHBondContact O-N 3.38Å; V29-F45 HydrophobicContact CG1-CE2 4.39Å; V29-F45 HydrophobicContact CG2-CZ 4.17Å; V29-V58 HydrophobicContact CG2-CG1 3.9Å; V29-V59 PolarHBondContact N-O 3.15Å; V29-M60 HydrophobicContact CB-CE 4.3Å; V29-M60 HydrophobicContact CB-SD 3.64Å; V29-M60 HydrophobicContact CG1-CE 3.88Å; V29-M60 HydrophobicContact CG1-SD 3.82Å; V29-M60 HydrophobicContact CG2-SD 4.19Å; V29-M60 CarbonylContact O-C 3.59Å; V29-M60 WeakPolarHBondContact O-CA 3.47Å; V29-L61 PolarHBondContact O-N 3.31Å
30	L	72.3	Confident	58.1	Low	74 Å²	74	89.4 Å²	89.4	39%	0.387	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	122.3	173.4	-176.2	67.5	0	0	0	110	L61 S63 V64	L30-L61 HydrophobicContact CD1-CB 4.41Å; L30-S63 VanDerWaalsContact CD1-O 3.24Å; L30-S63 WeakPolarHBondContact CD1-O 3.33Å; L30-V64 HydrophobicContact CD1-CG2 4.26Å; L30-V64 HydrophobicContact CD2-CG2 3.8Å
31	R	68.3	Low	58.6	Low	48 Å²	48	85 Å²	85	18%	0.181	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-68.9	141.8	175.9	-76.4	-177.5	174.8	95.4	3.6	111.7	V29 D42 M60 L61	V29-R31 PolarHBondContact O-N 3.38Å; R31-D42 IonicContact CZ-OD1 3.63Å; R31-D42 IonicContact NE-OD1 3.27Å; R31-D42 PolarHBondContact NE-OD1 3.33Å; R31-D42 IonicContact NE-OD2 3.4Å; R31-D42 PolarHBondContact NE-OD2 3.46Å; R31-D42 IonicContact NH2-OD1 2.69Å; R31-D42 PolarHBondContact NH2-OD1 2.76Å; R31-M60 HydrophobicContact CG-CE 4.02Å; R31-M60 VanDerWaalsContact CZ-CB 3.46Å; R31-M60 PolarHBondContact NH1-O 3.36Å; R31-M60 VanDerWaalsContact NH2-CB 3.32Å; R31-L61 VanDerWaalsContact CB-O 3.3Å; R31-L61 WeakPolarHBondContact CB-O 3.22Å; R31-L61 VanDerWaalsContact CG-O 3.28Å; R31-L61 WeakPolarHBondContact CG-O 3.38Å; R31-L61 PolarHBondContact N-O 3.44Å
32	P	61.6	Low	59.2	Low	35 Å²	35	80.5 Å²	80.5	23%	0.227	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-64.3	143.7	168.6	28.5	-34.2	0	0	0	110.8	S34 Q37 T41	P32-S34 VanDerWaalsContact C-N 3.33Å; P32-S34 PolarHBondContact O-N 3.31Å; P32-Q37 HydrophobicContact CB-CB 3.87Å; P32-Q37 HydrophobicContact CG-CB 3.66Å; P32-T41 HydrophobicContact CG-CG2 4.29Å
33	T	57.2	Low	59.2	Low	144 Å²	144	81.9 Å²	81.9	88%	0.883	43%	0.427	S	S	*	.	S	Bend	trans	-72.3	-24	-178.6	48.8	0	0	0	0	113.3	F35	T33-F35 PolarHBondContact O-N 3.03Å
34	S	60	Low	59.2	Low	55 Å²	55	79 Å²	79	39%	0.385	41%	0.413	S	S	.	.	S	Bend	trans	-74.8	123.8	178.2	-179.1	0	0	0	0	112	P32 L36 Q37 R38	P32-S34 VanDerWaalsContact C-N 3.33Å; P32-S34 PolarHBondContact O-N 3.31Å; S34-L36 VanDerWaalsContact C-N 3.32Å; S34-L36 PolarHBondContact O-N 2.91Å; S34-Q37 PolarHBondContact O-N 3.32Å; S34-R38 PolarHBondContact O-N 3.38Å
35	F	51.6	Low	59.1	Low	164 Å²	164	77.3 Å²	77.3	72%	0.719	40%	0.402	S	S	*	.	H	α-helix	trans	-50.7	-44.8	-176.6	-179.5	-99.5	0	0	0	113.7	T33 R38 T39	T33-F35 PolarHBondContact O-N 3.03Å; F35-R38 PolarHBondContact O-N 3.44Å; F35-T39 PolarHBondContact O-N 2.86Å; F35-T39 PolarHBondContact O-OG1 2.94Å
36	L	46.7	Very low	58.8	Low	119 Å²	119	80.1 Å²	80.1	62%	0.623	41%	0.407	S	S	*	.	H	α-helix	trans	-67.5	-41.8	179.6	-65.7	175.9	0	0	0	112	S34 R38 F40	S34-L36 VanDerWaalsContact C-N 3.32Å; S34-L36 PolarHBondContact O-N 2.91Å; L36-R38 VanDerWaalsContact C-N 3.34Å; L36-F40 VanDerWaalsContact O-CD2 3.24Å; L36-F40 WeakPolarHBondContact O-CD2 3.26Å; L36-F40 PolarHBondContact O-N 2.76Å
37	Q	53.4	Low	57.8	Low	113 Å²	113	85.2 Å²	85.2	53%	0.528	43%	0.426	S	S	.	.	H	α-helix	trans	-64.8	-41	177.8	-67.2	179.1	-23.9	0	0	111.1	P32 S34 T39 F40 T41	P32-Q37 HydrophobicContact CB-CB 3.87Å; P32-Q37 HydrophobicContact CG-CB 3.66Å; S34-Q37 PolarHBondContact O-N 3.32Å; Q37-T39 PolarHBondContact O-N 3.36Å; Q37-F40 PolarHBondContact O-N 3.42Å; Q37-T41 PolarHBondContact O-N 3.03Å; Q37-T41 PolarHBondContact O-OG1 3.44Å; Q37-T41 VanDerWaalsContact O-OG1 3.07Å
38	R	57.3	Low	56.6	Low	80 Å²	80	84.5 Å²	84.5	30%	0.302	42%	0.424	S	S	.	.	H	α-helix	trans	-56.1	-50.8	177.9	-167.3	169.9	179	134	-0.8	111.3	S34 F35 L36 F40 T41 D42 S62	S34-R38 PolarHBondContact O-N 3.38Å; F35-R38 PolarHBondContact O-N 3.44Å; L36-R38 VanDerWaalsContact C-N 3.34Å; R38-F40 PolarHBondContact O-N 3.22Å; R38-T41 WeakPolarHBondContact CA-OG1 3.42Å; R38-T41 PolarHBondContact O-N 3.47Å; R38-T41 PolarHBondContact O-OG1 2.87Å; R38-D42 PolarHBondContact O-N 3.23Å; R38-S62 PolarHBondContact NH2-OG 2.86Å
39	T	49.4	Very low	55.4	Low	64 Å²	64	89.7 Å²	89.7	39%	0.393	45%	0.447	S	S	.	.	H	α-helix	trans	-60.4	-43.8	176.8	-55.4	0	0	0	0	112.5	F35 Q37 T41 I43	F35-T39 PolarHBondContact O-N 2.86Å; F35-T39 PolarHBondContact O-OG1 2.94Å; Q37-T39 PolarHBondContact O-N 3.36Å; T39-T41 PolarHBondContact O-N 3.34Å; T39-I43 HydrophobicContact CG2-CD1 3.94Å; T39-I43 WeakPolarHBondContact O-CB 3.42Å; T39-I43 VanDerWaalsContact O-CG1 3.27Å; T39-I43 WeakPolarHBondContact O-CG1 3.31Å; T39-I43 PolarHBondContact O-N 3.06Å; T39-I43 VanDerWaalsContact O-N 3.09Å
40	F	48.5	Very low	54.1	Low	155 Å²	155	97.6 Å²	97.6	68%	0.68	48%	0.482	S	S	*	.	H	α-helix	trans	-66.3	-33.8	175.7	-80.7	-65.3	0	0	0	113.2	L36 Q37 R38 G44	L36-F40 VanDerWaalsContact O-CD2 3.24Å; L36-F40 WeakPolarHBondContact O-CD2 3.26Å; L36-F40 PolarHBondContact O-N 2.76Å; Q37-F40 PolarHBondContact O-N 3.42Å; R38-F40 PolarHBondContact O-N 3.22Å; F40-G44 PolarHBondContact O-N 3.37Å
41	T	55.4	Low	52.8	Low	28 Å²	28	100.9 Å²	100.9	17%	0.172	50%	0.5	C	S	.	.	H	α-helix	trans	-70.4	-45.4	175	44.2	0	0	0	0	113.3	P32 Q37 R38 T39 I43 G44 F45	P32-T41 HydrophobicContact CG-CG2 4.29Å; Q37-T41 PolarHBondContact O-N 3.03Å; Q37-T41 PolarHBondContact O-OG1 3.44Å; Q37-T41 VanDerWaalsContact O-OG1 3.07Å; R38-T41 WeakPolarHBondContact CA-OG1 3.42Å; R38-T41 PolarHBondContact O-N 3.47Å; R38-T41 PolarHBondContact O-OG1 2.87Å; T39-T41 PolarHBondContact O-N 3.34Å; T41-I43 VanDerWaalsContact C-N 3.3Å; T41-I43 PolarHBondContact O-N 3Å; T41-G44 PolarHBondContact O-N 3.43Å; T41-F45 PolarHBondContact O-N 2.84Å; T41-F45 VanDerWaalsContact O-N 3.09Å
42	D	53	Low	51.8	Low	48 Å²	48	103.7 Å²	103.7	26%	0.257	51%	0.514	S	S	.	.	H	α-helix	trans	-66.6	-31.9	179	-73	-53.2	0	0	0	111.1	R31 R38 R46	R31-D42 IonicContact CZ-OD1 3.63Å; R31-D42 IonicContact NE-OD1 3.27Å; R31-D42 PolarHBondContact NE-OD1 3.33Å; R31-D42 IonicContact NE-OD2 3.4Å; R31-D42 PolarHBondContact NE-OD2 3.46Å; R31-D42 IonicContact NH2-OD1 2.69Å; R31-D42 PolarHBondContact NH2-OD1 2.76Å; R38-D42 PolarHBondContact O-N 3.23Å; D42-R46 WeakPolarHBondContact O-CG 3.11Å; D42-R46 PolarHBondContact O-N 2.85Å
43	I	51.5	Low	50.9	Low	80 Å²	80	110.6 Å²	110.6	41%	0.41	55%	0.545	S	S	.	.	H	α-helix	trans	-69.4	-45.9	170.5	-69.4	170.3	0	0	0	111.4	T39 T41 F45 R46 F47	T39-I43 HydrophobicContact CG2-CD1 3.94Å; T39-I43 WeakPolarHBondContact O-CB 3.42Å; T39-I43 VanDerWaalsContact O-CG1 3.27Å; T39-I43 WeakPolarHBondContact O-CG1 3.31Å; T39-I43 PolarHBondContact O-N 3.06Å; T39-I43 VanDerWaalsContact O-N 3.09Å; T41-I43 VanDerWaalsContact C-N 3.3Å; T41-I43 PolarHBondContact O-N 3Å; I43-F45 VanDerWaalsContact C-N 3.31Å; I43-F45 PolarHBondContact O-N 3.28Å; I43-R46 PolarHBondContact O-N 3.35Å; I43-F47 HydrophobicContact CG2-CD2 3.83Å; I43-F47 HydrophobicContact CG2-CE2 4.03Å; I43-F47 WeakPolarHBondContact O-CD2 3.35Å; I43-F47 PolarHBondContact O-N 3.42Å
44	G	51.5	Low	50.5	Low	38 Å²	38	109 Å²	109	39%	0.392	53%	0.531	S	S	.	.	H	α-helix	trans	-60	-37.3	-178.5	0	0	0	0	0	113.8	F40 T41 S48	F40-G44 PolarHBondContact O-N 3.37Å; T41-G44 PolarHBondContact O-N 3.43Å; G44-S48 PolarHBondContact O-N 3.1Å; G44-S48 PolarHBondContact O-OG 2.91Å
45	F	55.1	Low	50.2	Low	52 Å²	52	117 Å²	117	23%	0.228	56%	0.558	C	S	.	*	H	α-helix	trans	-69.1	-42.7	174.1	-94.9	-85.1	0	0	0	112.6	M11 V29 T41 I43 F47 S48 Q49 V58 M60	M11-F45 HydrophobicContact SD-CE2 4.23Å; V29-F45 HydrophobicContact CG1-CE2 4.39Å; V29-F45 HydrophobicContact CG2-CZ 4.17Å; T41-F45 PolarHBondContact O-N 2.84Å; T41-F45 VanDerWaalsContact O-N 3.09Å; I43-F45 VanDerWaalsContact C-N 3.31Å; I43-F45 PolarHBondContact O-N 3.28Å; F45-F47 VanDerWaalsContact C-N 3.27Å; F45-F47 PolarHBondContact O-N 3.08Å; F45-S48 PolarHBondContact O-N 3.09Å; F45-S48 VanDerWaalsContact O-N 3.16Å; F45-S48 PolarHBondContact O-OG 3.46Å; F45-Q49 PolarHBondContact O-N 2.91Å; F45-V58 HydrophobicContact CE1-CG1 4.23Å; F45-M60 HydrophobicContact CD2-CE 4.46Å; F45-M60 HydrophobicContact CD2-SD 4.37Å; F45-M60 HydrophobicContact CE2-SD 4.36Å
46	R	52.9	Low	50.5	Low	201 Å²	201	111.5 Å²	111.5	76%	0.758	54%	0.536	S	S	*	.	H	α-helix	trans	-59.8	-34.4	177.9	-74.2	178.5	-178.4	-163.5	0.9	113.3	D42 I43	D42-R46 WeakPolarHBondContact O-CG 3.11Å; D42-R46 PolarHBondContact O-N 2.85Å; I43-R46 PolarHBondContact O-N 3.35Å
47	F	47.1	Very low	51.2	Low	182 Å²	182	109.1 Å²	109.1	80%	0.798	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	4	178.9	-77.8	-73.8	0	0	0	115	I43 F45	I43-F47 HydrophobicContact CG2-CD2 3.83Å; I43-F47 HydrophobicContact CG2-CE2 4.03Å; I43-F47 WeakPolarHBondContact O-CD2 3.35Å; I43-F47 PolarHBondContact O-N 3.42Å; F45-F47 VanDerWaalsContact C-N 3.27Å; F45-F47 PolarHBondContact O-N 3.08Å
48	S	47.8	Very low	51.8	Low	32 Å²	32	107 Å²	107	22%	0.224	52%	0.523	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	3.7	177.6	53.2	0	0	0	0	114.1	G44 F45 E50 D51 F52	G44-S48 PolarHBondContact O-N 3.1Å; G44-S48 PolarHBondContact O-OG 2.91Å; F45-S48 PolarHBondContact O-N 3.09Å; F45-S48 VanDerWaalsContact O-N 3.16Å; F45-S48 PolarHBondContact O-OG 3.46Å; S48-E50 PolarHBondContact O-N 2.84Å; S48-E50 VanDerWaalsContact O-N 3.14Å; S48-D51 PolarHBondContact O-N 3.3Å; S48-D51 VanDerWaalsContact O-N 3.14Å; S48-F52 VanDerWaalsContact O-CD2 3.3Å; S48-F52 WeakPolarHBondContact O-CD2 3.41Å
49	Q	49.2	Very low	52.6	Low	151 Å²	151	105.1 Å²	105.1	71%	0.706	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.5	-174.3	-164.5	167.5	5.3	0	0	114	F45	F45-Q49 PolarHBondContact O-N 2.91Å
50	E	46.7	Very low	53.7	Low	187 Å²	187	104.1 Å²	104.1	87%	0.874	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-24.4	178.1	-61.1	-176.4	165.2	0	0	113.8	S48 F52	S48-E50 PolarHBondContact O-N 2.84Å; S48-E50 VanDerWaalsContact O-N 3.14Å; E50-F52 VanDerWaalsContact C-N 3.28Å; E50-F52 PolarHBondContact O-N 3.06Å
51	D	44.5	Very low	55	Low	142 Å²	142	97 Å²	97	76%	0.759	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.9	177.7	-89	-37.1	0	0	0	112.4	S48 M53	S48-D51 PolarHBondContact O-N 3.3Å; S48-D51 VanDerWaalsContact O-N 3.14Å; D51-M53 PolarHBondContact O-N 2.62Å; D51-M53 VanDerWaalsContact O-N 3.09Å
52	F	47.4	Very low	55.8	Low	108 Å²	108	98.3 Å²	98.3	47%	0.474	49%	0.49	S	S	.	.			trans	-84.8	78.2	-179.8	-70.7	-80	0	0	0	111.6	F13 S48 E50 L54	F13-F52 HydrophobicContact CD2-CZ 4.44Å; S48-F52 VanDerWaalsContact O-CD2 3.3Å; S48-F52 WeakPolarHBondContact O-CD2 3.41Å; E50-F52 VanDerWaalsContact C-N 3.28Å; E50-F52 PolarHBondContact O-N 3.06Å; F52-L54 PolarHBondContact O-N 3.01Å
53	M	42.3	Very low	56.8	Low	180 Å²	180	98.1 Å²	98.1	89%	0.887	49%	0.493	S	S	*	.			trans	-67.9	39.4	174.8	-79	-81.3	-78.8	0	0	114.8	D51	D51-M53 PolarHBondContact O-N 2.62Å; D51-M53 VanDerWaalsContact O-N 3.09Å
54	L	48.8	Very low	57.7	Low	110 Å²	110	97 Å²	97	58%	0.576	49%	0.49	S	S	*	.	S	Bend	trans	-140.1	129.3	170.3	-71.4	174.5	0	0	0	108.7	F52 L56	F52-L54 PolarHBondContact O-N 3.01Å; L54-L56 HydrophobicContact CB-CD1 3.95Å; L54-L56 HydrophobicContact CB-CG 4.17Å; L54-L56 HydrophobicContact CD1-CD1 3.99Å; L54-L56 PolarHBondContact O-N 2.89Å
55	K	53.4	Low	58.9	Low	223 Å²	223	99.3 Å²	99.3	97%	0.97	50%	0.5	S	S	*	.			trans	-74.8	57.2	177.3	-67.3	-175.8	176.3	-178.6	0	112.2
56	L	58.9	Low	59.9	Low	49 Å²	49	99.2 Å²	99.2	26%	0.257	50%	0.502	S	S	.	.			trans	-89.7	128.1	177.7	-76.2	163.9	0	0	0	110.3	L24 L54 V58	L24-L56 HydrophobicContact CB-CD1 4.33Å; L24-L56 HydrophobicContact CB-CD2 4.06Å; L24-L56 VanDerWaalsContact O-CD2 3.25Å; L24-L56 WeakPolarHBondContact O-CD2 3.33Å; L54-L56 HydrophobicContact CB-CD1 3.95Å; L54-L56 HydrophobicContact CB-CG 4.17Å; L54-L56 HydrophobicContact CD1-CD1 3.99Å; L54-L56 PolarHBondContact O-N 2.89Å; L56-V58 PolarHBondContact O-N 2.81Å
57	P	60.7	Low	61	Low	69 Å²	69	90.3 Å²	90.3	45%	0.448	47%	0.469	S	S	.	.			trans	-66.2	133	170.3	26.9	-31.7	0	0	0	110.2	H25 L26 V27	H25-P57 VanDerWaalsContact O-CD 3.27Å; H25-P57 WeakPolarHBondContact O-CD 3.48Å; H25-P57 VanDerWaalsContact O-CG 3.24Å; H25-P57 WeakPolarHBondContact O-CG 3.31Å; L26-P57 HydrophobicContact CD1-CB 4.08Å; L26-P57 HydrophobicContact CD1-CG 3.93Å; V27-P57 PolarHBondContact N-O 2.93Å
58	V	66.8	Low	62.3	Low	69 Å²	69	85.5 Å²	85.5	42%	0.418	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.2	175.8	-172.8	0	0	0	0	108.3	V27 V29 F45 L56	V27-V58 HydrophobicContact CB-CG1 4.35Å; V27-V58 HydrophobicContact CB-CG2 4.25Å; V27-V58 HydrophobicContact CG1-CG1 4.42Å; V27-V58 CarbonylContact O-C 3.19Å; V27-V58 WeakPolarHBondContact O-CA 3.41Å; V29-V58 HydrophobicContact CG2-CG1 3.9Å; F45-V58 HydrophobicContact CE1-CG1 4.23Å; L56-V58 PolarHBondContact O-N 2.81Å
59	V	72.6	Confident	63.8	Low	40 Å²	40	89 Å²	89	24%	0.242	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122	-179.6	179.1	0	0	0	0	109.6	L26 V27 L28 V29 L61 Y70	L26-V59 HydrophobicContact CD1-CG2 3.94Å; V27-V59 PolarHBondContact O-N 3.36Å; L28-V59 HydrophobicContact CD2-CB 3.8Å; L28-V59 HydrophobicContact CD2-CG1 4.38Å; L28-V59 HydrophobicContact CD2-CG2 4.39Å; V29-V59 PolarHBondContact N-O 3.15Å; V59-L61 HydrophobicContact CG1-CD2 3.96Å; V59-Y70 HydrophobicContact CG1-CE1 4.49Å; V59-Y70 HydrophobicContact CG1-CE2 4.3Å
60	M	73.2	Confident	65.1	Low	43 Å²	43	87.6 Å²	87.6	21%	0.212	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	104.6	-179.7	-61.5	-66.6	-61.6	0	0	110	V29 R31 F45	V29-M60 HydrophobicContact CB-CE 4.3Å; V29-M60 HydrophobicContact CB-SD 3.64Å; V29-M60 HydrophobicContact CG1-CE 3.88Å; V29-M60 HydrophobicContact CG1-SD 3.82Å; V29-M60 HydrophobicContact CG2-SD 4.19Å; V29-M60 CarbonylContact O-C 3.59Å; V29-M60 WeakPolarHBondContact O-CA 3.47Å; R31-M60 HydrophobicContact CG-CE 4.02Å; R31-M60 VanDerWaalsContact CZ-CB 3.46Å; R31-M60 PolarHBondContact NH1-O 3.36Å; R31-M60 VanDerWaalsContact NH2-CB 3.32Å; F45-M60 HydrophobicContact CD2-CE 4.46Å; F45-M60 HydrophobicContact CD2-SD 4.37Å; F45-M60 HydrophobicContact CE2-SD 4.36Å
61	L	75.5	Confident	66.4	Low	5 Å²	5	80.8 Å²	80.8	3%	0.026	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	145.4	-178.2	-58	175.7	0	0	0	111.2	L28 V29 L30 R31 V59 D66 L67 Y70	L28-L61 HydrophobicContact CB-CD1 4.01Å; L28-L61 HydrophobicContact CD1-CD1 4.39Å; V29-L61 PolarHBondContact O-N 3.31Å; L30-L61 HydrophobicContact CD1-CB 4.41Å; R31-L61 VanDerWaalsContact CB-O 3.3Å; R31-L61 WeakPolarHBondContact CB-O 3.22Å; R31-L61 VanDerWaalsContact CG-O 3.28Å; R31-L61 WeakPolarHBondContact CG-O 3.38Å; R31-L61 PolarHBondContact N-O 3.44Å; V59-L61 HydrophobicContact CG1-CD2 3.96Å; L61-D66 HydrophobicContact CB-CB 4.07Å; L61-D66 HydrophobicContact CD2-CB 3.9Å; L61-D66 HydrophobicContact CG-CB 4.45Å; L61-L67 HydrophobicContact CD1-CB 3.97Å; L61-L67 HydrophobicContact CD1-CD1 3.48Å; L61-L67 VanDerWaalsContact CD1-CD1 3.48Å; L61-L67 HydrophobicContact CD1-CG 4.34Å; L61-Y70 HydrophobicContact CD2-CD2 3.84Å; L61-Y70 HydrophobicContact CD2-CE2 3.61Å
62	S	71.8	Confident	68	Low	55 Å²	55	77.5 Å²	77.5	39%	0.385	41%	0.412	S	S	.	.	S	Bend	trans	-97.8	-23.4	-176.6	-62	0	0	0	0	114.2	R38 D66	R38-S62 PolarHBondContact NH2-OG 2.86Å; S62-D66 WeakPolarHBondContact CA-OD2 3.35Å; S62-D66 VanDerWaalsContact CB-OD2 3.26Å; S62-D66 WeakPolarHBondContact CB-OD2 3.36Å; S62-D66 PolarHBondContact N-OD2 2.93Å
63	S	75.3	Confident	69.2	Low	44 Å²	44	75.4 Å²	75.4	31%	0.308	41%	0.406	S	S	.	.	S	Bend	trans	-144.8	169	175.7	86.5	0	0	0	0	111.6	L30 S65 D66	L30-S63 VanDerWaalsContact CD1-O 3.24Å; L30-S63 WeakPolarHBondContact CD1-O 3.33Å; S63-S65 VanDerWaalsContact C-N 3.27Å; S63-S65 WeakPolarHBondContact OG-CB 3.49Å; S63-S65 PolarHBondContact OG-N 3.44Å; S63-S65 VanDerWaalsContact OG-N 3.11Å; S63-D66 WeakPolarHBondContact CB-OD1 3.48Å; S63-D66 PolarHBondContact N-OD1 3.38Å; S63-D66 PolarHBondContact N-OD2 2.95Å; S63-D66 WeakPolarHBondContact O-CB 3.46Å; S63-D66 PolarHBondContact O-N 2.9Å; S63-D66 PolarHBondContact OG-N 3Å; S63-D66 PolarHBondContact OG-OD1 3.09Å
64	V	70.8	Confident	70.7	Confident	56 Å²	56	71.3 Å²	71.3	34%	0.339	38%	0.383	S	S	.	.	H	α-helix	trans	-66.9	-32	171.9	-179.6	0	0	0	0	110.8	L30 D66 L67 L80	L30-V64 HydrophobicContact CD1-CG2 4.26Å; L30-V64 HydrophobicContact CD2-CG2 3.8Å; V64-D66 PolarHBondContact O-N 2.88Å; V64-L67 WeakPolarHBondContact O-CB 3.07Å; V64-L67 PolarHBondContact O-N 3.27Å; V64-L80 WeakPolarHBondContact CG1-O 3.28Å
65	S	75.4	Confident	71.7	Confident	87 Å²	87	69.7 Å²	69.7	61%	0.608	37%	0.373	S	S	*	.	H	α-helix	trans	-64.5	-27.6	174.5	-51.1	0	0	0	0	112.7	S63 L67 L68	S63-S65 VanDerWaalsContact C-N 3.27Å; S63-S65 WeakPolarHBondContact OG-CB 3.49Å; S63-S65 PolarHBondContact OG-N 3.44Å; S63-S65 VanDerWaalsContact OG-N 3.11Å; S65-L67 VanDerWaalsContact C-N 3.25Å; S65-L67 PolarHBondContact O-N 3.37Å; S65-L68 PolarHBondContact O-N 2.97Å
66	D	76.8	Confident	72.5	Confident	50 Å²	50	59.1 Å²	59.1	27%	0.267	33%	0.327	S	S	.	.	H	α-helix	trans	-65.9	-30.2	173	-53.6	20	0	0	0	111.2	L61 S62 S63 V64 L68 T69	L61-D66 HydrophobicContact CB-CB 4.07Å; L61-D66 HydrophobicContact CD2-CB 3.9Å; L61-D66 HydrophobicContact CG-CB 4.45Å; S62-D66 WeakPolarHBondContact CA-OD2 3.35Å; S62-D66 VanDerWaalsContact CB-OD2 3.26Å; S62-D66 WeakPolarHBondContact CB-OD2 3.36Å; S62-D66 PolarHBondContact N-OD2 2.93Å; S63-D66 WeakPolarHBondContact CB-OD1 3.48Å; S63-D66 PolarHBondContact N-OD1 3.38Å; S63-D66 PolarHBondContact N-OD2 2.95Å; S63-D66 WeakPolarHBondContact O-CB 3.46Å; S63-D66 PolarHBondContact O-N 2.9Å; S63-D66 PolarHBondContact OG-N 3Å; S63-D66 PolarHBondContact OG-OD1 3.09Å; V64-D66 PolarHBondContact O-N 2.88Å; D66-L68 VanDerWaalsContact C-N 3.28Å; D66-L68 PolarHBondContact O-N 3.37Å; D66-T69 WeakPolarHBondContact O-CB 3.35Å; D66-T69 PolarHBondContact O-N 3Å; D66-T69 VanDerWaalsContact O-N 3.11Å; D66-T69 PolarHBondContact O-OG1 3.01Å
67	L	76.6	Confident	73.3	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.073	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-36.4	-179.8	-170.9	62.4	0	0	0	111.4	L28 L61 V64 S65 T69 Y70 I71 L76 L80	L28-L67 HydrophobicContact CB-CD1 4.25Å; L28-L67 HydrophobicContact CD1-CD1 3.66Å; L61-L67 HydrophobicContact CD1-CB 3.97Å; L61-L67 HydrophobicContact CD1-CD1 3.48Å; L61-L67 VanDerWaalsContact CD1-CD1 3.48Å; L61-L67 HydrophobicContact CD1-CG 4.34Å; V64-L67 WeakPolarHBondContact O-CB 3.07Å; V64-L67 PolarHBondContact O-N 3.27Å; S65-L67 VanDerWaalsContact C-N 3.25Å; S65-L67 PolarHBondContact O-N 3.37Å; L67-T69 PolarHBondContact O-N 2.86Å; L67-T69 VanDerWaalsContact O-N 3.16Å; L67-Y70 PolarHBondContact O-N 2.87Å; L67-I71 HydrophobicContact CD1-CD1 4.04Å; L67-I71 PolarHBondContact O-N 3.2Å; L67-I71 VanDerWaalsContact O-N 3.07Å; L67-L76 HydrophobicContact CD2-CD1 3.84Å; L67-L76 HydrophobicContact CD2-CD2 3.65Å; L67-L76 HydrophobicContact CD2-CG 4.43Å; L67-L76 HydrophobicContact CG-CD1 4.03Å; L67-L76 HydrophobicContact CG-CD2 4.18Å; L67-L80 HydrophobicContact CD2-CD1 4.49Å
68	L	74.3	Confident	74	Confident	81 Å²	81	57.9 Å²	57.9	42%	0.424	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-9.1	176.5	-65.2	171.3	0	0	0	113.7	S65 D66 Y70 I71 D73 L76	S65-L68 PolarHBondContact O-N 2.97Å; D66-L68 VanDerWaalsContact C-N 3.28Å; D66-L68 PolarHBondContact O-N 3.37Å; L68-Y70 VanDerWaalsContact C-N 3.32Å; L68-I71 WeakPolarHBondContact CA-O 3.35Å; L68-D73 HydrophobicContact CD2-CB 3.86Å; L68-L76 HydrophobicContact CD2-CD1 3.67Å; L68-L76 HydrophobicContact CG-CD1 4.43Å
69	T	79.1	Confident	74.2	Confident	106 Å²	106	63 Å²	63	65%	0.65	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-6.4	170.9	69.9	0	0	0	0	113.4	D66 L67	D66-T69 WeakPolarHBondContact O-CB 3.35Å; D66-T69 PolarHBondContact O-N 3Å; D66-T69 VanDerWaalsContact O-N 3.11Å; D66-T69 PolarHBondContact O-OG1 3.01Å; L67-T69 PolarHBondContact O-N 2.86Å; L67-T69 VanDerWaalsContact O-N 3.16Å
70	Y	75.6	Confident	74.2	Confident	122 Å²	122	63 Å²	63	48%	0.478	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	-17.7	179.5	-64.1	-91.4	0	0	0	114.2	L26 L28 V59 L61 L67 L68	L26-Y70 HydrophobicContact CD2-CD1 4.27Å; L28-Y70 HydrophobicContact CD1-CG 4.08Å; L28-Y70 HydrophobicContact CD2-CD1 4.14Å; L28-Y70 HydrophobicContact CD2-CD2 4.41Å; L28-Y70 HydrophobicContact CD2-CG 4.05Å; V59-Y70 HydrophobicContact CG1-CE1 4.49Å; V59-Y70 HydrophobicContact CG1-CE2 4.3Å; L61-Y70 HydrophobicContact CD2-CD2 3.84Å; L61-Y70 HydrophobicContact CD2-CE2 3.61Å; L67-Y70 PolarHBondContact O-N 2.87Å; L68-Y70 VanDerWaalsContact C-N 3.32Å
71	I	75.6	Confident	74.1	Confident	44 Å²	44	63.7 Å²	63.7	23%	0.226	36%	0.358	C	S	.	.	S	Bend	trans	-140	132.6	-173.8	-60.2	-171.8	0	0	0	108.4	L28 L67 L68 Q75 L76	L28-I71 HydrophobicContact CD1-CD1 3.78Å; L28-I71 HydrophobicContact CD1-CG1 3.91Å; L67-I71 HydrophobicContact CD1-CD1 4.04Å; L67-I71 PolarHBondContact O-N 3.2Å; L67-I71 VanDerWaalsContact O-N 3.07Å; L68-I71 WeakPolarHBondContact CA-O 3.35Å; I71-Q75 HydrophobicContact CG2-CB 3.72Å; I71-Q75 HydrophobicContact CG2-CG 4.23Å; I71-L76 HydrophobicContact CB-CD2 4.42Å; I71-L76 HydrophobicContact CD1-CD2 4.41Å; I71-L76 HydrophobicContact CG2-CD1 4.37Å; I71-L76 HydrophobicContact CG2-CD2 3.76Å; I71-L76 HydrophobicContact CG2-CG 3.78Å
72	D	76.2	Confident	74.1	Confident	72 Å²	72	63.9 Å²	63.9	39%	0.385	36%	0.361	S	S	.	.			trans	-68.2	146.7	177.1	173.9	-61	0	0	0	110.4	K74 Q75	D72-K74 PolarHBondContact O-N 2.89Å; D72-K74 VanDerWaalsContact O-N 3.13Å; D72-K74 VanDerWaalsContact OD1-CB 3.24Å; D72-K74 WeakPolarHBondContact OD1-CB 3.49Å; D72-K74 WeakPolarHBondContact OD1-CD 3.4Å; D72-K74 WeakPolarHBondContact OD1-CG 3.27Å; D72-K74 PolarHBondContact OD1-N 3.23Å; D72-K74 IonicContact OD1-NZ 3.07Å; D72-K74 IonicContact OD2-NZ 3.62Å; D72-K74 PolarHBondContact OD2-NZ 3.46Å; D72-Q75 HydrophobicContact CB-CG 3.99Å; D72-Q75 WeakPolarHBondContact O-CG 3.48Å; D72-Q75 PolarHBondContact O-N 2.82Å
73	D	73.3	Confident	74.3	Confident	64 Å²	64	64.3 Å²	64.3	34%	0.342	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-61.2	-24.9	-174.9	63.8	-65.8	0	0	0	113	L68 Q75 L76 G82 T83	L68-D73 HydrophobicContact CD2-CB 3.86Å; D73-Q75 PolarHBondContact O-N 3.48Å; D73-L76 PolarHBondContact O-N 2.86Å; D73-G82 CarbonylContact O-C 3.57Å; D73-G82 WeakPolarHBondContact O-CA 3.5Å; D73-T83 PolarHBondContact O-N 3.22Å
74	K	73.7	Confident	74.2	Confident	95 Å²	95	64 Å²	64	41%	0.413	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-75	-12.5	177.3	-59.3	156.1	-155.6	129.5	0	113.5	D72 L84	D72-K74 PolarHBondContact O-N 2.89Å; D72-K74 VanDerWaalsContact O-N 3.13Å; D72-K74 VanDerWaalsContact OD1-CB 3.24Å; D72-K74 WeakPolarHBondContact OD1-CB 3.49Å; D72-K74 WeakPolarHBondContact OD1-CD 3.4Å; D72-K74 WeakPolarHBondContact OD1-CG 3.27Å; D72-K74 PolarHBondContact OD1-N 3.23Å; D72-K74 IonicContact OD1-NZ 3.07Å; D72-K74 IonicContact OD2-NZ 3.62Å; D72-K74 PolarHBondContact OD2-NZ 3.46Å; K74-L84 WeakPolarHBondContact O-CB 3.23Å
75	Q	69.8	Low	74	Confident	76 Å²	76	69.1 Å²	69.1	36%	0.355	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-95.4	-7.7	177.6	-33.9	-171.5	-64.6	0	0	112.4	I71 D72 D73 E177	I71-Q75 HydrophobicContact CG2-CB 3.72Å; I71-Q75 HydrophobicContact CG2-CG 4.23Å; D72-Q75 HydrophobicContact CB-CG 3.99Å; D72-Q75 WeakPolarHBondContact O-CG 3.48Å; D72-Q75 PolarHBondContact O-N 2.82Å; D73-Q75 PolarHBondContact O-N 3.48Å; Q75-E177 WeakPolarHBondContact CG-OE2 3.36Å; Q75-E177 PolarHBondContact NE2-OE1 3.32Å; Q75-E177 PolarHBondContact NE2-OE2 3.03Å
76	L	70.9	Confident	73.7	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	-105.2	144.8	-177.6	-65.7	177	0	0	0	111.1	M1 L67 L68 I71 D73 L80 G82 T83 L84	M1-L76 HydrophobicContact CE-CD2 3.48Å; M1-L76 VanDerWaalsContact CE-CD2 3.48Å; L67-L76 HydrophobicContact CD2-CD1 3.84Å; L67-L76 HydrophobicContact CD2-CD2 3.65Å; L67-L76 HydrophobicContact CD2-CG 4.43Å; L67-L76 HydrophobicContact CG-CD1 4.03Å; L67-L76 HydrophobicContact CG-CD2 4.18Å; L68-L76 HydrophobicContact CD2-CD1 3.67Å; L68-L76 HydrophobicContact CG-CD1 4.43Å; I71-L76 HydrophobicContact CB-CD2 4.42Å; I71-L76 HydrophobicContact CD1-CD2 4.41Å; I71-L76 HydrophobicContact CG2-CD1 4.37Å; I71-L76 HydrophobicContact CG2-CD2 3.76Å; I71-L76 HydrophobicContact CG2-CG 3.78Å; D73-L76 PolarHBondContact O-N 2.86Å; L76-L80 HydrophobicContact CB-CB 4.47Å; L76-G82 CarbonylContact O-C 3.54Å; L76-G82 VanDerWaalsContact O-CA 3.25Å; L76-G82 WeakPolarHBondContact O-CA 3.4Å; L76-T83 PolarHBondContact O-N 3Å; L76-L84 WeakPolarHBondContact O-CB 3.32Å; L76-L84 PolarHBondContact O-N 2.97Å
77	T	75.7	Confident	73.5	Confident	17 Å²	17	70 Å²	70	10%	0.104	37%	0.37	C	S	.	.			trans	-71.8	158	174.5	58.3	0	0	0	0	111.2	E79 L80 G81 G82 Y86	T77-E79 PolarHBondContact O-N 3.34Å; T77-E79 VanDerWaalsContact O-N 3.12Å; T77-E79 PolarHBondContact OG1-OE2 3.42Å; T77-L80 CarbonylContact O-C 3.58Å; T77-L80 WeakPolarHBondContact O-CA 3.48Å; T77-L80 PolarHBondContact O-N 2.81Å; T77-G81 PolarHBondContact O-N 3.26Å; T77-G82 PolarHBondContact O-N 3.48Å; T77-G82 VanDerWaalsContact O-N 3.09Å; T77-Y86 HydrophobicContact CG2-CD1 4.37Å; T77-Y86 HydrophobicContact CG2-CG 4.47Å
78	P	76.1	Confident	73.3	Confident	76 Å²	76	74.5 Å²	74.5	49%	0.494	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-54	-30.4	175.1	-29.9	36.2	0	0	0	114.3	L80 G81 G82 L84	P78-L80 PolarHBondContact O-N 2.91Å; P78-G81 PolarHBondContact O-N 3Å; P78-G82 VanDerWaalsContact CA-O 3.27Å; P78-G82 WeakPolarHBondContact CA-O 3.3Å; P78-L84 WeakPolarHBondContact CD-O 3.4Å
79	E	71.3	Confident	73.2	Confident	176 Å²	176	74.3 Å²	74.3	82%	0.822	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-60.7	-22.4	174.6	-54.7	171	142.2	0	0	113.4	T77	T77-E79 PolarHBondContact O-N 3.34Å; T77-E79 VanDerWaalsContact O-N 3.12Å; T77-E79 PolarHBondContact OG1-OE2 3.42Å
80	L	72.2	Confident	72.7	Confident	39 Å²	39	75.6 Å²	75.6	20%	0.204	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-115.2	17.6	177.7	-64.7	173.1	0	0	0	112.1	M1 V64 L67 L76 T77 P78	M1-L80 HydrophobicContact CE-CD1 3.55Å; M1-L80 HydrophobicContact SD-CD1 3.41Å; M1-L80 WeakPolarHBondContact SD-CD1 3.47Å; V64-L80 WeakPolarHBondContact CG1-O 3.28Å; L67-L80 HydrophobicContact CD2-CD1 4.49Å; L76-L80 HydrophobicContact CB-CB 4.47Å; T77-L80 CarbonylContact O-C 3.58Å; T77-L80 WeakPolarHBondContact O-CA 3.48Å; T77-L80 PolarHBondContact O-N 2.81Å; P78-L80 PolarHBondContact O-N 2.91Å
81	G	69.4	Low	72.7	Confident	59 Å²	59	74.2 Å²	74.2	61%	0.608	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	14.9	175.6	0	0	0	0	0	115.6	T77 P78	T77-G81 PolarHBondContact O-N 3.26Å; P78-G81 PolarHBondContact O-N 3Å
82	G	77.1	Confident	72.6	Confident	9 Å²	9	75.9 Å²	75.9	9%	0.093	40%	0.397	C	S	.	.			trans	-106.1	-176	177.8	0	0	0	0	0	115.2	D73 L76 T77 P78	D73-G82 CarbonylContact O-C 3.57Å; D73-G82 WeakPolarHBondContact O-CA 3.5Å; L76-G82 CarbonylContact O-C 3.54Å; L76-G82 VanDerWaalsContact O-CA 3.25Å; L76-G82 WeakPolarHBondContact O-CA 3.4Å; T77-G82 PolarHBondContact O-N 3.48Å; T77-G82 VanDerWaalsContact O-N 3.09Å; P78-G82 VanDerWaalsContact CA-O 3.27Å; P78-G82 WeakPolarHBondContact CA-O 3.3Å
83	T	75.4	Confident	72.6	Confident	63 Å²	63	78.2 Å²	78.2	39%	0.387	41%	0.408	S	S	.	.			trans	-108.7	5.2	-175.7	77.7	0	0	0	0	114.8	D73 L76 Q85	D73-T83 PolarHBondContact O-N 3.22Å; L76-T83 PolarHBondContact O-N 3Å; T83-Q85 PolarHBondContact O-N 3.02Å; T83-Q85 VanDerWaalsContact O-N 3.16Å
84	L	72.5	Confident	72.7	Confident	39 Å²	39	77.1 Å²	77.1	20%	0.204	40%	0.401	C	S	.	.			trans	-73.3	106.6	-177.4	-172.4	62.3	0	0	0	111.3	K74 L76 P78 Y86	K74-L84 WeakPolarHBondContact O-CB 3.23Å; L76-L84 WeakPolarHBondContact O-CB 3.32Å; L76-L84 PolarHBondContact O-N 2.97Å; P78-L84 WeakPolarHBondContact CD-O 3.4Å; L84-Y86 PolarHBondContact O-N 3.18Å; L84-Y86 VanDerWaalsContact O-N 3.13Å
85	Q	67.6	Low	73.1	Confident	163 Å²	163	74.8 Å²	74.8	76%	0.762	39%	0.389	S	S	*	.			trans	-68.8	108	170.2	-68	-64.5	-12.1	0	0	109.8	T83	T83-Q85 PolarHBondContact O-N 3.02Å; T83-Q85 VanDerWaalsContact O-N 3.16Å
86	Y	68.8	Low	73.6	Confident	105 Å²	105	75.9 Å²	75.9	41%	0.412	40%	0.398	S	S	.	.			trans	-131.9	109	-177.9	176.7	-105	0	0	0	111	T77 L84 H88 W91	T77-Y86 HydrophobicContact CG2-CD1 4.37Å; T77-Y86 HydrophobicContact CG2-CG 4.47Å; L84-Y86 PolarHBondContact O-N 3.18Å; L84-Y86 VanDerWaalsContact O-N 3.13Å; Y86-H88 HydrophobicContact CE1-CB 3.73Å; Y86-H88 AromaticContact CE1-ND1 3.83Å; Y86-H88 AromaticContact CZ-ND1 3.77Å; Y86-H88 PolarHBondContact OH-ND1 2.92Å; Y86-W91 HydrophobicContact CE2-CB 3.9Å; Y86-W91 AromaticContact CE2-CD1 3.96Å; Y86-W91 AromaticContact CE2-CG 3.89Å; Y86-W91 HydrophobicContact CE2-CG 3.89Å
87	C	73.2	Confident	74.2	Confident	50 Å²	50	77.6 Å²	77.6	34%	0.338	41%	0.412	S	S	.	.			trans	-93.8	106.7	169.4	-176.5	0	0	0	0	109.8	S89 E90 W91	C87-S89 PolarHBondContact O-N 2.87Å; C87-E90 HydrophobicContact CB-CB 3.97Å; C87-E90 VanDerWaalsContact CB-CD 3.48Å; C87-E90 HydrophobicContact CB-CG 4.07Å; C87-E90 WeakPolarHBondContact CB-OE2 3.44Å; C87-E90 PolarHBondContact O-N 3.18Å; C87-E90 PolarHBondContact SG-OE1 3.24Å; C87-E90 VanDerWaalsContact SG-OE1 3.34Å; C87-W91 WeakPolarHBondContact O-CB 3.29Å; C87-W91 PolarHBondContact O-N 3.17Å
88	H	71.1	Confident	74.5	Confident	108 Å²	108	77 Å²	77	50%	0.5	41%	0.408	S	S	.	.	H	α-helix	trans	-59.4	-37.1	179.4	-169.6	50.5	0	0	0	112.3	Y86 W91 I92	Y86-H88 HydrophobicContact CE1-CB 3.73Å; Y86-H88 AromaticContact CE1-ND1 3.83Å; Y86-H88 AromaticContact CZ-ND1 3.77Å; Y86-H88 PolarHBondContact OH-ND1 2.92Å; H88-W91 PolarHBondContact O-N 3.44Å; H88-I92 WeakPolarHBondContact O-CG1 3.4Å; H88-I92 PolarHBondContact O-N 3.29Å
89	S	72.3	Confident	74.9	Confident	78 Å²	78	78.8 Å²	78.8	55%	0.545	41%	0.41	S	S	.	.	H	α-helix	trans	-65.2	-47.4	179.4	-53	0	0	0	0	112.4	C87 I92 I93	C87-S89 PolarHBondContact O-N 2.87Å; S89-I92 PolarHBondContact O-N 2.95Å; S89-I93 WeakPolarHBondContact O-CD1 3.26Å; S89-I93 VanDerWaalsContact O-CG1 3.27Å; S89-I93 WeakPolarHBondContact O-CG1 3.36Å; S89-I93 PolarHBondContact O-N 3.3Å
90	E	69.5	Low	75.7	Confident	132 Å²	132	76.4 Å²	76.4	62%	0.617	40%	0.397	S	S	*	.	H	α-helix	trans	-64.7	-42.5	176.5	-74.1	157.3	-151.1	0	0	111.3	C87 I92 I93 F94	C87-E90 HydrophobicContact CB-CB 3.97Å; C87-E90 VanDerWaalsContact CB-CD 3.48Å; C87-E90 HydrophobicContact CB-CG 4.07Å; C87-E90 WeakPolarHBondContact CB-OE2 3.44Å; C87-E90 PolarHBondContact O-N 3.18Å; C87-E90 PolarHBondContact SG-OE1 3.24Å; C87-E90 VanDerWaalsContact SG-OE1 3.34Å; E90-I92 VanDerWaalsContact C-N 3.31Å; E90-I92 PolarHBondContact O-N 3.42Å; E90-I93 PolarHBondContact O-N 2.85Å; E90-F94 VanDerWaalsContact O-CB 3.26Å; E90-F94 WeakPolarHBondContact O-CB 3.32Å; E90-F94 PolarHBondContact O-N 3.32Å
91	W	75.9	Confident	76.5	Confident	94 Å²	94	74.6 Å²	74.6	36%	0.356	39%	0.387	S	S	.	.	H	α-helix	trans	-58.3	-42.4	174.6	-175.2	92.5	0	0	0	111.8	Y86 C87 H88 R95 H181	Y86-W91 HydrophobicContact CE2-CB 3.9Å; Y86-W91 AromaticContact CE2-CD1 3.96Å; Y86-W91 AromaticContact CE2-CG 3.89Å; Y86-W91 HydrophobicContact CE2-CG 3.89Å; C87-W91 WeakPolarHBondContact O-CB 3.29Å; C87-W91 PolarHBondContact O-N 3.17Å; H88-W91 PolarHBondContact O-N 3.44Å; W91-R95 HydrophobicContact CE3-CB 4.48Å; W91-R95 HydrophobicContact CH2-CB 4.49Å; W91-R95 HydrophobicContact CH2-CG 4.11Å; W91-R95 HydrophobicContact CZ2-CG 4.44Å; W91-R95 HydrophobicContact CZ3-CB 4.41Å; W91-R95 HydrophobicContact CZ3-CG 4.37Å; W91-R95 WeakPolarHBondContact O-CB 3.34Å; W91-R95 PolarHBondContact O-N 2.9Å; W91-H181 AromaticContact CD1-CE1 3.68Å; W91-H181 AromaticContact CD1-NE2 3.78Å; W91-H181 AromaticContact CE2-NE2 3.96Å; W91-H181 AromaticContact NE1-CD2 3.98Å; W91-H181 AromaticContact NE1-CE1 3.22Å; W91-H181 PolarHBondContact NE1-CE1 2.71Å; W91-H181 AromaticContact NE1-NE2 2.94Å; W91-H181 PolarHBondContact NE1-NE2 3.26Å
92	I	71.7	Confident	77.1	Confident	78 Å²	78	73.5 Å²	73.5	40%	0.4	37%	0.372	S	S	.	.	H	α-helix	trans	-64.3	-50.5	175	-73.7	170	0	0	0	111.3	H88 S89 E90 F94 R95 N96	H88-I92 WeakPolarHBondContact O-CG1 3.4Å; H88-I92 PolarHBondContact O-N 3.29Å; S89-I92 PolarHBondContact O-N 2.95Å; E90-I92 VanDerWaalsContact C-N 3.31Å; E90-I92 PolarHBondContact O-N 3.42Å; I92-F94 VanDerWaalsContact C-N 3.27Å; I92-F94 PolarHBondContact O-N 3.43Å; I92-R95 PolarHBondContact O-N 2.9Å; I92-N96 WeakPolarHBondContact O-CB 3.33Å; I92-N96 PolarHBondContact O-N 3.17Å
93	I	77.8	Confident	77.6	Confident	121 Å²	121	76.3 Å²	76.3	62%	0.621	39%	0.388	S	S	*	.	H	α-helix	trans	-56.5	-46.4	-179.2	-70.8	163	0	0	0	109.9	S89 E90 A97	S89-I93 WeakPolarHBondContact O-CD1 3.26Å; S89-I93 VanDerWaalsContact O-CG1 3.27Å; S89-I93 WeakPolarHBondContact O-CG1 3.36Å; S89-I93 PolarHBondContact O-N 3.3Å; E90-I93 PolarHBondContact O-N 2.85Å; I93-A97 PolarHBondContact O-N 3.1Å
94	F	75.8	Confident	78.2	Confident	41 Å²	41	74.8 Å²	74.8	18%	0.18	38%	0.378	C	S	.	.	H	α-helix	trans	-74	-41.6	-176.2	-175	-99.5	0	0	0	113.1	E90 I92 N96 A97 I98 L159 L163 D185 I189	E90-F94 VanDerWaalsContact O-CB 3.26Å; E90-F94 WeakPolarHBondContact O-CB 3.32Å; E90-F94 PolarHBondContact O-N 3.32Å; I92-F94 VanDerWaalsContact C-N 3.27Å; I92-F94 PolarHBondContact O-N 3.43Å; F94-N96 VanDerWaalsContact C-N 3.33Å; F94-N96 PolarHBondContact O-N 2.88Å; F94-A97 PolarHBondContact O-N 3.33Å; F94-I98 HydrophobicContact CD1-CD1 4.33Å; F94-I98 HydrophobicContact CE1-CD1 3.35Å; F94-I98 HydrophobicContact CE1-CG1 3.95Å; F94-I98 HydrophobicContact CZ-CD1 3.53Å; F94-I98 HydrophobicContact CZ-CG1 3.8Å; F94-I98 PolarHBondContact O-N 3.33Å; F94-I98 VanDerWaalsContact O-N 3.07Å; F94-L159 HydrophobicContact CD2-CD1 4.47Å; F94-L159 HydrophobicContact CE2-CD1 3.82Å; F94-L163 HydrophobicContact CD1-CD2 4.19Å; F94-L163 HydrophobicContact CD2-CD2 4.33Å; F94-L163 HydrophobicContact CE1-CD1 4.16Å; F94-L163 HydrophobicContact CE1-CD2 3.52Å; F94-L163 HydrophobicContact CE1-CG 3.98Å; F94-L163 HydrophobicContact CE2-CD1 4.42Å; F94-L163 HydrophobicContact CE2-CD2 3.7Å; F94-L163 HydrophobicContact CE2-CG 3.63Å; F94-L163 HydrophobicContact CZ-CD1 3.59Å; F94-L163 HydrophobicContact CZ-CD2 3.27Å; F94-L163 HydrophobicContact CZ-CG 3.24Å; F94-D185 HydrophobicContact CE1-CB 3.86Å; F94-I189 HydrophobicContact CZ-CD1 3.81Å
95	R	80.8	Confident	78.9	Confident	47 Å²	47	73.2 Å²	73.2	18%	0.177	37%	0.37	C	S	.	.	H	α-helix	trans	-58.5	-45.2	172.7	178.9	59.4	59.8	-146.1	-2	111.3	W91 I92 A97 I98 E99 H181 D185	W91-R95 HydrophobicContact CE3-CB 4.48Å; W91-R95 HydrophobicContact CH2-CB 4.49Å; W91-R95 HydrophobicContact CH2-CG 4.11Å; W91-R95 HydrophobicContact CZ2-CG 4.44Å; W91-R95 HydrophobicContact CZ3-CB 4.41Å; W91-R95 HydrophobicContact CZ3-CG 4.37Å; W91-R95 WeakPolarHBondContact O-CB 3.34Å; W91-R95 PolarHBondContact O-N 2.9Å; I92-R95 PolarHBondContact O-N 2.9Å; R95-A97 VanDerWaalsContact C-N 3.35Å; R95-A97 PolarHBondContact O-N 2.74Å; R95-I98 PolarHBondContact O-N 2.66Å; R95-E99 WeakPolarHBondContact CD-OE1 3.23Å; R95-E99 WeakPolarHBondContact CG-OE1 3.45Å; R95-E99 WeakPolarHBondContact O-CG 3.45Å; R95-E99 PolarHBondContact O-N 3.44Å; R95-H181 PolarHBondContact NH2-CE1 2.75Å; R95-H181 PolarHBondContact NH2-NE2 3.11Å; R95-D185 IonicContact CZ-OD1 2.79Å; R95-D185 IonicContact CZ-OD2 2.96Å; R95-D185 IonicContact NH1-OD1 3.59Å; R95-D185 PolarHBondContact NH1-OD1 3.23Å; R95-D185 IonicContact NH1-OD2 3.21Å; R95-D185 VanDerWaalsContact NH2-CG 3.28Å; R95-D185 IonicContact NH2-OD1 2.71Å; R95-D185 PolarHBondContact NH2-OD1 2.8Å; R95-D185 IonicContact NH2-OD2 3.69Å; R95-D185 PolarHBondContact NH2-OD2 3.46Å
96	N	80.5	Confident	79.5	Confident	98 Å²	98	71.7 Å²	71.7	52%	0.524	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-40	176.6	-173.3	-0.9	0	0	0	111.6	I92 F94 I98 E99 K100	I92-N96 WeakPolarHBondContact O-CB 3.33Å; I92-N96 PolarHBondContact O-N 3.17Å; F94-N96 VanDerWaalsContact C-N 3.33Å; F94-N96 PolarHBondContact O-N 2.88Å; N96-I98 PolarHBondContact O-N 3.41Å; N96-E99 PolarHBondContact O-N 3.08Å; N96-K100 VanDerWaalsContact O-CB 3.29Å; N96-K100 WeakPolarHBondContact O-CB 3.49Å; N96-K100 PolarHBondContact O-N 2.96Å
97	A	83.4	Confident	80.4	Confident	36 Å²	36	71.5 Å²	71.5	30%	0.298	36%	0.364	S	S	.	.	H	α-helix	trans	-63	-40.4	174.9	0	0	0	0	0	113	I93 F94 R95 F101 L159	I93-A97 PolarHBondContact O-N 3.1Å; F94-A97 PolarHBondContact O-N 3.33Å; R95-A97 VanDerWaalsContact C-N 3.35Å; R95-A97 PolarHBondContact O-N 2.74Å; A97-F101 WeakPolarHBondContact O-CB 3.23Å; A97-F101 PolarHBondContact O-N 3.45Å; A97-L159 HydrophobicContact CB-CD1 3.68Å
98	I	82.9	Confident	81.1	Confident	6 Å²	6	69.3 Å²	69.3	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-47.3	171.8	-72.4	-175.4	0	0	0	111.6	F94 R95 N96 K100 F101 A102 L159 D185 T188 I189	F94-I98 HydrophobicContact CD1-CD1 4.33Å; F94-I98 HydrophobicContact CE1-CD1 3.35Å; F94-I98 HydrophobicContact CE1-CG1 3.95Å; F94-I98 HydrophobicContact CZ-CD1 3.53Å; F94-I98 HydrophobicContact CZ-CG1 3.8Å; F94-I98 PolarHBondContact O-N 3.33Å; F94-I98 VanDerWaalsContact O-N 3.07Å; R95-I98 PolarHBondContact O-N 2.66Å; N96-I98 PolarHBondContact O-N 3.41Å; I98-K100 VanDerWaalsContact C-N 3.34Å; I98-K100 PolarHBondContact O-N 2.74Å; I98-F101 PolarHBondContact O-N 3.23Å; I98-A102 WeakPolarHBondContact O-CB 3.37Å; I98-A102 PolarHBondContact O-N 3.34Å; I98-L159 HydrophobicContact CG1-CD2 4.23Å; I98-D185 HydrophobicContact CD1-CB 3.62Å; I98-T188 HydrophobicContact CG2-CG2 4.19Å; I98-I189 HydrophobicContact CD1-CD1 3.73Å; I98-I189 HydrophobicContact CD1-CG1 3.89Å; I98-I189 HydrophobicContact CG1-CD1 3.78Å; I98-I189 HydrophobicContact CG1-CG1 3.83Å
99	E	84.6	Confident	81.5	Confident	112 Å²	112	65.8 Å²	65.8	52%	0.523	34%	0.339	S	S	.	.	H	α-helix	trans	-63.9	-41	-178	-74.2	174	-171.3	0	0	111.4	R95 N96 A102 V103	R95-E99 WeakPolarHBondContact CD-OE1 3.23Å; R95-E99 WeakPolarHBondContact CG-OE1 3.45Å; R95-E99 WeakPolarHBondContact O-CG 3.45Å; R95-E99 PolarHBondContact O-N 3.44Å; N96-E99 PolarHBondContact O-N 3.08Å; E99-A102 PolarHBondContact O-N 3.29Å; E99-V103 WeakPolarHBondContact O-CG2 3.44Å; E99-V103 PolarHBondContact O-N 3.25Å
100	K	86.9	Confident	81.9	Confident	126 Å²	126	67 Å²	67	55%	0.548	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-49.6	172.1	-170.9	-165.5	173	-140	0	111.4	N96 I98 A102 V103 T104 E155	N96-K100 VanDerWaalsContact O-CB 3.29Å; N96-K100 WeakPolarHBondContact O-CB 3.49Å; N96-K100 PolarHBondContact O-N 2.96Å; I98-K100 VanDerWaalsContact C-N 3.34Å; I98-K100 PolarHBondContact O-N 2.74Å; K100-A102 VanDerWaalsContact C-N 3.29Å; K100-A102 PolarHBondContact O-N 3.05Å; K100-V103 WeakPolarHBondContact O-CA 3.48Å; K100-V103 WeakPolarHBondContact O-CB 3.43Å; K100-V103 PolarHBondContact O-N 3.41Å; K100-T104 PolarHBondContact O-N 2.99Å; K100-T104 PolarHBondContact O-OG1 2.59Å; K100-T104 VanDerWaalsContact O-OG1 3.13Å; K100-E155 IonicContact NZ-OE1 3.63Å
101	F	89.2	Confident	82.6	Confident	1 Å²	1	64.5 Å²	64.5	0%	0.004	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-40	178	178	-121.3	0	0	0	111.9	A97 I98 V103 T104 V105 V152 E155 L159 I189 L192 L193	A97-F101 WeakPolarHBondContact O-CB 3.23Å; A97-F101 PolarHBondContact O-N 3.45Å; I98-F101 PolarHBondContact O-N 3.23Å; F101-V103 VanDerWaalsContact C-N 3.28Å; F101-V103 PolarHBondContact O-N 3.19Å; F101-T104 PolarHBondContact O-N 3.1Å; F101-T104 VanDerWaalsContact O-N 3.17Å; F101-V105 HydrophobicContact CD2-CG2 4.18Å; F101-V105 HydrophobicContact CE1-CG2 4.1Å; F101-V105 HydrophobicContact CE2-CG2 3.73Å; F101-V105 HydrophobicContact CZ-CG2 3.66Å; F101-V105 WeakPolarHBondContact O-CG2 3.27Å; F101-V105 PolarHBondContact O-N 3.2Å; F101-V152 HydrophobicContact CE2-CG1 3.76Å; F101-V152 WeakPolarHBondContact CE2-O 3.39Å; F101-E155 HydrophobicContact CD2-CB 4.47Å; F101-E155 HydrophobicContact CD2-CG 4.17Å; F101-L159 HydrophobicContact CB-CD2 3.75Å; F101-L159 HydrophobicContact CD1-CD2 4.05Å; F101-L159 HydrophobicContact CG-CD2 4.06Å; F101-I189 HydrophobicContact CE1-CG2 4.4Å; F101-L192 HydrophobicContact CD1-CB 4.13Å; F101-L192 HydrophobicContact CD1-CD1 3.85Å; F101-L192 HydrophobicContact CE1-CB 3.57Å; F101-L192 HydrophobicContact CE1-CD1 4.18Å; F101-L192 HydrophobicContact CZ-CB 4.41Å; F101-L193 HydrophobicContact CZ-CD2 4.34Å; F101-L193 HydrophobicContact CZ-CG 4.42Å
102	A	82.8	Confident	82.9	Confident	36 Å²	36	60.8 Å²	60.8	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-63.3	-32.1	174.4	0	0	0	0	0	113	I98 E99 K100 K106 L192	I98-A102 WeakPolarHBondContact O-CB 3.37Å; I98-A102 PolarHBondContact O-N 3.34Å; E99-A102 PolarHBondContact O-N 3.29Å; K100-A102 VanDerWaalsContact C-N 3.29Å; K100-A102 PolarHBondContact O-N 3.05Å; A102-K106 WeakPolarHBondContact O-CB 3.38Å; A102-K106 PolarHBondContact O-N 3.46Å; A102-L192 HydrophobicContact CB-CD1 3.85Å; A102-L192 HydrophobicContact CB-CD2 4.16Å
103	V	86.1	Confident	83.1	Confident	69 Å²	69	62.4 Å²	62.4	42%	0.418	32%	0.318	S	S	.	.	H	α-helix	trans	-68.5	-47.8	169.6	171.7	0	0	0	0	110.7	E99 K100 F101 V105 K106 E107	E99-V103 WeakPolarHBondContact O-CG2 3.44Å; E99-V103 PolarHBondContact O-N 3.25Å; K100-V103 WeakPolarHBondContact O-CA 3.48Å; K100-V103 WeakPolarHBondContact O-CB 3.43Å; K100-V103 PolarHBondContact O-N 3.41Å; F101-V103 VanDerWaalsContact C-N 3.28Å; F101-V103 PolarHBondContact O-N 3.19Å; V103-V105 VanDerWaalsContact C-N 3.32Å; V103-V105 PolarHBondContact O-N 2.98Å; V103-K106 WeakPolarHBondContact O-CB 3.44Å; V103-K106 PolarHBondContact O-N 2.94Å; V103-E107 HydrophobicContact CG1-CG 4.19Å; V103-E107 VanDerWaalsContact CG1-OE1 3.31Å; V103-E107 WeakPolarHBondContact CG1-OE1 3.37Å; V103-E107 WeakPolarHBondContact O-CG 3.48Å; V103-E107 PolarHBondContact O-N 3.13Å
104	T	89.5	Confident	83.1	Confident	31 Å²	31	60.1 Å²	60.1	19%	0.19	31%	0.312	C	S	.	.	H	α-helix	trans	-55.6	-45	176.8	-41.1	0	0	0	0	112	K100 F101 K106 E107 M108 V152 E155	K100-T104 PolarHBondContact O-N 2.99Å; K100-T104 PolarHBondContact O-OG1 2.59Å; K100-T104 VanDerWaalsContact O-OG1 3.13Å; F101-T104 PolarHBondContact O-N 3.1Å; F101-T104 VanDerWaalsContact O-N 3.17Å; T104-K106 VanDerWaalsContact C-N 3.31Å; T104-K106 PolarHBondContact O-N 3.43Å; T104-E107 PolarHBondContact O-N 3.35Å; T104-M108 WeakPolarHBondContact O-CB 3.37Å; T104-M108 PolarHBondContact O-N 3.01Å; T104-V152 HydrophobicContact CG2-CG1 4.3Å; T104-V152 HydrophobicContact CG2-CG2 3.69Å; T104-E155 PolarHBondContact OG1-OE2 3.46Å
105	V	85.9	Confident	83.5	Confident	5 Å²	5	58.6 Å²	58.6	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-62.6	-37.6	177.3	173.6	0	0	0	0	111.8	F101 V103 A109 V152 L192 V196 M199	F101-V105 HydrophobicContact CD2-CG2 4.18Å; F101-V105 HydrophobicContact CE1-CG2 4.1Å; F101-V105 HydrophobicContact CE2-CG2 3.73Å; F101-V105 HydrophobicContact CZ-CG2 3.66Å; F101-V105 WeakPolarHBondContact O-CG2 3.27Å; F101-V105 PolarHBondContact O-N 3.2Å; V103-V105 VanDerWaalsContact C-N 3.32Å; V103-V105 PolarHBondContact O-N 2.98Å; V105-A109 PolarHBondContact O-N 2.87Å; V105-V152 HydrophobicContact CG2-CG1 3.94Å; V105-L192 HydrophobicContact CB-CD2 4.42Å; V105-L192 HydrophobicContact CG1-CD2 4.3Å; V105-L192 HydrophobicContact CG2-CB 4.46Å; V105-V196 HydrophobicContact CB-CG2 4.25Å; V105-V196 HydrophobicContact CG1-CG2 3.83Å; V105-V196 HydrophobicContact CG2-CG2 3.51Å; V105-M199 HydrophobicContact CG1-CE 3.9Å
106	K	81.8	Confident	83.2	Confident	131 Å²	131	57.2 Å²	57.2	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-72.3	-39.6	177.3	179	-168.7	167.6	-158.5	0	112.4	A102 V103 T104 A109 Q110	A102-K106 WeakPolarHBondContact O-CB 3.38Å; A102-K106 PolarHBondContact O-N 3.46Å; V103-K106 WeakPolarHBondContact O-CB 3.44Å; V103-K106 PolarHBondContact O-N 2.94Å; T104-K106 VanDerWaalsContact C-N 3.31Å; T104-K106 PolarHBondContact O-N 3.43Å; K106-A109 WeakPolarHBondContact O-CB 3.47Å; K106-A109 PolarHBondContact O-N 3.46Å; K106-Q110 WeakPolarHBondContact O-CG 3.41Å; K106-Q110 PolarHBondContact O-N 2.95Å; K106-Q110 VanDerWaalsContact O-N 3.12Å
107	E	86.4	Confident	82.9	Confident	101 Å²	101	55 Å²	55	47%	0.472	30%	0.296	S	S	.	.	H	α-helix	trans	-66.3	-41.7	176.4	-71.7	172.6	170.3	0	0	110.5	V103 T104 A109 Q110 M111	V103-E107 HydrophobicContact CG1-CG 4.19Å; V103-E107 VanDerWaalsContact CG1-OE1 3.31Å; V103-E107 WeakPolarHBondContact CG1-OE1 3.37Å; V103-E107 WeakPolarHBondContact O-CG 3.48Å; V103-E107 PolarHBondContact O-N 3.13Å; T104-E107 PolarHBondContact O-N 3.35Å; E107-A109 PolarHBondContact O-N 3.01Å; E107-Q110 WeakPolarHBondContact O-CB 3.45Å; E107-Q110 PolarHBondContact O-N 2.96Å; E107-Q110 VanDerWaalsContact O-N 3.1Å; E107-M111 WeakPolarHBondContact O-CG 3.49Å; E107-M111 PolarHBondContact O-N 3.22Å
108	M	88.1	Confident	82.4	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.02	30%	0.298	C	S	.	.	H	α-helix	trans	-55.2	-48.8	169.8	-179.2	48.7	60.7	0	0	112	T104 Q110 M111 L112 D148 L149 V152 M199	T104-M108 WeakPolarHBondContact O-CB 3.37Å; T104-M108 PolarHBondContact O-N 3.01Å; M108-Q110 PolarHBondContact O-N 3.26Å; M108-M111 HydrophobicContact CE-CE 3.74Å; M108-M111 PolarHBondContact O-N 2.87Å; M108-M111 HydrophobicContact SD-CE 4.41Å; M108-L112 HydrophobicContact CG-CD1 4.03Å; M108-L112 HydrophobicContact CG-CG 4.5Å; M108-L112 WeakPolarHBondContact O-CG 3.28Å; M108-L112 PolarHBondContact O-N 3.34Å; M108-L112 HydrophobicContact SD-CD1 3.88Å; M108-L112 HydrophobicContact SD-CD2 4.2Å; M108-L112 HydrophobicContact SD-CG 3.83Å; M108-D148 HydrophobicContact CE-CB 3.46Å; M108-D148 VanDerWaalsContact CE-CB 3.46Å; M108-L149 HydrophobicContact CG-CD2 3.75Å; M108-L149 HydrophobicContact CG-CG 4.19Å; M108-L149 HydrophobicContact SD-CD2 4.05Å; M108-L149 HydrophobicContact SD-CG 3.8Å; M108-V152 HydrophobicContact CE-CG2 4.15Å; M108-M199 HydrophobicContact CG-CE 4.4Å
109	A	79.6	Confident	81.9	Confident	35 Å²	35	56.9 Å²	56.9	29%	0.289	30%	0.299	S	S	.	.	H	α-helix	trans	-55.5	-38.3	175.8	0	0	0	0	0	112.7	V105 K106 E107 Q113 M199	V105-A109 PolarHBondContact O-N 2.87Å; K106-A109 WeakPolarHBondContact O-CB 3.47Å; K106-A109 PolarHBondContact O-N 3.46Å; E107-A109 PolarHBondContact O-N 3.01Å; A109-Q113 VanDerWaalsContact O-CB 3.24Å; A109-Q113 WeakPolarHBondContact O-CB 3.47Å; A109-Q113 PolarHBondContact O-N 3.43Å; A109-M199 VanDerWaalsContact CA-SD 3.57Å; A109-M199 HydrophobicContact CB-CE 4.39Å; A109-M199 HydrophobicContact CB-SD 3.39Å; A109-M199 WeakPolarHBondContact CB-SD 3.48Å
110	Q	80.3	Confident	80.8	Confident	102 Å²	102	53.4 Å²	53.4	48%	0.477	29%	0.29	S	S	.	.	H	α-helix	trans	-72.7	-37	179.3	-70.9	178	-32	0	0	112.8	K106 E107 M108 Q113 S114	K106-Q110 WeakPolarHBondContact O-CG 3.41Å; K106-Q110 PolarHBondContact O-N 2.95Å; K106-Q110 VanDerWaalsContact O-N 3.12Å; E107-Q110 WeakPolarHBondContact O-CB 3.45Å; E107-Q110 PolarHBondContact O-N 2.96Å; E107-Q110 VanDerWaalsContact O-N 3.1Å; M108-Q110 PolarHBondContact O-N 3.26Å; Q110-Q113 PolarHBondContact O-N 3.09Å; Q110-S114 PolarHBondContact O-N 2.96Å; Q110-S114 PolarHBondContact O-OG 3.3Å
111	M	84.4	Confident	79.5	Confident	81 Å²	81	53 Å²	53	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-69.7	-41.3	176.4	-66.7	-172.4	-65.6	0	0	112.4	E107 M108 Q113 S114 F115 L145	E107-M111 WeakPolarHBondContact O-CG 3.49Å; E107-M111 PolarHBondContact O-N 3.22Å; M108-M111 HydrophobicContact CE-CE 3.74Å; M108-M111 PolarHBondContact O-N 2.87Å; M108-M111 HydrophobicContact SD-CE 4.41Å; M111-Q113 VanDerWaalsContact C-N 3.32Å; M111-Q113 PolarHBondContact O-N 3.1Å; M111-S114 PolarHBondContact O-N 2.99Å; M111-S114 PolarHBondContact O-OG 3.39Å; M111-F115 PolarHBondContact O-N 3.45Å; M111-F115 VanDerWaalsContact O-N 3.13Å; M111-L145 HydrophobicContact CB-CD2 3.96Å
112	L	82.6	Confident	78.2	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-38.8	173.3	-61.7	171.2	0	0	0	111.2	M108 G116 L145 L149 M199 F203	M108-L112 HydrophobicContact CG-CD1 4.03Å; M108-L112 HydrophobicContact CG-CG 4.5Å; M108-L112 WeakPolarHBondContact O-CG 3.28Å; M108-L112 PolarHBondContact O-N 3.34Å; M108-L112 HydrophobicContact SD-CD1 3.88Å; M108-L112 HydrophobicContact SD-CD2 4.2Å; M108-L112 HydrophobicContact SD-CG 3.83Å; L112-G116 PolarHBondContact O-N 2.93Å; L112-L145 HydrophobicContact CD2-CB 4.01Å; L112-L145 HydrophobicContact CD2-CD1 4.43Å; L112-L145 HydrophobicContact CD2-CD2 4.48Å; L112-L149 HydrophobicContact CD1-CD1 3.93Å; L112-L149 HydrophobicContact CD1-CD2 3.99Å; L112-L149 HydrophobicContact CD1-CG 4.11Å; L112-L149 HydrophobicContact CD2-CD1 3.98Å; L112-L149 HydrophobicContact CD2-CG 4.48Å; L112-M199 HydrophobicContact CD1-CB 4.1Å; L112-F203 HydrophobicContact CD2-CD1 3.78Å; L112-F203 HydrophobicContact CD2-CD2 3.86Å; L112-F203 HydrophobicContact CD2-CE1 3.77Å; L112-F203 HydrophobicContact CD2-CE2 3.88Å; L112-F203 HydrophobicContact CD2-CG 3.81Å; L112-F203 HydrophobicContact CD2-CZ 3.82Å
113	Q	75.4	Confident	77	Confident	111 Å²	111	62.5 Å²	62.5	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-67	-41.7	176.4	-175.6	178.2	7.6	0	0	112.6	A109 Q110 M111 T117	A109-Q113 VanDerWaalsContact O-CB 3.24Å; A109-Q113 WeakPolarHBondContact O-CB 3.47Å; A109-Q113 PolarHBondContact O-N 3.43Å; Q110-Q113 PolarHBondContact O-N 3.09Å; M111-Q113 VanDerWaalsContact C-N 3.32Å; M111-Q113 PolarHBondContact O-N 3.1Å; Q113-T117 WeakPolarHBondContact O-CB 3.37Å; Q113-T117 PolarHBondContact O-N 3.37Å; Q113-T117 PolarHBondContact O-OG1 3.18Å
114	S	78.7	Confident	76	Confident	73 Å²	73	61.5 Å²	61.5	51%	0.51	32%	0.324	S	S	.	.	H	α-helix	trans	-67.9	-46	-179.6	62.5	0	0	0	0	111.5	Q110 M111 T117 E118	Q110-S114 PolarHBondContact O-N 2.96Å; Q110-S114 PolarHBondContact O-OG 3.3Å; M111-S114 PolarHBondContact O-N 2.99Å; M111-S114 PolarHBondContact O-OG 3.39Å; S114-T117 WeakPolarHBondContact O-CB 3.3Å; S114-T117 PolarHBondContact O-N 3.35Å; S114-T117 VanDerWaalsContact O-N 3.12Å; S114-E118 PolarHBondContact O-N 2.78Å
115	F	83.8	Confident	74.7	Confident	9 Å²	9	62.3 Å²	62.3	4%	0.039	33%	0.33	C	S	.	.	H	α-helix	trans	-64.3	-42	175.5	179.7	-121.6	0	0	0	112.3	M111 T117 E118 L119 R138 R141 L145 F203 W207	M111-F115 PolarHBondContact O-N 3.45Å; M111-F115 VanDerWaalsContact O-N 3.13Å; F115-T117 PolarHBondContact O-N 3.48Å; F115-E118 PolarHBondContact O-N 3.05Å; F115-L119 HydrophobicContact CD1-CD1 3.99Å; F115-L119 HydrophobicContact CD2-CD1 4.43Å; F115-L119 HydrophobicContact CD2-CG 4.3Å; F115-L119 HydrophobicContact CE1-CD1 3.61Å; F115-L119 HydrophobicContact CE1-CG 4.43Å; F115-L119 HydrophobicContact CE2-CD1 4.08Å; F115-L119 HydrophobicContact CE2-CD2 4.11Å; F115-L119 HydrophobicContact CE2-CG 4.02Å; F115-L119 HydrophobicContact CG-CD1 4.4Å; F115-L119 HydrophobicContact CZ-CD1 3.67Å; F115-L119 HydrophobicContact CZ-CD2 4.18Å; F115-L119 HydrophobicContact CZ-CG 4.09Å; F115-L119 VanDerWaalsContact O-CG 3.31Å; F115-L119 WeakPolarHBondContact O-CG 3.44Å; F115-L119 PolarHBondContact O-N 3.13Å; F115-R138 WeakPolarHBondContact CZ-O 3.32Å; F115-R141 HydrophobicContact CD2-CB 4.4Å; F115-R141 HydrophobicContact CE2-CB 3.78Å; F115-R141 HydrophobicContact CZ-CB 3.92Å; F115-L145 HydrophobicContact CB-CD1 3.73Å; F115-L145 HydrophobicContact CD1-CD1 3.41Å; F115-L145 VanDerWaalsContact CD1-CD1 3.41Å; F115-L145 HydrophobicContact CE1-CD1 4.13Å; F115-L145 HydrophobicContact CG-CD1 3.69Å; F115-F203 AromaticContact CD1-CE2 3.78Å; F115-F203 HydrophobicContact CD1-CE2 3.78Å; F115-F203 AromaticContact CD1-CZ 3.7Å; F115-F203 HydrophobicContact CD1-CZ 3.7Å; F115-F203 HydrophobicContact CE1-CE2 4.19Å; F115-F203 AromaticContact CE1-CZ 3.87Å; F115-F203 HydrophobicContact CE1-CZ 3.87Å; F115-W207 HydrophobicContact CE1-CE3 4.42Å; F115-W207 HydrophobicContact CE1-CZ3 4.33Å; F115-W207 HydrophobicContact CZ-CZ3 4.08Å
116	G	74.9	Confident	73.4	Confident	18 Å²	18	70.9 Å²	70.9	19%	0.186	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-28.4	172.4	0	0	0	0	0	113.7	L112 A120	L112-G116 PolarHBondContact O-N 2.93Å; G116-A120 WeakPolarHBondContact O-CB 3.45Å; G116-A120 PolarHBondContact O-N 3.41Å
117	T	73	Confident	72.8	Confident	51 Å²	51	68 Å²	68	31%	0.313	36%	0.361	S	S	.	.	H	α-helix	trans	-76.4	-46	173.8	-54.8	0	0	0	0	111.2	Q113 S114 F115 L119 A120 E121	Q113-T117 WeakPolarHBondContact O-CB 3.37Å; Q113-T117 PolarHBondContact O-N 3.37Å; Q113-T117 PolarHBondContact O-OG1 3.18Å; S114-T117 WeakPolarHBondContact O-CB 3.3Å; S114-T117 PolarHBondContact O-N 3.35Å; S114-T117 VanDerWaalsContact O-N 3.12Å; F115-T117 PolarHBondContact O-N 3.48Å; T117-L119 VanDerWaalsContact C-N 3.34Å; T117-L119 PolarHBondContact O-N 3.5Å; T117-A120 CarbonylContact O-C 3.57Å; T117-A120 WeakPolarHBondContact O-CA 3.27Å; T117-A120 WeakPolarHBondContact O-CB 3.47Å; T117-A120 PolarHBondContact O-N 3.07Å; T117-E121 HydrophobicContact CG2-CG 4.13Å; T117-E121 WeakPolarHBondContact O-CB 3.43Å; T117-E121 WeakPolarHBondContact O-CG 3.46Å; T117-E121 PolarHBondContact O-N 3.17Å
118	E	74.4	Confident	72	Confident	73 Å²	73	65 Å²	65	34%	0.341	35%	0.348	S	S	.	.	H	α-helix	trans	-52.4	-51.8	174.3	-173.9	-170.8	179.3	0	0	110.8	S114 F115 A120 E121 T122 R141	S114-E118 PolarHBondContact O-N 2.78Å; F115-E118 PolarHBondContact O-N 3.05Å; E118-A120 PolarHBondContact O-N 3.08Å; E118-E121 PolarHBondContact O-N 3.32Å; E118-E121 VanDerWaalsContact O-N 3.13Å; E118-T122 PolarHBondContact O-N 3.39Å; E118-T122 PolarHBondContact O-OG1 2.93Å; E118-R141 IonicContact OE1-CZ 3.31Å; E118-R141 IonicContact OE1-NH1 2.97Å; E118-R141 PolarHBondContact OE1-NH1 2.97Å; E118-R141 IonicContact OE1-NH2 3.28Å; E118-R141 IonicContact OE2-NH1 3.98Å; E118-R141 PolarHBondContact OE2-NH1 3.18Å
119	L	71.5	Confident	71.4	Confident	9 Å²	9	70.7 Å²	70.7	5%	0.047	38%	0.377	C	S	.	.	H	α-helix	trans	-60.1	-25.3	176.6	-68.4	175.6	0	0	0	114	F115 T117 R138 F206 W207 H210	F115-L119 HydrophobicContact CD1-CD1 3.99Å; F115-L119 HydrophobicContact CD2-CD1 4.43Å; F115-L119 HydrophobicContact CD2-CG 4.3Å; F115-L119 HydrophobicContact CE1-CD1 3.61Å; F115-L119 HydrophobicContact CE1-CG 4.43Å; F115-L119 HydrophobicContact CE2-CD1 4.08Å; F115-L119 HydrophobicContact CE2-CD2 4.11Å; F115-L119 HydrophobicContact CE2-CG 4.02Å; F115-L119 HydrophobicContact CG-CD1 4.4Å; F115-L119 HydrophobicContact CZ-CD1 3.67Å; F115-L119 HydrophobicContact CZ-CD2 4.18Å; F115-L119 HydrophobicContact CZ-CG 4.09Å; F115-L119 VanDerWaalsContact O-CG 3.31Å; F115-L119 WeakPolarHBondContact O-CG 3.44Å; F115-L119 PolarHBondContact O-N 3.13Å; T117-L119 VanDerWaalsContact C-N 3.34Å; T117-L119 PolarHBondContact O-N 3.5Å; L119-R138 HydrophobicContact CD2-CB 4.12Å; L119-R138 VanDerWaalsContact CD2-CD 3.45Å; L119-R138 HydrophobicContact CD2-CG 3.69Å; L119-F206 HydrophobicContact CB-CE1 4.45Å; L119-F206 HydrophobicContact CB-CZ 4.43Å; L119-F206 HydrophobicContact CD1-CE1 3.87Å; L119-W207 HydrophobicContact CD1-CE3 4.07Å; L119-W207 HydrophobicContact CD1-CZ3 3.92Å; L119-W207 HydrophobicContact CD2-CZ3 4.33Å; L119-H210 PolarHBondContact O-CE1 3.22Å; L119-H210 VanDerWaalsContact O-CE1 3.26Å
120	A	62.3	Low	71.2	Confident	40 Å²	40	71.1 Å²	71.1	33%	0.331	38%	0.378	S	S	.	.	H	α-helix	trans	-88.7	-26.8	177.6	0	0	0	0	0	113	G116 T117 E118 K719	G116-A120 WeakPolarHBondContact O-CB 3.45Å; G116-A120 PolarHBondContact O-N 3.41Å; T117-A120 CarbonylContact O-C 3.57Å; T117-A120 WeakPolarHBondContact O-CA 3.27Å; T117-A120 WeakPolarHBondContact O-CB 3.47Å; T117-A120 PolarHBondContact O-N 3.07Å; E118-A120 PolarHBondContact O-N 3.08Å; A120-K719 WeakPolarHBondContact O-CD 3.42Å; A120-K719 WeakPolarHBondContact O-CE 3.3Å; A120-K719 PolarHBondContact O-NZ 2.96Å
121	E	58	Low	70.8	Confident	117 Å²	117	66.5 Å²	66.5	55%	0.547	36%	0.357	S	S	.	.	H	α-helix	trans	-100	-32.1	-172.5	-67.7	-169.7	157.9	0	0	114	T117 E118 E123	T117-E121 HydrophobicContact CG2-CG 4.13Å; T117-E121 WeakPolarHBondContact O-CB 3.43Å; T117-E121 WeakPolarHBondContact O-CG 3.46Å; T117-E121 PolarHBondContact O-N 3.17Å; E118-E121 PolarHBondContact O-N 3.32Å; E118-E121 VanDerWaalsContact O-N 3.13Å; E121-E123 PolarHBondContact O-N 3.14Å
122	T	63.6	Low	70.5	Confident	61 Å²	61	66 Å²	66	37%	0.374	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-59.8	128.8	-179.3	-48.5	0	0	0	0	112.7	E118 R138	E118-T122 PolarHBondContact O-N 3.39Å; E118-T122 PolarHBondContact O-OG1 2.93Å; T122-R138 PolarHBondContact OG1-NH2 3.22Å
123	E	57.4	Low	70.5	Confident	175 Å²	175	72.2 Å²	72.2	82%	0.818	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-82.2	139.4	168.3	-56.9	-169.1	149.5	0	0	109.9	E121	E121-E123 PolarHBondContact O-N 3.14Å
124	L	63.8	Low	70.7	Confident	49 Å²	49	69.7 Å²	69.7	26%	0.257	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-80.9	139.2	179.9	-67.6	174.7	0	0	0	110.4	M214 Y217	L124-M214 HydrophobicContact CD1-SD 4.13Å; L124-Y217 HydrophobicContact CD1-CD1 3.69Å; L124-Y217 HydrophobicContact CD1-CE1 3.59Å; L124-Y217 HydrophobicContact CD1-CG 4.43Å
125	P	63.6	Low	70.8	Confident	48 Å²	48	68 Å²	68	31%	0.312	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-58.8	172	169.8	-24.7	35.5	0	0	0	113.2	I131 I134	P125-I131 WeakPolarHBondContact O-CD1 3.39Å; P125-I134 HydrophobicContact CG-CD1 3.76Å
126	Q	56.8	Low	70.9	Confident	184 Å²	184	70.6 Å²	70.6	86%	0.86	38%	0.38	S	S	*	.	S	Bend	trans	-89.8	-9.4	172.8	-67.5	-176	-11.6	0	0	113.8
127	D	71.2	Confident	71.4	Confident	71 Å²	71	70.9 Å²	70.9	38%	0.38	38%	0.383	S	S	.	.			trans	-94.7	138.7	-178.6	168.7	53.1	0	0	0	112.4	L129 S130 I131	D127-L129 PolarHBondContact OD2-N 3.07Å; D127-S130 VanDerWaalsContact OD2-CB 3.28Å; D127-S130 WeakPolarHBondContact OD2-CB 3.3Å; D127-S130 PolarHBondContact OD2-N 2.99Å; D127-S130 PolarHBondContact OD2-OG 3.33Å; D127-I131 WeakPolarHBondContact O-CD1 3.41Å; D127-I131 WeakPolarHBondContact O-CG1 3.39Å; D127-I131 PolarHBondContact O-N 3.35Å; D127-I131 VanDerWaalsContact O-N 3.1Å
128	I	68.8	Low	72	Confident	39 Å²	39	69 Å²	69	20%	0.2	37%	0.37	C	S	.	.	H	α-helix	trans	-66	-48.7	-177	-46.4	172.2	0	0	0	111.1	S130 I131 E132 L218 W221	I128-S130 VanDerWaalsContact C-N 3.34Å; I128-S130 PolarHBondContact O-N 3.15Å; I128-I131 WeakPolarHBondContact O-CB 3.43Å; I128-I131 PolarHBondContact O-N 2.94Å; I128-I131 VanDerWaalsContact O-N 3.11Å; I128-E132 HydrophobicContact CG2-CG 4.36Å; I128-E132 WeakPolarHBondContact O-CG 3.25Å; I128-E132 PolarHBondContact O-N 3.11Å; I128-L218 HydrophobicContact CG2-CD1 4.42Å; I128-W221 HydrophobicContact CD1-CE3 4.3Å; I128-W221 HydrophobicContact CD1-CH2 3.58Å; I128-W221 HydrophobicContact CD1-CZ3 3.32Å; I128-W221 HydrophobicContact CG1-CE3 4.14Å; I128-W221 HydrophobicContact CG1-CH2 3.5Å; I128-W221 VanDerWaalsContact CG1-CH2 3.5Å; I128-W221 HydrophobicContact CG1-CZ2 4.21Å; I128-W221 HydrophobicContact CG1-CZ3 3.45Å; I128-W221 VanDerWaalsContact CG1-CZ3 3.45Å
129	L	74.8	Confident	72.7	Confident	123 Å²	123	66.9 Å²	66.9	64%	0.644	37%	0.365	S	S	*	.	H	α-helix	trans	-65.3	-43.8	-172.8	-60.9	175.1	0	0	0	109.8	D127 I131 E132 E133	D127-L129 PolarHBondContact OD2-N 3.07Å; L129-I131 VanDerWaalsContact C-N 3.34Å; L129-I131 PolarHBondContact O-N 3.15Å; L129-E132 PolarHBondContact O-N 3.47Å; L129-E133 WeakPolarHBondContact O-CB 3.44Å; L129-E133 PolarHBondContact O-N 2.95Å
130	S	75.6	Confident	73.6	Confident	44 Å²	44	73.4 Å²	73.4	31%	0.308	40%	0.395	S	S	.	.	H	α-helix	trans	-58.7	-40.3	172.1	-55.4	0	0	0	0	112.7	D127 I128 I134	D127-S130 VanDerWaalsContact OD2-CB 3.28Å; D127-S130 WeakPolarHBondContact OD2-CB 3.3Å; D127-S130 PolarHBondContact OD2-N 2.99Å; D127-S130 PolarHBondContact OD2-OG 3.33Å; I128-S130 VanDerWaalsContact C-N 3.34Å; I128-S130 PolarHBondContact O-N 3.15Å; S130-I134 VanDerWaalsContact O-CB 3.28Å; S130-I134 WeakPolarHBondContact O-CB 3.32Å; S130-I134 VanDerWaalsContact O-CD1 3.31Å; S130-I134 WeakPolarHBondContact O-CD1 3.45Å; S130-I134 WeakPolarHBondContact O-CG1 3.47Å; S130-I134 PolarHBondContact O-N 3.04Å; S130-I134 VanDerWaalsContact O-N 3.08Å
131	I	72.2	Confident	74.9	Confident	4 Å²	4	76.7 Å²	76.7	2%	0.021	40%	0.399	C	S	.	.	H	α-helix	trans	-65.9	-47.2	175.4	-70.5	161.7	0	0	0	110.7	P125 D127 I128 L129 I134 L135 Y217 L218	P125-I131 WeakPolarHBondContact O-CD1 3.39Å; D127-I131 WeakPolarHBondContact O-CD1 3.41Å; D127-I131 WeakPolarHBondContact O-CG1 3.39Å; D127-I131 PolarHBondContact O-N 3.35Å; D127-I131 VanDerWaalsContact O-N 3.1Å; I128-I131 WeakPolarHBondContact O-CB 3.43Å; I128-I131 PolarHBondContact O-N 2.94Å; I128-I131 VanDerWaalsContact O-N 3.11Å; L129-I131 VanDerWaalsContact C-N 3.34Å; L129-I131 PolarHBondContact O-N 3.15Å; I131-I134 PolarHBondContact O-N 3.24Å; I131-L135 HydrophobicContact CG2-CD1 3.8Å; I131-L135 HydrophobicContact CG2-CG 4.32Å; I131-L135 WeakPolarHBondContact O-CB 3.41Å; I131-L135 VanDerWaalsContact O-CG 3.27Å; I131-L135 WeakPolarHBondContact O-CG 3.24Å; I131-L135 PolarHBondContact O-N 2.99Å; I131-Y217 HydrophobicContact CD1-CE1 4.47Å; I131-L218 HydrophobicContact CG2-CD1 4.45Å
132	E	78.2	Confident	76.5	Confident	71 Å²	71	72.3 Å²	72.3	33%	0.332	38%	0.378	S	S	.	.	H	α-helix	trans	-66.6	-39.8	-176.4	-70.4	-178.5	158	0	0	111.8	I128 L129 L135 A136 L218 K222	I128-E132 HydrophobicContact CG2-CG 4.36Å; I128-E132 WeakPolarHBondContact O-CG 3.25Å; I128-E132 PolarHBondContact O-N 3.11Å; L129-E132 PolarHBondContact O-N 3.47Å; E132-L135 PolarHBondContact O-N 3.5Å; E132-A136 WeakPolarHBondContact O-CB 3.29Å; E132-A136 PolarHBondContact O-N 3.06Å; E132-L218 HydrophobicContact CG-CD1 4.29Å; E132-L218 HydrophobicContact CG-CD2 4.18Å; E132-L218 WeakPolarHBondContact OE1-CD2 3.42Å; E132-K222 IonicContact OE1-NZ 2.74Å; E132-K222 PolarHBondContact OE1-NZ 3.09Å
133	E	82.6	Confident	77.9	Confident	147 Å²	147	74.5 Å²	74.5	69%	0.687	38%	0.384	S	S	*	.	H	α-helix	trans	-62.6	-46.7	172.1	-175.1	177.1	-158.8	0	0	112.1	L129 L135 A136 G137	L129-E133 WeakPolarHBondContact O-CB 3.44Å; L129-E133 PolarHBondContact O-N 2.95Å; E133-L135 VanDerWaalsContact C-N 3.29Å; E133-L135 PolarHBondContact O-N 3.06Å; E133-A136 PolarHBondContact O-N 3.18Å; E133-G137 PolarHBondContact O-N 3.27Å
134	I	80.1	Confident	79.6	Confident	58 Å²	58	71.1 Å²	71.1	30%	0.297	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-37.5	176.6	-74.5	168.7	0	0	0	111.4	P125 S130 I131 R138	P125-I134 HydrophobicContact CG-CD1 3.76Å; S130-I134 VanDerWaalsContact O-CB 3.28Å; S130-I134 WeakPolarHBondContact O-CB 3.32Å; S130-I134 VanDerWaalsContact O-CD1 3.31Å; S130-I134 WeakPolarHBondContact O-CD1 3.45Å; S130-I134 WeakPolarHBondContact O-CG1 3.47Å; S130-I134 PolarHBondContact O-N 3.04Å; S130-I134 VanDerWaalsContact O-N 3.08Å; I131-I134 PolarHBondContact O-N 3.24Å; I134-R138 VanDerWaalsContact CG2-CZ 3.45Å; I134-R138 VanDerWaalsContact O-CD 3.29Å; I134-R138 WeakPolarHBondContact O-CD 3.4Å; I134-R138 WeakPolarHBondContact O-CG 3.1Å; I134-R138 PolarHBondContact O-N 3.29Å
135	L	81.1	Confident	81	Confident	37 Å²	37	69.8 Å²	69.8	19%	0.194	36%	0.363	C	S	.	.	H	α-helix	trans	-71	-39.6	177	-70	174.6	0	0	0	112.1	I131 E132 E133 R138 A139 M214	I131-L135 HydrophobicContact CG2-CD1 3.8Å; I131-L135 HydrophobicContact CG2-CG 4.32Å; I131-L135 WeakPolarHBondContact O-CB 3.41Å; I131-L135 VanDerWaalsContact O-CG 3.27Å; I131-L135 WeakPolarHBondContact O-CG 3.24Å; I131-L135 PolarHBondContact O-N 2.99Å; E132-L135 PolarHBondContact O-N 3.5Å; E133-L135 VanDerWaalsContact C-N 3.29Å; E133-L135 PolarHBondContact O-N 3.06Å; L135-R138 PolarHBondContact O-N 3.31Å; L135-A139 PolarHBondContact O-N 2.99Å; L135-M214 HydrophobicContact CD1-CB 4.11Å; L135-M214 HydrophobicContact CD2-CB 3.7Å; L135-M214 HydrophobicContact CD2-CG 3.58Å; L135-M214 HydrophobicContact CD2-SD 4.2Å
136	A	85	Confident	82.4	Confident	64 Å²	64	69.3 Å²	69.3	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-50	174.7	0	0	0	0	0	111.9	E132 E133 R138 A139 E140	E132-A136 WeakPolarHBondContact O-CB 3.29Å; E132-A136 PolarHBondContact O-N 3.06Å; E133-A136 PolarHBondContact O-N 3.18Å; A136-R138 PolarHBondContact O-N 3.28Å; A136-A139 WeakPolarHBondContact O-CB 3.35Å; A136-A139 PolarHBondContact O-N 2.76Å; A136-E140 PolarHBondContact O-N 3.48Å
137	G	85.5	Confident	84.2	Confident	24 Å²	24	65.6 Å²	65.6	25%	0.247	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-22.7	177.7	0	0	0	0	0	114.1	E133 R141	E133-G137 PolarHBondContact O-N 3.27Å; G137-R141 WeakPolarHBondContact O-CG 3.25Å; G137-R141 PolarHBondContact O-N 2.72Å
138	R	86.1	Confident	85.2	Confident	10 Å²	10	65.1 Å²	65.1	4%	0.038	34%	0.34	C	S	.	.	H	α-helix	trans	-75.9	-41.1	170.4	-74.1	164.4	175.4	177.8	5.4	112.2	F115 L119 T122 I134 L135 A136 E140 R141 Y142 W207	F115-R138 WeakPolarHBondContact CZ-O 3.32Å; L119-R138 HydrophobicContact CD2-CB 4.12Å; L119-R138 VanDerWaalsContact CD2-CD 3.45Å; L119-R138 HydrophobicContact CD2-CG 3.69Å; T122-R138 PolarHBondContact OG1-NH2 3.22Å; I134-R138 VanDerWaalsContact CG2-CZ 3.45Å; I134-R138 VanDerWaalsContact O-CD 3.29Å; I134-R138 WeakPolarHBondContact O-CD 3.4Å; I134-R138 WeakPolarHBondContact O-CG 3.1Å; I134-R138 PolarHBondContact O-N 3.29Å; L135-R138 PolarHBondContact O-N 3.31Å; A136-R138 PolarHBondContact O-N 3.28Å; R138-E140 VanDerWaalsContact C-N 3.3Å; R138-E140 PolarHBondContact O-N 2.99Å; R138-R141 PolarHBondContact O-N 3.46Å; R138-Y142 PolarHBondContact O-N 2.99Å; R138-W207 HydrophobicContact CB-CH2 3.96Å; R138-W207 HydrophobicContact CB-CZ3 4.28Å
139	A	87.6	Confident	86.4	Confident	30 Å²	30	63.2 Å²	63.2	25%	0.248	33%	0.33	C	S	.	.	H	α-helix	trans	-62.1	-40.1	176.2	0	0	0	0	0	111.3	L135 A136 Y142 H143 W207	L135-A139 PolarHBondContact O-N 2.99Å; A136-A139 WeakPolarHBondContact O-CB 3.35Å; A136-A139 PolarHBondContact O-N 2.76Å; A139-Y142 WeakPolarHBondContact O-CB 3.11Å; A139-Y142 PolarHBondContact O-N 3.49Å; A139-H143 PolarHBondContact O-CD2 3.12Å; A139-H143 PolarHBondContact O-N 3.03Å; A139-W207 HydrophobicContact CB-CH2 4.33Å; A139-W207 HydrophobicContact CB-CZ2 3.97Å
140	E	90.9	Very high	87.2	Confident	145 Å²	145	59.7 Å²	59.7	68%	0.678	31%	0.314	S	S	*	.	H	α-helix	trans	-58.3	-49.2	173.1	-174.9	177.6	-148.4	0	0	112.4	A136 R138 Y142 H143 L144	A136-E140 PolarHBondContact O-N 3.48Å; R138-E140 VanDerWaalsContact C-N 3.3Å; R138-E140 PolarHBondContact O-N 2.99Å; E140-Y142 VanDerWaalsContact C-N 3.33Å; E140-Y142 PolarHBondContact O-N 3.38Å; E140-H143 PolarHBondContact O-N 2.97Å; E140-H143 VanDerWaalsContact O-N 3.16Å; E140-L144 PolarHBondContact O-N 3.2Å
141	R	89.8	Confident	88.1	Confident	109 Å²	109	60 Å²	60	41%	0.411	32%	0.32	S	S	.	.	H	α-helix	trans	-63.5	-35.5	176.8	-68.9	-175.7	-145.2	163.2	6.5	113.3	F115 E118 G137 R138 L144 L145	F115-R141 HydrophobicContact CD2-CB 4.4Å; F115-R141 HydrophobicContact CE2-CB 3.78Å; F115-R141 HydrophobicContact CZ-CB 3.92Å; E118-R141 IonicContact OE1-CZ 3.31Å; E118-R141 IonicContact OE1-NH1 2.97Å; E118-R141 PolarHBondContact OE1-NH1 2.97Å; E118-R141 IonicContact OE1-NH2 3.28Å; E118-R141 IonicContact OE2-NH1 3.98Å; E118-R141 PolarHBondContact OE2-NH1 3.18Å; G137-R141 WeakPolarHBondContact O-CG 3.25Å; G137-R141 PolarHBondContact O-N 2.72Å; R138-R141 PolarHBondContact O-N 3.46Å; R141-L144 PolarHBondContact O-N 2.88Å; R141-L145 WeakPolarHBondContact O-CG 3.45Å; R141-L145 PolarHBondContact O-N 3.2Å
142	Y	91.8	Very high	89.2	Confident	25 Å²	25	60.3 Å²	60.3	10%	0.098	32%	0.321	C	S	.	.	H	α-helix	trans	-59.7	-47.5	172	166.8	-100.4	0	0	0	111.1	R138 A139 E140 L144 L145 K146 F203 D204 W207	R138-Y142 PolarHBondContact O-N 2.99Å; A139-Y142 WeakPolarHBondContact O-CB 3.11Å; A139-Y142 PolarHBondContact O-N 3.49Å; E140-Y142 VanDerWaalsContact C-N 3.33Å; E140-Y142 PolarHBondContact O-N 3.38Å; Y142-L144 PolarHBondContact O-N 3.25Å; Y142-L145 PolarHBondContact O-N 3.11Å; Y142-K146 VanDerWaalsContact O-CB 3.3Å; Y142-K146 WeakPolarHBondContact O-CB 3.17Å; Y142-K146 PolarHBondContact O-N 3.31Å; Y142-F203 HydrophobicContact CD2-CD1 4.01Å; Y142-F203 AromaticContact CD2-CE1 3.32Å; Y142-F203 HydrophobicContact CD2-CE1 3.32Å; Y142-F203 HydrophobicContact CD2-CE2 4.49Å; Y142-F203 AromaticContact CD2-CZ 3.61Å; Y142-F203 HydrophobicContact CD2-CZ 3.61Å; Y142-F203 AromaticContact CE2-CD1 3.77Å; Y142-F203 HydrophobicContact CE2-CD1 3.77Å; Y142-F203 AromaticContact CE2-CE1 3.57Å; Y142-F203 HydrophobicContact CE2-CE1 3.57Å; Y142-F203 HydrophobicContact CE2-CZ 4.23Å; Y142-F203 HydrophobicContact CG-CE1 4.38Å; Y142-D204 PolarHBondContact OH-OD1 2.91Å; Y142-W207 AromaticContact CD1-CD1 3.87Å; Y142-W207 HydrophobicContact CD1-CD2 4.09Å; Y142-W207 AromaticContact CD1-CE2 3.97Å; Y142-W207 HydrophobicContact CD1-CG 4.06Å; Y142-W207 AromaticContact CD1-NE1 3.82Å; Y142-W207 HydrophobicContact CD2-CB 3.65Å; Y142-W207 AromaticContact CD2-CD1 4Å; Y142-W207 AromaticContact CD2-CD2 3.59Å; Y142-W207 HydrophobicContact CD2-CD2 3.59Å; Y142-W207 AromaticContact CD2-CE3 3.95Å; Y142-W207 HydrophobicContact CD2-CE3 3.95Å; Y142-W207 AromaticContact CD2-CG 3.41Å; Y142-W207 HydrophobicContact CD2-CG 3.41Å; Y142-W207 VanDerWaalsContact CD2-CG 3.41Å; Y142-W207 AromaticContact CE1-CD1 3.66Å; Y142-W207 HydrophobicContact CE1-CG 4.06Å; Y142-W207 AromaticContact CE1-NE1 3.97Å; Y142-W207 HydrophobicContact CE2-CB 3.37Å; Y142-W207 AromaticContact CE2-CD1 3.82Å; Y142-W207 HydrophobicContact CE2-CD2 4.14Å; Y142-W207 AromaticContact CE2-CG 3.43Å; Y142-W207 HydrophobicContact CE2-CG 3.43Å; Y142-W207 VanDerWaalsContact CE2-CG 3.43Å; Y142-W207 HydrophobicContact CG-CB 4.46Å; Y142-W207 AromaticContact CG-CD2 3.57Å; Y142-W207 HydrophobicContact CG-CD2 3.57Å; Y142-W207 AromaticContact CG-CE2 3.85Å; Y142-W207 AromaticContact CG-CE3 3.99Å; Y142-W207 HydrophobicContact CG-CE3 3.99Å; Y142-W207 AromaticContact CG-CG 3.74Å; Y142-W207 HydrophobicContact CG-CG 3.74Å; Y142-W207 HydrophobicContact CG-CZ2 4.49Å; Y142-W207 AromaticContact CZ-CD1 3.62Å; Y142-W207 AromaticContact CZ-CG 3.76Å
143	H	92.3	Very high	89.9	Confident	108 Å²	108	57.9 Å²	57.9	50%	0.5	31%	0.311	S	S	.	.	H	α-helix	trans	-64.5	-36.2	177.1	-70.5	-57.7	0	0	0	113.1	A139 E140 K146 N147	A139-H143 PolarHBondContact O-CD2 3.12Å; A139-H143 PolarHBondContact O-N 3.03Å; E140-H143 PolarHBondContact O-N 2.97Å; E140-H143 VanDerWaalsContact O-N 3.16Å; H143-K146 PolarHBondContact O-N 2.67Å; H143-N147 VanDerWaalsContact O-CG 3.29Å; H143-N147 PolarHBondContact O-N 2.9Å; H143-N147 PolarHBondContact O-ND2 3.28Å; H143-N147 VanDerWaalsContact O-ND2 3.17Å
144	L	94.3	Very high	90.4	Very high	104 Å²	104	57.3 Å²	57.3	55%	0.545	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-54.4	173.6	-175.8	63.5	0	0	0	111.3	E140 R141 Y142 K146 N147 D148	E140-L144 PolarHBondContact O-N 3.2Å; R141-L144 PolarHBondContact O-N 2.88Å; Y142-L144 PolarHBondContact O-N 3.25Å; L144-K146 PolarHBondContact O-N 3.43Å; L144-N147 WeakPolarHBondContact O-CB 3.3Å; L144-N147 PolarHBondContact O-N 2.58Å; L144-D148 PolarHBondContact O-N 3.01Å
145	L	93.2	Very high	90.9	Very high	20 Å²	20	57.7 Å²	57.7	11%	0.105	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-32.1	178.7	-70.7	167.3	0	0	0	112.7	M111 L112 F115 R141 Y142 D148 L149 F203	M111-L145 HydrophobicContact CB-CD2 3.96Å; L112-L145 HydrophobicContact CD2-CB 4.01Å; L112-L145 HydrophobicContact CD2-CD1 4.43Å; L112-L145 HydrophobicContact CD2-CD2 4.48Å; F115-L145 HydrophobicContact CB-CD1 3.73Å; F115-L145 HydrophobicContact CD1-CD1 3.41Å; F115-L145 VanDerWaalsContact CD1-CD1 3.41Å; F115-L145 HydrophobicContact CE1-CD1 4.13Å; F115-L145 HydrophobicContact CG-CD1 3.69Å; R141-L145 WeakPolarHBondContact O-CG 3.45Å; R141-L145 PolarHBondContact O-N 3.2Å; Y142-L145 PolarHBondContact O-N 3.11Å; L145-D148 PolarHBondContact O-N 3.35Å; L145-L149 WeakPolarHBondContact O-CB 3.28Å; L145-L149 PolarHBondContact O-N 3.01Å; L145-F203 HydrophobicContact CB-CE1 4.03Å; L145-F203 HydrophobicContact CB-CZ 4.1Å; L145-F203 HydrophobicContact CD1-CZ 3.96Å
146	K	93	Very high	91.4	Very high	39 Å²	39	55.9 Å²	55.9	17%	0.17	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-38.4	173.7	-174.8	59.9	164.6	-179.2	0	112.5	Y142 H143 L144 T150 E200 D204	Y142-K146 VanDerWaalsContact O-CB 3.3Å; Y142-K146 WeakPolarHBondContact O-CB 3.17Å; Y142-K146 PolarHBondContact O-N 3.31Å; H143-K146 PolarHBondContact O-N 2.67Å; L144-K146 PolarHBondContact O-N 3.43Å; K146-T150 WeakPolarHBondContact O-CB 3.48Å; K146-T150 PolarHBondContact O-N 3.08Å; K146-T150 VanDerWaalsContact O-N 3.09Å; K146-T150 PolarHBondContact O-OG1 2.97Å; K146-E200 IonicContact NZ-OE1 3.5Å; K146-E200 PolarHBondContact NZ-OE1 3.19Å; K146-D204 WeakPolarHBondContact CE-OD1 3.42Å; K146-D204 IonicContact NZ-OD1 3.03Å; K146-D204 PolarHBondContact NZ-OD1 3.35Å; K146-D204 IonicContact NZ-OD2 3.87Å; K146-D204 PolarHBondContact NZ-OD2 2.68Å
147	N	93.6	Very high	91.6	Very high	105 Å²	105	58.4 Å²	58.4	56%	0.561	30%	0.297	S	S	*	.	H	α-helix	trans	-66.6	-40.8	172.9	-71.6	-34.2	0	0	0	111.4	H143 L144 T150 A151	H143-N147 VanDerWaalsContact O-CG 3.29Å; H143-N147 PolarHBondContact O-N 2.9Å; H143-N147 PolarHBondContact O-ND2 3.28Å; H143-N147 VanDerWaalsContact O-ND2 3.17Å; L144-N147 WeakPolarHBondContact O-CB 3.3Å; L144-N147 PolarHBondContact O-N 2.58Å; N147-T150 CarbonylContact O-C 3.5Å; N147-T150 WeakPolarHBondContact O-CA 3.36Å; N147-T150 VanDerWaalsContact O-CB 3.32Å; N147-T150 WeakPolarHBondContact O-CB 3.42Å; N147-T150 PolarHBondContact O-N 3.24Å; N147-A151 PolarHBondContact O-N 2.93Å
148	D	93.7	Very high	91.7	Very high	61 Å²	61	61 Å²	61	33%	0.326	31%	0.308	S	S	.	.	H	α-helix	trans	-67.3	-43.2	177.9	-62.4	-31.3	0	0	0	111.8	M108 L144 L145 T150 A151 V152	M108-D148 HydrophobicContact CE-CB 3.46Å; M108-D148 VanDerWaalsContact CE-CB 3.46Å; L144-D148 PolarHBondContact O-N 3.01Å; L145-D148 PolarHBondContact O-N 3.35Å; D148-T150 PolarHBondContact O-N 3.27Å; D148-A151 WeakPolarHBondContact O-CA 3.37Å; D148-A151 WeakPolarHBondContact O-CB 3.13Å; D148-A151 PolarHBondContact O-N 3.46Å; D148-V152 WeakPolarHBondContact O-CG2 3.45Å; D148-V152 PolarHBondContact O-N 2.77Å
149	L	92.2	Very high	91.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-53	-42.6	168.9	-92.4	168.9	0	0	0	112	M108 L112 L145 A151 T153 V196 E200 F203	M108-L149 HydrophobicContact CG-CD2 3.75Å; M108-L149 HydrophobicContact CG-CG 4.19Å; M108-L149 HydrophobicContact SD-CD2 4.05Å; M108-L149 HydrophobicContact SD-CG 3.8Å; L112-L149 HydrophobicContact CD1-CD1 3.93Å; L112-L149 HydrophobicContact CD1-CD2 3.99Å; L112-L149 HydrophobicContact CD1-CG 4.11Å; L112-L149 HydrophobicContact CD2-CD1 3.98Å; L112-L149 HydrophobicContact CD2-CG 4.48Å; L145-L149 WeakPolarHBondContact O-CB 3.28Å; L145-L149 PolarHBondContact O-N 3.01Å; L149-A151 VanDerWaalsContact C-N 3.33Å; L149-T153 WeakPolarHBondContact O-CB 3.47Å; L149-T153 PolarHBondContact O-N 3.2Å; L149-T153 PolarHBondContact O-OG1 3.48Å; L149-V196 HydrophobicContact CD2-CG1 3.87Å; L149-E200 HydrophobicContact CD1-CB 4.08Å; L149-E200 HydrophobicContact CD1-CG 4.31Å; L149-E200 HydrophobicContact CD2-CB 4.29Å; L149-F203 HydrophobicContact CD1-CD1 4.16Å
150	T	93.5	Very high	91.6	Very high	48 Å²	48	61.3 Å²	61.3	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-66.5	-34.7	176.9	-58.2	0	0	0	0	111.7	K146 N147 D148 K154	K146-T150 WeakPolarHBondContact O-CB 3.48Å; K146-T150 PolarHBondContact O-N 3.08Å; K146-T150 VanDerWaalsContact O-N 3.09Å; K146-T150 PolarHBondContact O-OG1 2.97Å; N147-T150 CarbonylContact O-C 3.5Å; N147-T150 WeakPolarHBondContact O-CA 3.36Å; N147-T150 VanDerWaalsContact O-CB 3.32Å; N147-T150 WeakPolarHBondContact O-CB 3.42Å; N147-T150 PolarHBondContact O-N 3.24Å; D148-T150 PolarHBondContact O-N 3.27Å; T150-K154 VanDerWaalsContact O-CG 3.31Å; T150-K154 WeakPolarHBondContact O-CG 3.45Å; T150-K154 PolarHBondContact O-N 3.38Å; T150-K154 VanDerWaalsContact O-N 3.15Å
151	A	94.3	Very high	91.2	Very high	52 Å²	52	60.7 Å²	60.7	43%	0.43	30%	0.304	S	S	.	.	H	α-helix	trans	-69.9	-46.9	175.3	0	0	0	0	0	112.2	N147 D148 L149 T153 K154 E155	N147-A151 PolarHBondContact O-N 2.93Å; D148-A151 WeakPolarHBondContact O-CA 3.37Å; D148-A151 WeakPolarHBondContact O-CB 3.13Å; D148-A151 PolarHBondContact O-N 3.46Å; L149-A151 VanDerWaalsContact C-N 3.33Å; A151-T153 VanDerWaalsContact C-N 3.28Å; A151-T153 PolarHBondContact O-N 3.4Å; A151-K154 WeakPolarHBondContact O-CA 3.04Å; A151-K154 WeakPolarHBondContact O-CB 3.45Å; A151-K154 PolarHBondContact O-N 3.38Å; A151-E155 PolarHBondContact O-N 2.98Å
152	V	93.9	Very high	90.6	Very high	9 Å²	9	61.2 Å²	61.2	6%	0.055	32%	0.315	C	S	.	.	H	α-helix	trans	-60.6	-39.5	175	179.4	0	0	0	0	110.9	F101 T104 V105 M108 D148 K154 E155 G156 V196	F101-V152 HydrophobicContact CE2-CG1 3.76Å; F101-V152 WeakPolarHBondContact CE2-O 3.39Å; T104-V152 HydrophobicContact CG2-CG1 4.3Å; T104-V152 HydrophobicContact CG2-CG2 3.69Å; V105-V152 HydrophobicContact CG2-CG1 3.94Å; M108-V152 HydrophobicContact CE-CG2 4.15Å; D148-V152 WeakPolarHBondContact O-CG2 3.45Å; D148-V152 PolarHBondContact O-N 2.77Å; V152-K154 VanDerWaalsContact C-N 3.28Å; V152-K154 PolarHBondContact O-N 2.58Å; V152-E155 PolarHBondContact O-N 3.35Å; V152-G156 PolarHBondContact O-N 3.04Å; V152-V196 HydrophobicContact CG1-CG1 4.48Å; V152-V196 HydrophobicContact CG1-CG2 3.95Å
153	T	93.4	Very high	89.7	Confident	21 Å²	21	60.8 Å²	60.8	13%	0.129	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-34.6	173.5	-61.3	0	0	0	0	112.6	L149 A151 K157 V196	L149-T153 WeakPolarHBondContact O-CB 3.47Å; L149-T153 PolarHBondContact O-N 3.2Å; L149-T153 PolarHBondContact O-OG1 3.48Å; A151-T153 VanDerWaalsContact C-N 3.28Å; A151-T153 PolarHBondContact O-N 3.4Å; T153-K157 HydrophobicContact CG2-CD 4.16Å; T153-K157 WeakPolarHBondContact O-CB 3.29Å; T153-K157 WeakPolarHBondContact O-CD 3.41Å; T153-K157 VanDerWaalsContact O-CG 3.24Å; T153-K157 WeakPolarHBondContact O-CG 3.33Å; T153-K157 PolarHBondContact O-N 3.41Å; T153-V196 WeakPolarHBondContact OG1-CG1 3.25Å
154	K	92.6	Very high	88.3	Confident	134 Å²	134	61.9 Å²	61.9	58%	0.583	32%	0.32	S	S	*	.	H	α-helix	trans	-72.3	-44.1	173.9	-71.2	163.5	-178	170.7	0	111.6	T150 A151 V152 G156 K157 V158	T150-K154 VanDerWaalsContact O-CG 3.31Å; T150-K154 WeakPolarHBondContact O-CG 3.45Å; T150-K154 PolarHBondContact O-N 3.38Å; T150-K154 VanDerWaalsContact O-N 3.15Å; A151-K154 WeakPolarHBondContact O-CA 3.04Å; A151-K154 WeakPolarHBondContact O-CB 3.45Å; A151-K154 PolarHBondContact O-N 3.38Å; V152-K154 VanDerWaalsContact C-N 3.28Å; V152-K154 PolarHBondContact O-N 2.58Å; K154-G156 PolarHBondContact O-N 2.99Å; K154-K157 PolarHBondContact O-N 3.5Å; K154-V158 WeakPolarHBondContact O-CG2 3.32Å; K154-V158 PolarHBondContact O-N 3.14Å
155	E	91.8	Very high	86.5	Confident	66 Å²	66	62.1 Å²	62.1	31%	0.308	33%	0.325	S	S	.	.	H	α-helix	trans	-54.8	-51.6	176.1	-175	178.5	-148.8	0	0	110.7	K100 F101 T104 A151 V152 K157 V158 L159	K100-E155 IonicContact NZ-OE1 3.63Å; F101-E155 HydrophobicContact CD2-CB 4.47Å; F101-E155 HydrophobicContact CD2-CG 4.17Å; T104-E155 PolarHBondContact OG1-OE2 3.46Å; A151-E155 PolarHBondContact O-N 2.98Å; V152-E155 PolarHBondContact O-N 3.35Å; E155-K157 VanDerWaalsContact C-N 3.34Å; E155-K157 PolarHBondContact O-N 3.05Å; E155-V158 PolarHBondContact O-N 2.73Å; E155-L159 WeakPolarHBondContact O-CB 3.45Å; E155-L159 PolarHBondContact O-N 3.47Å
156	G	90.4	Very high	84.3	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-34.9	178.6	0	0	0	0	0	114.1	V152 K154 L160	V152-G156 PolarHBondContact O-N 3.04Å; K154-G156 PolarHBondContact O-N 2.99Å; G156-L160 WeakPolarHBondContact O-CB 3.48Å; G156-L160 PolarHBondContact O-N 2.86Å
157	K	89.6	Confident	81.9	Confident	116 Å²	116	68.9 Å²	68.9	50%	0.504	38%	0.383	S	S	.	.	H	α-helix	trans	-68.6	-40.2	175.6	-78.7	169.5	-179.4	171.1	0	112.1	T153 K154 E155 L160 M161 L193	T153-K157 HydrophobicContact CG2-CD 4.16Å; T153-K157 WeakPolarHBondContact O-CB 3.29Å; T153-K157 WeakPolarHBondContact O-CD 3.41Å; T153-K157 VanDerWaalsContact O-CG 3.24Å; T153-K157 WeakPolarHBondContact O-CG 3.33Å; T153-K157 PolarHBondContact O-N 3.41Å; K154-K157 PolarHBondContact O-N 3.5Å; E155-K157 VanDerWaalsContact C-N 3.34Å; E155-K157 PolarHBondContact O-N 3.05Å; K157-L160 PolarHBondContact O-N 3.42Å; K157-M161 WeakPolarHBondContact O-CG 3.44Å; K157-M161 PolarHBondContact O-N 3.06Å; K157-L193 HydrophobicContact CG-CD1 4.5Å; K157-L193 HydrophobicContact CG-CD2 4.28Å
158	V	88.9	Confident	79.2	Confident	80 Å²	80	69.8 Å²	69.8	49%	0.485	39%	0.393	S	S	.	.	H	α-helix	trans	-66.9	-43.2	174.1	172.5	0	0	0	0	110.8	K154 E155 L160 M161 N162	K154-V158 WeakPolarHBondContact O-CG2 3.32Å; K154-V158 PolarHBondContact O-N 3.14Å; E155-V158 PolarHBondContact O-N 2.73Å; V158-L160 VanDerWaalsContact C-N 3.27Å; V158-L160 PolarHBondContact O-N 3.03Å; V158-M161 PolarHBondContact O-N 3.41Å; V158-N162 VanDerWaalsContact O-CG 3.24Å; V158-N162 PolarHBondContact O-N 2.99Å
159	L	86	Confident	76.8	Confident	16 Å²	16	75.6 Å²	75.6	8%	0.084	42%	0.418	C	S	.	.	H	α-helix	trans	-61.2	-36.4	175.5	-176.1	61.6	0	0	0	112.2	F94 A97 I98 F101 E155 I189	F94-L159 HydrophobicContact CD2-CD1 4.47Å; F94-L159 HydrophobicContact CE2-CD1 3.82Å; A97-L159 HydrophobicContact CB-CD1 3.68Å; I98-L159 HydrophobicContact CG1-CD2 4.23Å; F101-L159 HydrophobicContact CB-CD2 3.75Å; F101-L159 HydrophobicContact CD1-CD2 4.05Å; F101-L159 HydrophobicContact CG-CD2 4.06Å; E155-L159 WeakPolarHBondContact O-CB 3.45Å; E155-L159 PolarHBondContact O-N 3.47Å; L159-I189 HydrophobicContact CD2-CD1 4.05Å; L159-I189 HydrophobicContact CD2-CG1 4.08Å; L159-I189 HydrophobicContact CG-CD1 3.79Å; L159-I189 HydrophobicContact CG-CG1 4.33Å
160	L	84.6	Confident	74.5	Confident	29 Å²	29	84.4 Å²	84.4	15%	0.152	46%	0.459	C	S	.	.	H	α-helix	trans	-66.8	-46.4	172.5	-167.5	72.2	0	0	0	111.5	G156 K157 V158 N162 L163 W186 I189 K190 L193	G156-L160 WeakPolarHBondContact O-CB 3.48Å; G156-L160 PolarHBondContact O-N 2.86Å; K157-L160 PolarHBondContact O-N 3.42Å; V158-L160 VanDerWaalsContact C-N 3.27Å; V158-L160 PolarHBondContact O-N 3.03Å; L160-N162 VanDerWaalsContact C-N 3.27Å; L160-N162 PolarHBondContact O-N 3.44Å; L160-L163 WeakPolarHBondContact O-CB 3.5Å; L160-L163 PolarHBondContact O-N 3.1Å; L160-L163 VanDerWaalsContact O-N 3.11Å; L160-W186 HydrophobicContact CD1-CD2 3.67Å; L160-W186 HydrophobicContact CD1-CE3 3.4Å; L160-W186 HydrophobicContact CD1-CG 4.35Å; L160-W186 HydrophobicContact CD1-CH2 4.13Å; L160-W186 HydrophobicContact CD1-CZ2 4.38Å; L160-W186 HydrophobicContact CD1-CZ3 3.68Å; L160-W186 HydrophobicContact CD2-CH2 4.47Å; L160-W186 HydrophobicContact CG-CE3 4Å; L160-W186 HydrophobicContact CG-CH2 3.94Å; L160-W186 HydrophobicContact CG-CZ2 4.47Å; L160-W186 HydrophobicContact CG-CZ3 3.71Å; L160-W186 WeakPolarHBondContact O-CZ3 3.5Å; L160-I189 HydrophobicContact CB-CG2 4.02Å; L160-I189 HydrophobicContact CD1-CB 4.16Å; L160-I189 HydrophobicContact CD1-CG2 3.92Å; L160-K190 HydrophobicContact CD1-CG 4.05Å; L160-K190 HydrophobicContact CD2-CG 4.4Å; L160-L193 HydrophobicContact CB-CD1 4.44Å; L160-L193 HydrophobicContact CD2-CD1 4.15Å
161	M	82.4	Confident	71.9	Confident	132 Å²	132	88.1 Å²	88.1	65%	0.65	48%	0.482	S	S	*	.	H	α-helix	trans	-58.6	-38	176.1	-73.7	173.1	171.3	0	0	112.3	K157 V158 L163 Q164	K157-M161 WeakPolarHBondContact O-CG 3.44Å; K157-M161 PolarHBondContact O-N 3.06Å; V158-M161 PolarHBondContact O-N 3.41Å; M161-L163 PolarHBondContact O-N 3.09Å; M161-Q164 WeakPolarHBondContact O-CB 3.45Å; M161-Q164 PolarHBondContact O-N 3.07Å
162	N	78.1	Confident	69.6	Low	120 Å²	120	92.2 Å²	92.2	64%	0.642	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.6	178.7	-67.6	-13.9	0	0	0	114.2	V158 L160	V158-N162 VanDerWaalsContact O-CG 3.24Å; V158-N162 PolarHBondContact O-N 2.99Å; L160-N162 VanDerWaalsContact C-N 3.27Å; L160-N162 PolarHBondContact O-N 3.44Å
163	L	71.3	Confident	67.1	Low	17 Å²	17	96.7 Å²	96.7	9%	0.089	53%	0.533	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-17	168.2	-93.1	-175	0	0	0	113.6	F94 L160 M161 V165 I182 D185 W186 I189	F94-L163 HydrophobicContact CD1-CD2 4.19Å; F94-L163 HydrophobicContact CD2-CD2 4.33Å; F94-L163 HydrophobicContact CE1-CD1 4.16Å; F94-L163 HydrophobicContact CE1-CD2 3.52Å; F94-L163 HydrophobicContact CE1-CG 3.98Å; F94-L163 HydrophobicContact CE2-CD1 4.42Å; F94-L163 HydrophobicContact CE2-CD2 3.7Å; F94-L163 HydrophobicContact CE2-CG 3.63Å; F94-L163 HydrophobicContact CZ-CD1 3.59Å; F94-L163 HydrophobicContact CZ-CD2 3.27Å; F94-L163 HydrophobicContact CZ-CG 3.24Å; L160-L163 WeakPolarHBondContact O-CB 3.5Å; L160-L163 PolarHBondContact O-N 3.1Å; L160-L163 VanDerWaalsContact O-N 3.11Å; M161-L163 PolarHBondContact O-N 3.09Å; L163-V165 VanDerWaalsContact C-N 3.34Å; L163-V165 PolarHBondContact O-N 3.14Å; L163-I182 HydrophobicContact CD2-CG2 4.33Å; L163-D185 HydrophobicContact CD1-CB 4.27Å; L163-W186 HydrophobicContact CB-CE3 3.72Å; L163-W186 HydrophobicContact CB-CZ3 4Å; L163-W186 HydrophobicContact CD1-CB 3.97Å; L163-W186 HydrophobicContact CD1-CE3 3.97Å; L163-I189 HydrophobicContact CD1-CD1 3.71Å; L163-I189 HydrophobicContact CG-CD1 4.38Å
164	Q	63.9	Low	64.6	Low	130 Å²	130	99.1 Å²	99.1	61%	0.607	55%	0.551	S	S	*	*			trans	-85.8	78.4	-166.3	-162.6	168.2	-11	0	0	110.4	M161 W186	M161-Q164 WeakPolarHBondContact O-CB 3.45Å; M161-Q164 PolarHBondContact O-N 3.07Å; Q164-W186 HydrophobicContact CB-CH2 4.2Å; Q164-W186 HydrophobicContact CB-CZ3 4.04Å; Q164-W186 HydrophobicContact CG-CH2 4.18Å; Q164-W186 HydrophobicContact CG-CZ3 4.46Å
165	V	56	Low	62.5	Low	109 Å²	109	95.5 Å²	95.5	66%	0.661	54%	0.543	S	S	*	.			trans	-49.8	125.9	173.9	-176.2	0	0	0	0	109.5	L163 A167	L163-V165 VanDerWaalsContact C-N 3.34Å; L163-V165 PolarHBondContact O-N 3.14Å; V165-A167 PolarHBondContact O-N 3Å
166	P	46.5	Very low	60.1	Low	100 Å²	100	98.5 Å²	98.5	65%	0.649	56%	0.56	S	S	*	*			trans	-58.9	129.8	175.1	-24	34.1	0	0	0	110.6	T168	P166-T168 PolarHBondContact O-N 2.91Å
167	A	43	Very low	57.8	Low	102 Å²	102	101.7 Å²	101.7	84%	0.843	58%	0.575	S	S	*	*			trans	-76.8	71.4	173	0	0	0	0	0	110.2	V165	V165-A167 PolarHBondContact O-N 3Å
168	T	37.6	Very low	55.5	Low	124 Å²	124	99 Å²	99	76%	0.761	57%	0.57	S	S	*	*			trans	-69.1	124.8	157.8	47.7	0	0	0	0	108	P166	P166-T168 PolarHBondContact O-N 2.91Å
169	E	43.3	Very low	53.6	Low	183 Å²	183	98.9 Å²	98.9	86%	0.855	57%	0.569	S	S	*	*	S	Bend	trans	-64.3	168.7	176.4	-59.8	176.2	139.7	0	0	110.5
170	E	44.1	Very low	51.8	Low	184 Å²	184	104.2 Å²	104.2	86%	0.86	59%	0.594	S	S	*	*			trans	75.1	53.8	179.8	-49.1	-166.5	150.5	0	0	118.8
171	T	37.6	Very low	50.3	Low	126 Å²	126	106.8 Å²	106.8	77%	0.773	61%	0.605	S	S	*	*			trans	-159.2	83.9	137.3	2.2	0	0	0	0	113.4
172	V	46.8	Very low	49.1	Very low	139 Å²	139	103 Å²	103	84%	0.842	59%	0.587	S	S	*	*			trans	-94	101.9	178.7	-178.3	0	0	0	0	110.9
173	S	41.3	Very low	48.4	Very low	102 Å²	102	101 Å²	101	71%	0.713	58%	0.577	S	S	*	*	S	Bend	trans	-179.6	-25.9	148.7	-84.2	0	0	0	0	114.7
174	S	41.8	Very low	48.1	Very low	73 Å²	73	102 Å²	102	51%	0.51	59%	0.59	S	S	.	*	S	Bend	trans	-96.7	-4	-169.8	53.1	0	0	0	0	115.7
175	S	46.7	Very low	48.6	Very low	58 Å²	58	96.2 Å²	96.2	41%	0.406	56%	0.564	S	S	.	*			trans	-83.8	-22.6	-162.4	56.5	0	0	0	0	116.4	E177 C178 T179	S175-E177 VanDerWaalsContact C-N 3.31Å; S175-E177 PolarHBondContact O-N 2.91Å; S175-C178 PolarHBondContact O-N 3.48Å; S175-C178 VanDerWaalsContact O-N 3.16Å; S175-T179 PolarHBondContact O-N 3.03Å; S175-T179 PolarHBondContact O-OG1 3.29Å; S175-T179 VanDerWaalsContact O-OG1 3.06Å
176	L	42.3	Very low	49.7	Very low	128 Å²	128	93.5 Å²	93.5	67%	0.67	54%	0.541	S	S	*	.	H	α-helix	trans	-51.7	-40.4	-161.2	-104.1	76	0	0	0	115.4	Q180	L176-Q180 WeakPolarHBondContact O-CG 3.27Å; L176-Q180 PolarHBondContact O-N 3.42Å; L176-Q180 VanDerWaalsContact O-N 3.16Å
177	E	42	Very low	51	Low	67 Å²	67	92.7 Å²	92.7	31%	0.313	53%	0.529	S	S	.	.	H	α-helix	trans	-89.2	-31.6	-175.9	-64.9	-169.4	-179.4	0	0	113.5	Q75 S175 T179 Q180 H181	Q75-E177 WeakPolarHBondContact CG-OE2 3.36Å; Q75-E177 PolarHBondContact NE2-OE1 3.32Å; Q75-E177 PolarHBondContact NE2-OE2 3.03Å; S175-E177 VanDerWaalsContact C-N 3.31Å; S175-E177 PolarHBondContact O-N 2.91Å; E177-T179 VanDerWaalsContact C-N 3.26Å; E177-T179 PolarHBondContact O-N 2.94Å; E177-Q180 WeakPolarHBondContact O-CB 3.44Å; E177-Q180 PolarHBondContact O-N 2.92Å; E177-Q180 VanDerWaalsContact O-N 3.08Å; E177-H181 PolarHBondContact O-N 3.41Å; E177-H181 VanDerWaalsContact O-N 3.1Å
178	C	42.5	Very low	52.8	Low	59 Å²	59	90.5 Å²	90.5	40%	0.399	51%	0.505	S	S	.	.	H	α-helix	trans	-59.3	-43.8	166.3	-172.1	0	0	0	0	109.8	S175 Q180 H181 I182	S175-C178 PolarHBondContact O-N 3.48Å; S175-C178 VanDerWaalsContact O-N 3.16Å; C178-Q180 VanDerWaalsContact C-N 3.31Å; C178-Q180 PolarHBondContact O-N 2.72Å; C178-H181 PolarHBondContact O-N 3.24Å; C178-I182 WeakPolarHBondContact O-CB 3.49Å; C178-I182 VanDerWaalsContact O-CG1 3.31Å; C178-I182 WeakPolarHBondContact O-CG1 3.25Å; C178-I182 PolarHBondContact O-N 2.94Å
179	T	47.1	Very low	55.1	Low	78 Å²	78	84.6 Å²	84.6	48%	0.479	47%	0.469	S	S	.	.	H	α-helix	trans	-60	-35.2	171.8	-56	0	0	0	0	112.8	S175 E177 N183	S175-T179 PolarHBondContact O-N 3.03Å; S175-T179 PolarHBondContact O-OG1 3.29Å; S175-T179 VanDerWaalsContact O-OG1 3.06Å; E177-T179 VanDerWaalsContact C-N 3.26Å; E177-T179 PolarHBondContact O-N 2.94Å; T179-N183 WeakPolarHBondContact O-CB 3.43Å; T179-N183 PolarHBondContact O-N 3.22Å
180	Q	48.5	Very low	57	Low	128 Å²	128	80.2 Å²	80.2	60%	0.598	45%	0.447	S	S	*	.	H	α-helix	trans	-67	-45.7	176.3	-76.8	176.4	45.2	0	0	112.9	L176 E177 C178 N183 G184	L176-Q180 WeakPolarHBondContact O-CG 3.27Å; L176-Q180 PolarHBondContact O-N 3.42Å; L176-Q180 VanDerWaalsContact O-N 3.16Å; E177-Q180 WeakPolarHBondContact O-CB 3.44Å; E177-Q180 PolarHBondContact O-N 2.92Å; E177-Q180 VanDerWaalsContact O-N 3.08Å; C178-Q180 VanDerWaalsContact C-N 3.31Å; C178-Q180 PolarHBondContact O-N 2.72Å; Q180-N183 PolarHBondContact O-N 2.66Å; Q180-G184 PolarHBondContact O-N 2.91Å
181	H	53	Low	58.9	Low	83 Å²	83	77.8 Å²	77.8	38%	0.384	43%	0.433	S	S	.	.	H	α-helix	trans	-67.7	-43.7	177.9	-173.7	-72	0	0	0	111.5	W91 R95 E177 C178 N183 G184 D185	W91-H181 AromaticContact CD1-CE1 3.68Å; W91-H181 AromaticContact CD1-NE2 3.78Å; W91-H181 AromaticContact CE2-NE2 3.96Å; W91-H181 AromaticContact NE1-CD2 3.98Å; W91-H181 AromaticContact NE1-CE1 3.22Å; W91-H181 PolarHBondContact NE1-CE1 2.71Å; W91-H181 AromaticContact NE1-NE2 2.94Å; W91-H181 PolarHBondContact NE1-NE2 3.26Å; R95-H181 PolarHBondContact NH2-CE1 2.75Å; R95-H181 PolarHBondContact NH2-NE2 3.11Å; E177-H181 PolarHBondContact O-N 3.41Å; E177-H181 VanDerWaalsContact O-N 3.1Å; C178-H181 PolarHBondContact O-N 3.24Å; H181-N183 VanDerWaalsContact C-N 3.3Å; H181-N183 PolarHBondContact O-N 3.36Å; H181-G184 PolarHBondContact O-N 2.76Å; H181-D185 IonicContact CE1-OD2 2.67Å; H181-D185 PolarHBondContact CE1-OD2 3.37Å; H181-D185 IonicContact ND1-OD2 2.89Å; H181-D185 PolarHBondContact ND1-OD2 3.32Å; H181-D185 PolarHBondContact O-N 3.21Å; H181-D185 VanDerWaalsContact O-N 3.08Å
182	I	58.3	Low	61.1	Low	54 Å²	54	72.7 Å²	72.7	28%	0.277	40%	0.402	S	S	.	.	H	α-helix	trans	-57.9	-43.2	173.8	-70.8	169.6	0	0	0	110.5	L163 C178 D185 W186	L163-I182 HydrophobicContact CD2-CG2 4.33Å; C178-I182 WeakPolarHBondContact O-CB 3.49Å; C178-I182 VanDerWaalsContact O-CG1 3.31Å; C178-I182 WeakPolarHBondContact O-CG1 3.25Å; C178-I182 PolarHBondContact O-N 2.94Å; I182-D185 PolarHBondContact O-N 3.47Å; I182-W186 WeakPolarHBondContact O-CB 3.23Å; I182-W186 PolarHBondContact O-N 3.02Å
183	N	61.8	Low	63.1	Low	78 Å²	78	67.3 Å²	67.3	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-44.7	175.3	-174.1	15.6	0	0	0	111.7	T179 Q180 H181 D185 W186 Q187	T179-N183 WeakPolarHBondContact O-CB 3.43Å; T179-N183 PolarHBondContact O-N 3.22Å; Q180-N183 PolarHBondContact O-N 2.66Å; H181-N183 VanDerWaalsContact C-N 3.3Å; H181-N183 PolarHBondContact O-N 3.36Å; N183-D185 VanDerWaalsContact C-N 3.31Å; N183-D185 PolarHBondContact O-N 3.31Å; N183-W186 WeakPolarHBondContact O-CB 3.44Å; N183-W186 PolarHBondContact O-N 2.9Å; N183-Q187 VanDerWaalsContact O-CG 3.28Å; N183-Q187 WeakPolarHBondContact O-CG 3.23Å; N183-Q187 PolarHBondContact O-N 3.26Å; N183-Q187 PolarHBondContact OD1-NE2 3.46Å
184	G	66	Low	65.1	Low	36 Å²	36	64.8 Å²	64.8	37%	0.371	35%	0.353	S	S	.	.	H	α-helix	trans	-56.7	-42.2	177.1	0	0	0	0	0	113.5	Q180 H181 T188	Q180-G184 PolarHBondContact O-N 2.91Å; H181-G184 PolarHBondContact O-N 2.76Å; G184-T188 PolarHBondContact O-N 2.79Å; G184-T188 VanDerWaalsContact O-N 3.14Å; G184-T188 PolarHBondContact O-OG1 3.25Å
185	D	74	Confident	67.1	Low	10 Å²	10	66 Å²	66	5%	0.053	35%	0.35	C	S	.	.	H	α-helix	trans	-74.3	-39.2	177.1	-77.7	-18.7	0	0	0	113	F94 R95 I98 L163 H181 I182 N183 Q187 T188 I189	F94-D185 HydrophobicContact CE1-CB 3.86Å; R95-D185 IonicContact CZ-OD1 2.79Å; R95-D185 IonicContact CZ-OD2 2.96Å; R95-D185 IonicContact NH1-OD1 3.59Å; R95-D185 PolarHBondContact NH1-OD1 3.23Å; R95-D185 IonicContact NH1-OD2 3.21Å; R95-D185 VanDerWaalsContact NH2-CG 3.28Å; R95-D185 IonicContact NH2-OD1 2.71Å; R95-D185 PolarHBondContact NH2-OD1 2.8Å; R95-D185 IonicContact NH2-OD2 3.69Å; R95-D185 PolarHBondContact NH2-OD2 3.46Å; I98-D185 HydrophobicContact CD1-CB 3.62Å; L163-D185 HydrophobicContact CD1-CB 4.27Å; H181-D185 IonicContact CE1-OD2 2.67Å; H181-D185 PolarHBondContact CE1-OD2 3.37Å; H181-D185 IonicContact ND1-OD2 2.89Å; H181-D185 PolarHBondContact ND1-OD2 3.32Å; H181-D185 PolarHBondContact O-N 3.21Å; H181-D185 VanDerWaalsContact O-N 3.08Å; I182-D185 PolarHBondContact O-N 3.47Å; N183-D185 VanDerWaalsContact C-N 3.31Å; N183-D185 PolarHBondContact O-N 3.31Å; D185-Q187 PolarHBondContact O-N 3.39Å; D185-T188 WeakPolarHBondContact O-CA 3.42Å; D185-T188 WeakPolarHBondContact O-CB 3.47Å; D185-T188 PolarHBondContact O-N 3.25Å; D185-I189 PolarHBondContact O-N 2.87Å
186	W	78.7	Confident	69.1	Low	52 Å²	52	63.2 Å²	63.2	20%	0.197	33%	0.331	C	S	.	.	H	α-helix	trans	-58.6	-43.8	171.9	-179	-103.3	0	0	0	111.9	L160 L163 Q164 I182 N183 T188 K190	L160-W186 HydrophobicContact CD1-CD2 3.67Å; L160-W186 HydrophobicContact CD1-CE3 3.4Å; L160-W186 HydrophobicContact CD1-CG 4.35Å; L160-W186 HydrophobicContact CD1-CH2 4.13Å; L160-W186 HydrophobicContact CD1-CZ2 4.38Å; L160-W186 HydrophobicContact CD1-CZ3 3.68Å; L160-W186 HydrophobicContact CD2-CH2 4.47Å; L160-W186 HydrophobicContact CG-CE3 4Å; L160-W186 HydrophobicContact CG-CH2 3.94Å; L160-W186 HydrophobicContact CG-CZ2 4.47Å; L160-W186 HydrophobicContact CG-CZ3 3.71Å; L160-W186 WeakPolarHBondContact O-CZ3 3.5Å; L163-W186 HydrophobicContact CB-CE3 3.72Å; L163-W186 HydrophobicContact CB-CZ3 4Å; L163-W186 HydrophobicContact CD1-CB 3.97Å; L163-W186 HydrophobicContact CD1-CE3 3.97Å; Q164-W186 HydrophobicContact CB-CH2 4.2Å; Q164-W186 HydrophobicContact CB-CZ3 4.04Å; Q164-W186 HydrophobicContact CG-CH2 4.18Å; Q164-W186 HydrophobicContact CG-CZ3 4.46Å; I182-W186 WeakPolarHBondContact O-CB 3.23Å; I182-W186 PolarHBondContact O-N 3.02Å; N183-W186 WeakPolarHBondContact O-CB 3.44Å; N183-W186 PolarHBondContact O-N 2.9Å; W186-T188 VanDerWaalsContact C-N 3.27Å; W186-T188 PolarHBondContact O-N 3.33Å; W186-K190 VanDerWaalsContact NE1-CE 3.32Å; W186-K190 WeakPolarHBondContact O-CB 3.32Å; W186-K190 WeakPolarHBondContact O-CG 3.46Å; W186-K190 PolarHBondContact O-N 3.09Å
187	Q	74.8	Confident	71.2	Confident	83 Å²	83	62.2 Å²	62.2	39%	0.388	32%	0.323	S	S	.	.	H	α-helix	trans	-64.8	-31.1	171.9	-62.7	-49.2	-34	0	0	112.1	N183 D185 K191	N183-Q187 VanDerWaalsContact O-CG 3.28Å; N183-Q187 WeakPolarHBondContact O-CG 3.23Å; N183-Q187 PolarHBondContact O-N 3.26Å; N183-Q187 PolarHBondContact OD1-NE2 3.46Å; D185-Q187 PolarHBondContact O-N 3.39Å; Q187-K191 WeakPolarHBondContact O-CB 3.42Å; Q187-K191 WeakPolarHBondContact O-CD 3.42Å; Q187-K191 WeakPolarHBondContact O-CG 3.38Å; Q187-K191 PolarHBondContact O-N 3.14Å
188	T	80.5	Confident	73.2	Confident	55 Å²	55	62.9 Å²	62.9	34%	0.337	33%	0.329	S	S	.	.	H	α-helix	trans	-71.6	-47.9	178.9	-60	0	0	0	0	111.2	I98 G184 D185 W186 K190 K191 L192	I98-T188 HydrophobicContact CG2-CG2 4.19Å; G184-T188 PolarHBondContact O-N 2.79Å; G184-T188 VanDerWaalsContact O-N 3.14Å; G184-T188 PolarHBondContact O-OG1 3.25Å; D185-T188 WeakPolarHBondContact O-CA 3.42Å; D185-T188 WeakPolarHBondContact O-CB 3.47Å; D185-T188 PolarHBondContact O-N 3.25Å; W186-T188 VanDerWaalsContact C-N 3.27Å; W186-T188 PolarHBondContact O-N 3.33Å; T188-K190 VanDerWaalsContact C-N 3.34Å; T188-K190 PolarHBondContact O-N 3.26Å; T188-K191 PolarHBondContact O-N 3.25Å; T188-L192 HydrophobicContact CG2-CD1 4.4Å; T188-L192 WeakPolarHBondContact O-CG 3.28Å; T188-L192 PolarHBondContact O-N 2.99Å
189	I	85.4	Confident	75.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.9	-40.4	174.2	-65.1	157.7	0	0	0	110.9	F94 I98 F101 L159 L160 L163 D185 K191 L192 L193	F94-I189 HydrophobicContact CZ-CD1 3.81Å; I98-I189 HydrophobicContact CD1-CD1 3.73Å; I98-I189 HydrophobicContact CD1-CG1 3.89Å; I98-I189 HydrophobicContact CG1-CD1 3.78Å; I98-I189 HydrophobicContact CG1-CG1 3.83Å; F101-I189 HydrophobicContact CE1-CG2 4.4Å; L159-I189 HydrophobicContact CD2-CD1 4.05Å; L159-I189 HydrophobicContact CD2-CG1 4.08Å; L159-I189 HydrophobicContact CG-CD1 3.79Å; L159-I189 HydrophobicContact CG-CG1 4.33Å; L160-I189 HydrophobicContact CB-CG2 4.02Å; L160-I189 HydrophobicContact CD1-CB 4.16Å; L160-I189 HydrophobicContact CD1-CG2 3.92Å; L163-I189 HydrophobicContact CD1-CD1 3.71Å; L163-I189 HydrophobicContact CG-CD1 4.38Å; D185-I189 PolarHBondContact O-N 2.87Å; I189-K191 PolarHBondContact O-N 2.77Å; I189-L192 PolarHBondContact O-N 3.39Å; I189-L193 HydrophobicContact CG2-CD1 4.05Å; I189-L193 HydrophobicContact CG2-CG 4.45Å; I189-L193 WeakPolarHBondContact O-CB 3.27Å; I189-L193 PolarHBondContact O-N 2.91Å
190	K	83.6	Confident	77.1	Confident	91 Å²	91	59.6 Å²	59.6	40%	0.396	30%	0.302	S	S	.	.	H	α-helix	trans	-61.6	-39.2	174.8	-78.6	-175.3	172.8	-169.3	0	113.2	L160 W186 T188 A194	L160-K190 HydrophobicContact CD1-CG 4.05Å; L160-K190 HydrophobicContact CD2-CG 4.4Å; W186-K190 VanDerWaalsContact NE1-CE 3.32Å; W186-K190 WeakPolarHBondContact O-CB 3.32Å; W186-K190 WeakPolarHBondContact O-CG 3.46Å; W186-K190 PolarHBondContact O-N 3.09Å; T188-K190 VanDerWaalsContact C-N 3.34Å; T188-K190 PolarHBondContact O-N 3.26Å; K190-A194 WeakPolarHBondContact O-CB 3.4Å; K190-A194 PolarHBondContact O-N 2.99Å
191	K	84.4	Confident	78.8	Confident	133 Å²	133	57.1 Å²	57.1	58%	0.578	30%	0.296	S	S	*	.	H	α-helix	trans	-65.9	-40.2	174	-75.4	165.5	-174.8	174.1	0	112.1	Q187 T188 I189 A194 Q195	Q187-K191 WeakPolarHBondContact O-CB 3.42Å; Q187-K191 WeakPolarHBondContact O-CD 3.42Å; Q187-K191 WeakPolarHBondContact O-CG 3.38Å; Q187-K191 PolarHBondContact O-N 3.14Å; T188-K191 PolarHBondContact O-N 3.25Å; I189-K191 PolarHBondContact O-N 2.77Å; K191-A194 PolarHBondContact O-N 3.4Å; K191-Q195 WeakPolarHBondContact O-CG 3.48Å; K191-Q195 PolarHBondContact O-N 3Å
192	L	84.1	Confident	80	Confident	20 Å²	20	54.7 Å²	54.7	11%	0.105	29%	0.291	C	S	.	.	H	α-helix	trans	-66.7	-43.3	175.8	-70.5	168.2	0	0	0	111.7	F101 A102 V105 T188 I189 A194 Q195 V196	F101-L192 HydrophobicContact CD1-CB 4.13Å; F101-L192 HydrophobicContact CD1-CD1 3.85Å; F101-L192 HydrophobicContact CE1-CB 3.57Å; F101-L192 HydrophobicContact CE1-CD1 4.18Å; F101-L192 HydrophobicContact CZ-CB 4.41Å; A102-L192 HydrophobicContact CB-CD1 3.85Å; A102-L192 HydrophobicContact CB-CD2 4.16Å; V105-L192 HydrophobicContact CB-CD2 4.42Å; V105-L192 HydrophobicContact CG1-CD2 4.3Å; V105-L192 HydrophobicContact CG2-CB 4.46Å; T188-L192 HydrophobicContact CG2-CD1 4.4Å; T188-L192 WeakPolarHBondContact O-CG 3.28Å; T188-L192 PolarHBondContact O-N 2.99Å; I189-L192 PolarHBondContact O-N 3.39Å; L192-A194 PolarHBondContact O-N 3.3Å; L192-Q195 WeakPolarHBondContact O-CB 3.45Å; L192-Q195 PolarHBondContact O-N 3.28Å; L192-V196 WeakPolarHBondContact O-CG2 3.41Å; L192-V196 PolarHBondContact O-N 3.28Å
193	L	88.6	Confident	81.3	Confident	26 Å²	26	52.7 Å²	52.7	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-40	173.4	-82.5	169.6	0	0	0	112.6	F101 K157 L160 I189 V196 H197	F101-L193 HydrophobicContact CZ-CD2 4.34Å; F101-L193 HydrophobicContact CZ-CG 4.42Å; K157-L193 HydrophobicContact CG-CD1 4.5Å; K157-L193 HydrophobicContact CG-CD2 4.28Å; L160-L193 HydrophobicContact CB-CD1 4.44Å; L160-L193 HydrophobicContact CD2-CD1 4.15Å; I189-L193 HydrophobicContact CG2-CD1 4.05Å; I189-L193 HydrophobicContact CG2-CG 4.45Å; I189-L193 WeakPolarHBondContact O-CB 3.27Å; I189-L193 PolarHBondContact O-N 2.91Å; L193-V196 PolarHBondContact O-N 3.08Å; L193-H197 PolarHBondContact O-N 3.38Å; L193-H197 VanDerWaalsContact O-N 3.09Å
194	A	83.6	Confident	82.5	Confident	48 Å²	48	51 Å²	51	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-44.6	172.9	0	0	0	0	0	111.2	K190 K191 L192 V196 H197 D198	K190-A194 WeakPolarHBondContact O-CB 3.4Å; K190-A194 PolarHBondContact O-N 2.99Å; K191-A194 PolarHBondContact O-N 3.4Å; L192-A194 PolarHBondContact O-N 3.3Å; A194-V196 VanDerWaalsContact C-N 3.34Å; A194-V196 PolarHBondContact O-N 3.33Å; A194-H197 PolarHBondContact O-N 3.02Å; A194-D198 WeakPolarHBondContact O-CB 3.46Å; A194-D198 VanDerWaalsContact O-CG 3.31Å; A194-D198 PolarHBondContact O-N 3.06Å
195	Q	84.2	Confident	83.2	Confident	98 Å²	98	50.3 Å²	50.3	46%	0.458	26%	0.264	S	S	.	.	H	α-helix	trans	-60.1	-39.2	175.1	-73.6	170.3	5	0	0	112.9	K191 L192 D198 M199	K191-Q195 WeakPolarHBondContact O-CG 3.48Å; K191-Q195 PolarHBondContact O-N 3Å; L192-Q195 WeakPolarHBondContact O-CB 3.45Å; L192-Q195 PolarHBondContact O-N 3.28Å; Q195-D198 PolarHBondContact O-N 3.47Å; Q195-M199 WeakPolarHBondContact O-CB 3.48Å; Q195-M199 VanDerWaalsContact O-CG 3.24Å; Q195-M199 WeakPolarHBondContact O-CG 3.28Å; Q195-M199 PolarHBondContact O-N 3.18Å
196	V	87.4	Confident	83.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-43.4	175.1	177.7	0	0	0	0	111.2	V105 L149 V152 T153 L192 L193 A194 M199 E200	V105-V196 HydrophobicContact CB-CG2 4.25Å; V105-V196 HydrophobicContact CG1-CG2 3.83Å; V105-V196 HydrophobicContact CG2-CG2 3.51Å; L149-V196 HydrophobicContact CD2-CG1 3.87Å; V152-V196 HydrophobicContact CG1-CG1 4.48Å; V152-V196 HydrophobicContact CG1-CG2 3.95Å; T153-V196 WeakPolarHBondContact OG1-CG1 3.25Å; L192-V196 WeakPolarHBondContact O-CG2 3.41Å; L192-V196 PolarHBondContact O-N 3.28Å; L193-V196 PolarHBondContact O-N 3.08Å; A194-V196 VanDerWaalsContact C-N 3.34Å; A194-V196 PolarHBondContact O-N 3.33Å; V196-M199 HydrophobicContact CG2-CE 4.21Å; V196-M199 PolarHBondContact O-N 2.88Å; V196-E200 WeakPolarHBondContact O-CB 3.43Å; V196-E200 PolarHBondContact O-N 3.08Å
197	H	87.3	Confident	83.9	Confident	108 Å²	108	51 Å²	51	50%	0.5	27%	0.267	S	S	.	.	H	α-helix	trans	-70.1	-36.2	177.8	-175.6	49.7	0	0	0	113.2	L193 A194 E200 T201	L193-H197 PolarHBondContact O-N 3.38Å; L193-H197 VanDerWaalsContact O-N 3.09Å; A194-H197 PolarHBondContact O-N 3.02Å; H197-E200 IonicContact ND1-OE2 3.73Å; H197-E200 PolarHBondContact ND1-OE2 3.03Å; H197-E200 PolarHBondContact O-N 2.94Å; H197-T201 WeakPolarHBondContact O-CB 3.42Å; H197-T201 PolarHBondContact O-N 3.46Å; H197-T201 PolarHBondContact O-OG1 3.04Å
198	D	82.8	Confident	84.4	Confident	81 Å²	81	53 Å²	53	43%	0.433	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-42.6	172.5	-74.5	-26.9	0	0	0	111.1	A194 Q195 A202 M712	A194-D198 WeakPolarHBondContact O-CB 3.46Å; A194-D198 VanDerWaalsContact O-CG 3.31Å; A194-D198 PolarHBondContact O-N 3.06Å; Q195-D198 PolarHBondContact O-N 3.47Å; D198-A202 VanDerWaalsContact O-CB 3.25Å; D198-A202 WeakPolarHBondContact O-CB 3.44Å; D198-A202 PolarHBondContact O-N 3.08Å; D198-M712 HydrophobicContact CB-CE 4.1Å; D198-M712 HydrophobicContact CB-SD 3.92Å; D198-M712 WeakPolarHBondContact O-CE 3.41Å
199	M	86.8	Confident	84.4	Confident	31 Å²	31	57.1 Å²	57.1	15%	0.153	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-45.8	174.5	-75.3	-172.2	-58.2	0	0	112	V105 M108 A109 L112 Q195 V196 A202 F203	V105-M199 HydrophobicContact CG1-CE 3.9Å; M108-M199 HydrophobicContact CG-CE 4.4Å; A109-M199 VanDerWaalsContact CA-SD 3.57Å; A109-M199 HydrophobicContact CB-CE 4.39Å; A109-M199 HydrophobicContact CB-SD 3.39Å; A109-M199 WeakPolarHBondContact CB-SD 3.48Å; L112-M199 HydrophobicContact CD1-CB 4.1Å; Q195-M199 WeakPolarHBondContact O-CB 3.48Å; Q195-M199 VanDerWaalsContact O-CG 3.24Å; Q195-M199 WeakPolarHBondContact O-CG 3.28Å; Q195-M199 PolarHBondContact O-N 3.18Å; V196-M199 HydrophobicContact CG2-CE 4.21Å; V196-M199 PolarHBondContact O-N 2.88Å; M199-A202 PolarHBondContact O-N 3.4Å; M199-F203 VanDerWaalsContact O-CB 3.23Å; M199-F203 WeakPolarHBondContact O-CB 3.26Å; M199-F203 PolarHBondContact O-N 3.18Å
200	E	85.7	Confident	84.2	Confident	36 Å²	36	58 Å²	58	17%	0.168	29%	0.294	C	S	.	.	H	α-helix	trans	-56.9	-52.7	175.6	179.7	-178.7	-153.2	0	0	111.3	K146 L149 V196 H197 A202 F203 D204	K146-E200 IonicContact NZ-OE1 3.5Å; K146-E200 PolarHBondContact NZ-OE1 3.19Å; L149-E200 HydrophobicContact CD1-CB 4.08Å; L149-E200 HydrophobicContact CD1-CG 4.31Å; L149-E200 HydrophobicContact CD2-CB 4.29Å; V196-E200 WeakPolarHBondContact O-CB 3.43Å; V196-E200 PolarHBondContact O-N 3.08Å; H197-E200 IonicContact ND1-OE2 3.73Å; H197-E200 PolarHBondContact ND1-OE2 3.03Å; H197-E200 PolarHBondContact O-N 2.94Å; E200-A202 VanDerWaalsContact C-N 3.3Å; E200-A202 PolarHBondContact O-N 2.87Å; E200-F203 PolarHBondContact O-N 2.87Å; E200-F203 VanDerWaalsContact O-N 3.1Å; E200-D204 PolarHBondContact O-N 3.39Å
201	T	83	Confident	84.3	Confident	77 Å²	77	57.4 Å²	57.4	47%	0.472	29%	0.292	S	S	.	.	H	α-helix	trans	-62.2	-37.6	-179.3	-53.7	0	0	0	0	112	H197 G205	H197-T201 WeakPolarHBondContact O-CB 3.42Å; H197-T201 PolarHBondContact O-N 3.46Å; H197-T201 PolarHBondContact O-OG1 3.04Å; T201-G205 PolarHBondContact O-N 3.49Å; T201-G205 VanDerWaalsContact O-N 3.15Å
202	A	79.8	Confident	84.3	Confident	32 Å²	32	55.4 Å²	55.4	26%	0.264	29%	0.288	S	S	.	.	H	α-helix	trans	-73.3	-29.7	176	0	0	0	0	0	113.1	D198 M199 E200 F206 M712	D198-A202 VanDerWaalsContact O-CB 3.25Å; D198-A202 WeakPolarHBondContact O-CB 3.44Å; D198-A202 PolarHBondContact O-N 3.08Å; M199-A202 PolarHBondContact O-N 3.4Å; E200-A202 VanDerWaalsContact C-N 3.3Å; E200-A202 PolarHBondContact O-N 2.87Å; A202-F206 VanDerWaalsContact O-CB 3.3Å; A202-F206 WeakPolarHBondContact O-CB 3.35Å; A202-F206 PolarHBondContact O-N 3.33Å; A202-F206 VanDerWaalsContact O-N 3.08Å; A202-M712 HydrophobicContact CB-CE 3.74Å
203	F	85.1	Confident	84.1	Confident	12 Å²	12	60.5 Å²	60.5	5%	0.053	31%	0.309	C	S	.	.	H	α-helix	trans	-74.9	-50.8	178.2	-176.1	-120.7	0	0	0	111.6	L112 F115 Y142 L145 L149 M199 E200 G205 F206 W207	L112-F203 HydrophobicContact CD2-CD1 3.78Å; L112-F203 HydrophobicContact CD2-CD2 3.86Å; L112-F203 HydrophobicContact CD2-CE1 3.77Å; L112-F203 HydrophobicContact CD2-CE2 3.88Å; L112-F203 HydrophobicContact CD2-CG 3.81Å; L112-F203 HydrophobicContact CD2-CZ 3.82Å; F115-F203 AromaticContact CD1-CE2 3.78Å; F115-F203 HydrophobicContact CD1-CE2 3.78Å; F115-F203 AromaticContact CD1-CZ 3.7Å; F115-F203 HydrophobicContact CD1-CZ 3.7Å; F115-F203 HydrophobicContact CE1-CE2 4.19Å; F115-F203 AromaticContact CE1-CZ 3.87Å; F115-F203 HydrophobicContact CE1-CZ 3.87Å; Y142-F203 HydrophobicContact CD2-CD1 4.01Å; Y142-F203 AromaticContact CD2-CE1 3.32Å; Y142-F203 HydrophobicContact CD2-CE1 3.32Å; Y142-F203 HydrophobicContact CD2-CE2 4.49Å; Y142-F203 AromaticContact CD2-CZ 3.61Å; Y142-F203 HydrophobicContact CD2-CZ 3.61Å; Y142-F203 AromaticContact CE2-CD1 3.77Å; Y142-F203 HydrophobicContact CE2-CD1 3.77Å; Y142-F203 AromaticContact CE2-CE1 3.57Å; Y142-F203 HydrophobicContact CE2-CE1 3.57Å; Y142-F203 HydrophobicContact CE2-CZ 4.23Å; Y142-F203 HydrophobicContact CG-CE1 4.38Å; L145-F203 HydrophobicContact CB-CE1 4.03Å; L145-F203 HydrophobicContact CB-CZ 4.1Å; L145-F203 HydrophobicContact CD1-CZ 3.96Å; L149-F203 HydrophobicContact CD1-CD1 4.16Å; M199-F203 VanDerWaalsContact O-CB 3.23Å; M199-F203 WeakPolarHBondContact O-CB 3.26Å; M199-F203 PolarHBondContact O-N 3.18Å; E200-F203 PolarHBondContact O-N 2.87Å; E200-F203 VanDerWaalsContact O-N 3.1Å; F203-G205 PolarHBondContact O-N 3.04Å; F203-F206 WeakPolarHBondContact O-CB 3.46Å; F203-F206 PolarHBondContact O-N 2.91Å; F203-F206 VanDerWaalsContact O-N 3.07Å; F203-W207 PolarHBondContact O-N 2.9Å
204	D	86.1	Confident	83.7	Confident	43 Å²	43	60.2 Å²	60.2	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-53.5	-53.6	172.7	-67.7	16.4	0	0	0	110.1	Y142 K146 E200 F206 W207 E208	Y142-D204 PolarHBondContact OH-OD1 2.91Å; K146-D204 WeakPolarHBondContact CE-OD1 3.42Å; K146-D204 IonicContact NZ-OD1 3.03Å; K146-D204 PolarHBondContact NZ-OD1 3.35Å; K146-D204 IonicContact NZ-OD2 3.87Å; K146-D204 PolarHBondContact NZ-OD2 2.68Å; E200-D204 PolarHBondContact O-N 3.39Å; D204-F206 PolarHBondContact O-N 3.06Å; D204-F206 VanDerWaalsContact O-N 3.14Å; D204-W207 PolarHBondContact O-N 3.35Å; D204-E208 WeakPolarHBondContact O-CG 3.44Å; D204-E208 PolarHBondContact O-N 3.2Å
205	G	81.3	Confident	83.7	Confident	21 Å²	21	61.7 Å²	61.7	22%	0.216	31%	0.306	C	S	.	.	H	α-helix	trans	-69.1	-8.4	179.5	0	0	0	0	0	115	T201 F203 K209	T201-G205 PolarHBondContact O-N 3.49Å; T201-G205 VanDerWaalsContact O-N 3.15Å; F203-G205 PolarHBondContact O-N 3.04Å; G205-K209 WeakPolarHBondContact O-CD 3.07Å; G205-K209 PolarHBondContact O-NZ 3.12Å
206	F	81.9	Confident	83.8	Confident	61 Å²	61	58.4 Å²	58.4	27%	0.268	29%	0.29	S	S	.	.	H	α-helix	trans	-89.1	-45.9	164.9	166.5	-94.7	0	0	0	110.4	L119 A202 F203 D204 K209 H210	L119-F206 HydrophobicContact CB-CE1 4.45Å; L119-F206 HydrophobicContact CB-CZ 4.43Å; L119-F206 HydrophobicContact CD1-CE1 3.87Å; A202-F206 VanDerWaalsContact O-CB 3.3Å; A202-F206 WeakPolarHBondContact O-CB 3.35Å; A202-F206 PolarHBondContact O-N 3.33Å; A202-F206 VanDerWaalsContact O-N 3.08Å; F203-F206 WeakPolarHBondContact O-CB 3.46Å; F203-F206 PolarHBondContact O-N 2.91Å; F203-F206 VanDerWaalsContact O-N 3.07Å; D204-F206 PolarHBondContact O-N 3.06Å; D204-F206 VanDerWaalsContact O-N 3.14Å; F206-K209 PolarHBondContact O-N 2.93Å; F206-H210 HydrophobicContact CE1-CB 4.43Å; F206-H210 PolarHBondContact O-N 3.21Å
207	W	85.6	Confident	83.5	Confident	16 Å²	16	62.3 Å²	62.3	6%	0.061	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-49.3	-178.5	178.3	-96.6	0	0	0	112.3	F115 L119 R138 A139 Y142 F203 D204 K209 H210 Q211	F115-W207 HydrophobicContact CE1-CE3 4.42Å; F115-W207 HydrophobicContact CE1-CZ3 4.33Å; F115-W207 HydrophobicContact CZ-CZ3 4.08Å; L119-W207 HydrophobicContact CD1-CE3 4.07Å; L119-W207 HydrophobicContact CD1-CZ3 3.92Å; L119-W207 HydrophobicContact CD2-CZ3 4.33Å; R138-W207 HydrophobicContact CB-CH2 3.96Å; R138-W207 HydrophobicContact CB-CZ3 4.28Å; A139-W207 HydrophobicContact CB-CH2 4.33Å; A139-W207 HydrophobicContact CB-CZ2 3.97Å; Y142-W207 AromaticContact CD1-CD1 3.87Å; Y142-W207 HydrophobicContact CD1-CD2 4.09Å; Y142-W207 AromaticContact CD1-CE2 3.97Å; Y142-W207 HydrophobicContact CD1-CG 4.06Å; Y142-W207 AromaticContact CD1-NE1 3.82Å; Y142-W207 HydrophobicContact CD2-CB 3.65Å; Y142-W207 AromaticContact CD2-CD1 4Å; Y142-W207 AromaticContact CD2-CD2 3.59Å; Y142-W207 HydrophobicContact CD2-CD2 3.59Å; Y142-W207 AromaticContact CD2-CE3 3.95Å; Y142-W207 HydrophobicContact CD2-CE3 3.95Å; Y142-W207 AromaticContact CD2-CG 3.41Å; Y142-W207 HydrophobicContact CD2-CG 3.41Å; Y142-W207 VanDerWaalsContact CD2-CG 3.41Å; Y142-W207 AromaticContact CE1-CD1 3.66Å; Y142-W207 HydrophobicContact CE1-CG 4.06Å; Y142-W207 AromaticContact CE1-NE1 3.97Å; Y142-W207 HydrophobicContact CE2-CB 3.37Å; Y142-W207 AromaticContact CE2-CD1 3.82Å; Y142-W207 HydrophobicContact CE2-CD2 4.14Å; Y142-W207 AromaticContact CE2-CG 3.43Å; Y142-W207 HydrophobicContact CE2-CG 3.43Å; Y142-W207 VanDerWaalsContact CE2-CG 3.43Å; Y142-W207 HydrophobicContact CG-CB 4.46Å; Y142-W207 AromaticContact CG-CD2 3.57Å; Y142-W207 HydrophobicContact CG-CD2 3.57Å; Y142-W207 AromaticContact CG-CE2 3.85Å; Y142-W207 AromaticContact CG-CE3 3.99Å; Y142-W207 HydrophobicContact CG-CE3 3.99Å; Y142-W207 AromaticContact CG-CG 3.74Å; Y142-W207 HydrophobicContact CG-CG 3.74Å; Y142-W207 HydrophobicContact CG-CZ2 4.49Å; Y142-W207 AromaticContact CZ-CD1 3.62Å; Y142-W207 AromaticContact CZ-CG 3.76Å; F203-W207 PolarHBondContact O-N 2.9Å; D204-W207 PolarHBondContact O-N 3.35Å; W207-K209 PolarHBondContact O-N 3.3Å; W207-K209 VanDerWaalsContact O-N 3.16Å; W207-H210 CarbonylContact O-C 3.42Å; W207-H210 WeakPolarHBondContact O-CA 3.27Å; W207-H210 WeakPolarHBondContact O-CB 3.32Å; W207-H210 PolarHBondContact O-N 2.82Å; W207-Q211 WeakPolarHBondContact O-CB 3.48Å; W207-Q211 PolarHBondContact O-N 3.46Å
208	E	86	Confident	83.3	Confident	125 Å²	125	58.7 Å²	58.7	58%	0.584	29%	0.29	S	S	*	.	H	α-helix	trans	-49.9	-44.4	176.1	-69.6	174.5	156	0	0	112.3	D204 L212	D204-E208 WeakPolarHBondContact O-CG 3.44Å; D204-E208 PolarHBondContact O-N 3.2Å; E208-L212 VanDerWaalsContact O-CB 3.28Å; E208-L212 WeakPolarHBondContact O-CB 3.38Å; E208-L212 PolarHBondContact O-N 3.26Å
209	K	80.6	Confident	83.6	Confident	140 Å²	140	58 Å²	58	61%	0.609	28%	0.284	S	S	*	.	H	α-helix	trans	-76.4	-31.2	-177.9	-61.3	-180	-175.5	62.3	0	112	G205 F206 W207 K213	G205-K209 WeakPolarHBondContact O-CD 3.07Å; G205-K209 PolarHBondContact O-NZ 3.12Å; F206-K209 PolarHBondContact O-N 2.93Å; W207-K209 PolarHBondContact O-N 3.3Å; W207-K209 VanDerWaalsContact O-N 3.16Å; K209-K213 VanDerWaalsContact O-CB 3.29Å; K209-K213 WeakPolarHBondContact O-CB 3.18Å; K209-K213 PolarHBondContact O-N 3.4Å
210	H	80.9	Confident	83.6	Confident	19 Å²	19	57.2 Å²	57.2	9%	0.088	28%	0.281	C	S	.	.	H	α-helix	trans	-68.9	-52.1	172.6	-175.6	94.8	0	0	0	110.3	L119 F206 W207 K213 M214	L119-H210 PolarHBondContact O-CE1 3.22Å; L119-H210 VanDerWaalsContact O-CE1 3.26Å; F206-H210 HydrophobicContact CE1-CB 4.43Å; F206-H210 PolarHBondContact O-N 3.21Å; W207-H210 CarbonylContact O-C 3.42Å; W207-H210 WeakPolarHBondContact O-CA 3.27Å; W207-H210 WeakPolarHBondContact O-CB 3.32Å; W207-H210 PolarHBondContact O-N 2.82Å; H210-K213 WeakPolarHBondContact O-CB 3.47Å; H210-K213 PolarHBondContact O-N 3.18Å; H210-M214 WeakPolarHBondContact NE2-CG 3.44Å; H210-M214 WeakPolarHBondContact O-CG 3.44Å; H210-M214 PolarHBondContact O-N 3.37Å
211	Q	84.4	Confident	83.6	Confident	79 Å²	79	59 Å²	59	37%	0.369	29%	0.286	S	S	.	.	H	α-helix	trans	-56.8	-54.7	179	178.5	176.3	-21.3	0	0	111.4	W207 K213 M214 E215	W207-Q211 WeakPolarHBondContact O-CB 3.48Å; W207-Q211 PolarHBondContact O-N 3.46Å; Q211-K213 PolarHBondContact O-N 3.03Å; Q211-K213 VanDerWaalsContact O-N 3.16Å; Q211-M214 WeakPolarHBondContact O-CA 3.48Å; Q211-M214 PolarHBondContact O-N 3.07Å; Q211-E215 HydrophobicContact CG-CG 4.36Å; Q211-E215 VanDerWaalsContact CG-OE1 3.25Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.46Å; Q211-E215 PolarHBondContact NE2-OE1 3.12Å; Q211-E215 WeakPolarHBondContact O-CG 3.36Å; Q211-E215 PolarHBondContact O-N 3.41Å
212	L	84.6	Confident	83.8	Confident	91 Å²	91	58 Å²	58	48%	0.476	28%	0.275	S	S	.	.	H	α-helix	trans	-54.2	-38.5	177.3	176.3	62.1	0	0	0	112.3	E208 Q216	E208-L212 VanDerWaalsContact O-CB 3.28Å; E208-L212 WeakPolarHBondContact O-CB 3.38Å; E208-L212 PolarHBondContact O-N 3.26Å; L212-Q216 HydrophobicContact CD1-CG 4.36Å; L212-Q216 WeakPolarHBondContact O-CB 3.34Å; L212-Q216 VanDerWaalsContact O-CG 3.32Å; L212-Q216 WeakPolarHBondContact O-CG 3.34Å; L212-Q216 PolarHBondContact O-N 3.47Å
213	K	81	Confident	84.4	Confident	126 Å²	126	56.5 Å²	56.5	55%	0.548	26%	0.262	S	S	.	.	H	α-helix	trans	-69.7	-36.9	177	-175.9	-166.8	169.2	-157.1	0	112.4	K209 H210 Q211 Y217	K209-K213 VanDerWaalsContact O-CB 3.29Å; K209-K213 WeakPolarHBondContact O-CB 3.18Å; K209-K213 PolarHBondContact O-N 3.4Å; H210-K213 WeakPolarHBondContact O-CB 3.47Å; H210-K213 PolarHBondContact O-N 3.18Å; Q211-K213 PolarHBondContact O-N 3.03Å; Q211-K213 VanDerWaalsContact O-N 3.16Å; K213-Y217 WeakPolarHBondContact O-CB 3.43Å; K213-Y217 PolarHBondContact O-N 3.04Å
214	M	79.8	Confident	84.5	Confident	20 Å²	20	59 Å²	59	10%	0.099	27%	0.274	C	S	.	.	H	α-helix	trans	-70.1	-41.3	175.4	-63.9	-56.7	106	0	0	111.2	L124 L135 H210 Q211 Y217 L218	L124-M214 HydrophobicContact CD1-SD 4.13Å; L135-M214 HydrophobicContact CD1-CB 4.11Å; L135-M214 HydrophobicContact CD2-CB 3.7Å; L135-M214 HydrophobicContact CD2-CG 3.58Å; L135-M214 HydrophobicContact CD2-SD 4.2Å; H210-M214 WeakPolarHBondContact NE2-CG 3.44Å; H210-M214 WeakPolarHBondContact O-CG 3.44Å; H210-M214 PolarHBondContact O-N 3.37Å; Q211-M214 WeakPolarHBondContact O-CA 3.48Å; Q211-M214 PolarHBondContact O-N 3.07Å; M214-Y217 WeakPolarHBondContact O-CB 3.41Å; M214-Y217 PolarHBondContact O-N 2.96Å; M214-L218 PolarHBondContact O-N 3.34Å
215	E	84.5	Confident	84.5	Confident	80 Å²	80	61.4 Å²	61.4	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-46.5	173.5	-70.5	172.4	-173.8	0	0	111.4	Q211 Y217 L218 Q219	Q211-E215 HydrophobicContact CG-CG 4.36Å; Q211-E215 VanDerWaalsContact CG-OE1 3.25Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.46Å; Q211-E215 PolarHBondContact NE2-OE1 3.12Å; Q211-E215 WeakPolarHBondContact O-CG 3.36Å; Q211-E215 PolarHBondContact O-N 3.41Å; E215-Y217 PolarHBondContact O-N 2.8Å; E215-L218 PolarHBondContact O-N 2.74Å; E215-Q219 WeakPolarHBondContact O-CB 3.47Å; E215-Q219 WeakPolarHBondContact O-CG 3.12Å; E215-Q219 PolarHBondContact O-N 3.18Å
216	Q	85.3	Confident	85.1	Confident	28 Å²	28	62.5 Å²	62.5	13%	0.131	29%	0.285	C	S	.	.	H	α-helix	trans	-63.8	-37.5	174	-74.7	-170.9	-4.8	0	0	112.4	L212 L218 Q219 L220 H290 Y291	L212-Q216 HydrophobicContact CD1-CG 4.36Å; L212-Q216 WeakPolarHBondContact O-CB 3.34Å; L212-Q216 VanDerWaalsContact O-CG 3.32Å; L212-Q216 WeakPolarHBondContact O-CG 3.34Å; L212-Q216 PolarHBondContact O-N 3.47Å; Q216-L218 PolarHBondContact O-N 3.33Å; Q216-Q219 PolarHBondContact O-N 2.92Å; Q216-L220 PolarHBondContact O-N 3.23Å; Q216-H290 WeakPolarHBondContact CA-NE2 3.23Å; Q216-H290 VanDerWaalsContact CB-NE2 3.34Å; Q216-H290 WeakPolarHBondContact CB-NE2 3.34Å; Q216-H290 PolarHBondContact O-CE1 3.38Å; Q216-H290 PolarHBondContact O-NE2 2.94Å; Q216-Y291 HydrophobicContact CB-CD1 3.7Å; Q216-Y291 HydrophobicContact CB-CE1 3.83Å
217	Y	82.3	Confident	85.6	Confident	82 Å²	82	59.8 Å²	59.8	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-45.2	174.3	-179.6	-99.8	0	0	0	111.8	L124 I131 K213 M214 E215 L220 W221	L124-Y217 HydrophobicContact CD1-CD1 3.69Å; L124-Y217 HydrophobicContact CD1-CE1 3.59Å; L124-Y217 HydrophobicContact CD1-CG 4.43Å; I131-Y217 HydrophobicContact CD1-CE1 4.47Å; K213-Y217 WeakPolarHBondContact O-CB 3.43Å; K213-Y217 PolarHBondContact O-N 3.04Å; M214-Y217 WeakPolarHBondContact O-CB 3.41Å; M214-Y217 PolarHBondContact O-N 2.96Å; E215-Y217 PolarHBondContact O-N 2.8Å; Y217-L220 PolarHBondContact O-N 2.88Å; Y217-W221 WeakPolarHBondContact O-CB 3.47Å; Y217-W221 PolarHBondContact O-N 3.16Å
218	L	82.9	Confident	85.8	Confident	32 Å²	32	63.7 Å²	63.7	17%	0.168	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-36.4	177	-170.4	67.6	0	0	0	112.3	I128 I131 E132 M214 E215 Q216 K222	I128-L218 HydrophobicContact CG2-CD1 4.42Å; I131-L218 HydrophobicContact CG2-CD1 4.45Å; E132-L218 HydrophobicContact CG-CD1 4.29Å; E132-L218 HydrophobicContact CG-CD2 4.18Å; E132-L218 WeakPolarHBondContact OE1-CD2 3.42Å; M214-L218 PolarHBondContact O-N 3.34Å; E215-L218 PolarHBondContact O-N 2.74Å; Q216-L218 PolarHBondContact O-N 3.33Å; L218-K222 HydrophobicContact CG-CD 4.36Å; L218-K222 WeakPolarHBondContact O-CB 3.48Å; L218-K222 WeakPolarHBondContact O-CG 3.31Å; L218-K222 PolarHBondContact O-N 2.75Å; L218-K222 VanDerWaalsContact O-N 3.09Å
219	Q	89.1	Confident	86.2	Confident	66 Å²	66	62.9 Å²	62.9	31%	0.308	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-46.6	174	-74.9	165	24.4	0	0	111.9	E215 Q216 F223 L285	E215-Q219 WeakPolarHBondContact O-CB 3.47Å; E215-Q219 WeakPolarHBondContact O-CG 3.12Å; E215-Q219 PolarHBondContact O-N 3.18Å; Q216-Q219 PolarHBondContact O-N 2.92Å; Q219-F223 WeakPolarHBondContact O-CB 3.44Å; Q219-F223 PolarHBondContact O-N 2.71Å; Q219-L285 HydrophobicContact CB-CD1 4.39Å; Q219-L285 HydrophobicContact CB-CD2 3.87Å; Q219-L285 HydrophobicContact CG-CD2 4.12Å; Q219-L285 VanDerWaalsContact OE1-CD2 3.31Å
220	L	86.4	Confident	86.9	Confident	16 Å²	16	56.5 Å²	56.5	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-47.2	175.9	179.3	65.3	0	0	0	111.6	Q216 Y217 K222 F223 E224 Y291 A292 L295 I296	Q216-L220 PolarHBondContact O-N 3.23Å; Y217-L220 PolarHBondContact O-N 2.88Å; L220-K222 PolarHBondContact O-N 3.12Å; L220-F223 HydrophobicContact CD1-CD1 4.38Å; L220-F223 CarbonylContact O-C 3.49Å; L220-F223 WeakPolarHBondContact O-CB 3.44Å; L220-F223 PolarHBondContact O-N 3.49Å; L220-F223 VanDerWaalsContact O-N 3.15Å; L220-E224 HydrophobicContact CD1-CG 4.25Å; L220-E224 PolarHBondContact O-N 3.43Å; L220-Y291 HydrophobicContact CD2-CE2 4.39Å; L220-Y291 WeakPolarHBondContact CD2-OH 3.39Å; L220-A292 HydrophobicContact CD1-CB 4.01Å; L220-A292 HydrophobicContact CD2-CB 3.76Å; L220-A292 HydrophobicContact CG-CB 4.46Å; L220-L295 HydrophobicContact CD1-CD2 4.37Å; L220-I296 HydrophobicContact CD1-CD1 4.08Å; L220-I296 HydrophobicContact CD1-CG1 3.75Å
221	W	84.3	Confident	87.4	Confident	74 Å²	74	56.1 Å²	56.1	28%	0.28	26%	0.261	S	S	.	.	H	α-helix	trans	-60.2	-46.4	-177.5	-170.4	102.5	0	0	0	111.1	I128 Y217 F223 E224 Q225	I128-W221 HydrophobicContact CD1-CE3 4.3Å; I128-W221 HydrophobicContact CD1-CH2 3.58Å; I128-W221 HydrophobicContact CD1-CZ3 3.32Å; I128-W221 HydrophobicContact CG1-CE3 4.14Å; I128-W221 HydrophobicContact CG1-CH2 3.5Å; I128-W221 VanDerWaalsContact CG1-CH2 3.5Å; I128-W221 HydrophobicContact CG1-CZ2 4.21Å; I128-W221 HydrophobicContact CG1-CZ3 3.45Å; I128-W221 VanDerWaalsContact CG1-CZ3 3.45Å; Y217-W221 WeakPolarHBondContact O-CB 3.47Å; Y217-W221 PolarHBondContact O-N 3.16Å; W221-F223 VanDerWaalsContact C-N 3.32Å; W221-F223 PolarHBondContact O-N 2.99Å; W221-E224 PolarHBondContact O-N 2.93Å; W221-Q225 HydrophobicContact CE3-CB 4.46Å; W221-Q225 HydrophobicContact CH2-CB 4.44Å; W221-Q225 HydrophobicContact CZ3-CB 4.02Å; W221-Q225 HydrophobicContact CZ3-CG 4.36Å; W221-Q225 VanDerWaalsContact CZ3-OE1 3.25Å; W221-Q225 PolarHBondContact O-N 2.63Å
222	K	87.6	Confident	87.8	Confident	54 Å²	54	56 Å²	56	24%	0.235	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-35.6	176.6	-69.4	178.8	179.9	-177.2	0	111.9	E132 L218 L220 Q225 D226	E132-K222 IonicContact OE1-NZ 2.74Å; E132-K222 PolarHBondContact OE1-NZ 3.09Å; L218-K222 HydrophobicContact CG-CD 4.36Å; L218-K222 WeakPolarHBondContact O-CB 3.48Å; L218-K222 WeakPolarHBondContact O-CG 3.31Å; L218-K222 PolarHBondContact O-N 2.75Å; L218-K222 VanDerWaalsContact O-N 3.09Å; L220-K222 PolarHBondContact O-N 3.12Å; K222-Q225 PolarHBondContact O-N 3.12Å; K222-D226 PolarHBondContact O-N 3.32Å
223	F	92.1	Very high	88.3	Confident	1 Å²	1	54.3 Å²	54.3	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-67.8	-38.7	173.2	167.9	-93.9	0	0	0	113.3	Q219 L220 W221 F227 V278 L285 I296 R299	Q219-F223 WeakPolarHBondContact O-CB 3.44Å; Q219-F223 PolarHBondContact O-N 2.71Å; L220-F223 HydrophobicContact CD1-CD1 4.38Å; L220-F223 CarbonylContact O-C 3.49Å; L220-F223 WeakPolarHBondContact O-CB 3.44Å; L220-F223 PolarHBondContact O-N 3.49Å; L220-F223 VanDerWaalsContact O-N 3.15Å; W221-F223 VanDerWaalsContact C-N 3.32Å; W221-F223 PolarHBondContact O-N 2.99Å; F223-F227 VanDerWaalsContact O-CB 3.24Å; F223-F227 WeakPolarHBondContact O-CB 3.18Å; F223-F227 PolarHBondContact O-N 3.37Å; F223-V278 HydrophobicContact CD2-CG1 4.14Å; F223-V278 HydrophobicContact CE2-CG1 4Å; F223-L285 HydrophobicContact CB-CD1 4.09Å; F223-L285 HydrophobicContact CG-CD1 4.37Å; F223-I296 HydrophobicContact CD1-CG1 4.18Å; F223-I296 HydrophobicContact CE1-CB 4.2Å; F223-I296 HydrophobicContact CE1-CG1 4.06Å; F223-I296 HydrophobicContact CE1-CG2 4.02Å; F223-I296 HydrophobicContact CE2-CG2 4.31Å; F223-I296 HydrophobicContact CZ-CB 4.48Å; F223-I296 HydrophobicContact CZ-CG2 3.87Å; F223-R299 HydrophobicContact CE1-CB 3.75Å; F223-R299 HydrophobicContact CE1-CG 4.12Å; F223-R299 HydrophobicContact CZ-CB 3.8Å
224	E	87	Confident	89	Confident	65 Å²	65	48.4 Å²	48.4	30%	0.304	23%	0.229	S	C	.	.	H	α-helix	trans	-69.7	-33	175.1	-72.1	-153.5	119.9	0	0	112.1	L220 W221 Q228 R299	L220-E224 HydrophobicContact CD1-CG 4.25Å; L220-E224 PolarHBondContact O-N 3.43Å; W221-E224 PolarHBondContact O-N 2.93Å; E224-Q228 WeakPolarHBondContact O-CB 3.36Å; E224-Q228 PolarHBondContact O-N 3.07Å; E224-R299 IonicContact OE1-NE 2.75Å; E224-R299 IonicContact OE1-NH2 2.74Å
225	Q	86.8	Confident	89.6	Confident	93 Å²	93	52.6 Å²	52.6	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-62.8	-54.9	170.2	-172.6	-175.8	26.5	0	0	111.3	W221 K222 F227 Q228 E229	W221-Q225 HydrophobicContact CE3-CB 4.46Å; W221-Q225 HydrophobicContact CH2-CB 4.44Å; W221-Q225 HydrophobicContact CZ3-CB 4.02Å; W221-Q225 HydrophobicContact CZ3-CG 4.36Å; W221-Q225 VanDerWaalsContact CZ3-OE1 3.25Å; W221-Q225 PolarHBondContact O-N 2.63Å; K222-Q225 PolarHBondContact O-N 3.12Å; Q225-F227 PolarHBondContact O-N 3.34Å; Q225-Q228 PolarHBondContact O-N 3.28Å; Q225-E229 PolarHBondContact O-N 3.14Å
226	D	93.1	Very high	90	Very high	45 Å²	45	54.8 Å²	54.8	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-51	-45	176.2	-71.2	-6.7	0	0	0	111.4	K222 A230 V278 R281	K222-D226 PolarHBondContact O-N 3.32Å; D226-A230 WeakPolarHBondContact O-CB 3.48Å; D226-A230 PolarHBondContact O-N 2.78Å; D226-A230 VanDerWaalsContact O-N 3.11Å; D226-V278 HydrophobicContact CB-CB 4.42Å; D226-V278 HydrophobicContact CB-CG1 3.79Å; D226-V278 HydrophobicContact CB-CG2 3.75Å; D226-R281 IonicContact OD1-NH1 3.9Å; D226-R281 PolarHBondContact OD1-NH1 3.32Å; D226-R281 WeakPolarHBondContact OD2-CD 3.41Å; D226-R281 IonicContact OD2-CZ 3.72Å; D226-R281 IonicContact OD2-NE 3.47Å; D226-R281 IonicContact OD2-NH1 2.76Å; D226-R281 PolarHBondContact OD2-NH1 2.78Å
227	F	93.6	Very high	90.5	Very high	4 Å²	4	54 Å²	54	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-65.4	-49.1	179.3	165.7	-91.8	0	0	0	112	F223 Q225 E229 A230 V231 V278 R299 E302 L303	F223-F227 VanDerWaalsContact O-CB 3.24Å; F223-F227 WeakPolarHBondContact O-CB 3.18Å; F223-F227 PolarHBondContact O-N 3.37Å; Q225-F227 PolarHBondContact O-N 3.34Å; F227-E229 VanDerWaalsContact C-N 3.34Å; F227-E229 PolarHBondContact O-N 2.8Å; F227-A230 PolarHBondContact O-N 3.4Å; F227-V231 HydrophobicContact CD1-CG2 4.41Å; F227-V231 HydrophobicContact CD2-CG2 4.2Å; F227-V231 HydrophobicContact CE1-CG2 3.93Å; F227-V231 HydrophobicContact CE2-CG2 3.71Å; F227-V231 HydrophobicContact CZ-CG2 3.54Å; F227-V231 WeakPolarHBondContact O-CG2 3.24Å; F227-V231 PolarHBondContact O-N 2.94Å; F227-V278 HydrophobicContact CB-CG1 4.34Å; F227-R299 HydrophobicContact CD1-CG 4.39Å; F227-R299 HydrophobicContact CD2-CB 3.75Å; F227-R299 HydrophobicContact CD2-CG 4.33Å; F227-R299 HydrophobicContact CE1-CG 4.4Å; F227-R299 HydrophobicContact CE2-CB 3.85Å; F227-R299 HydrophobicContact CE2-CG 4.32Å; F227-R299 WeakPolarHBondContact CE2-O 3.24Å; F227-R299 HydrophobicContact CG-CB 4.19Å; F227-R299 HydrophobicContact CG-CG 4.37Å; F227-R299 HydrophobicContact CZ-CB 4.38Å; F227-R299 HydrophobicContact CZ-CG 4.37Å; F227-E302 HydrophobicContact CE2-CB 4.28Å; F227-E302 HydrophobicContact CE2-CG 4.29Å; F227-E302 HydrophobicContact CZ-CB 4.47Å; F227-E302 HydrophobicContact CZ-CG 4.07Å; F227-E302 WeakPolarHBondContact CZ-OE2 3.12Å; F227-L303 HydrophobicContact CD2-CB 3.99Å; F227-L303 HydrophobicContact CD2-CD2 4.24Å; F227-L303 HydrophobicContact CE2-CB 3.93Å
228	Q	89.8	Confident	91	Very high	98 Å²	98	51.2 Å²	51.2	46%	0.458	24%	0.244	S	C	.	.	H	α-helix	trans	-68	-35.9	-176.7	-173.7	58.8	54.1	0	0	111.5	E224 Q225 T232	E224-Q228 WeakPolarHBondContact O-CB 3.36Å; E224-Q228 PolarHBondContact O-N 3.07Å; Q225-Q228 PolarHBondContact O-N 3.28Å; Q228-T232 PolarHBondContact NE2-OG1 3.44Å; Q228-T232 WeakPolarHBondContact O-CB 3.02Å; Q228-T232 PolarHBondContact O-N 3.1Å; Q228-T232 PolarHBondContact O-OG1 3.27Å
229	E	94.6	Very high	91.5	Very high	107 Å²	107	51.2 Å²	51.2	50%	0.5	25%	0.247	S	C	.	.	H	α-helix	trans	-60.4	-49.9	170.7	-176.9	-177.4	149.8	0	0	110.9	Q225 F227 V231 T232 Q233	Q225-E229 PolarHBondContact O-N 3.14Å; F227-E229 VanDerWaalsContact C-N 3.34Å; F227-E229 PolarHBondContact O-N 2.8Å; E229-V231 PolarHBondContact O-N 3Å; E229-T232 PolarHBondContact O-N 2.7Å; E229-Q233 VanDerWaalsContact CG-NE2 3.26Å; E229-Q233 WeakPolarHBondContact O-CG 3.46Å; E229-Q233 PolarHBondContact O-N 3.1Å; E229-Q233 PolarHBondContact OE1-NE2 3.18Å
230	A	95	Very high	91.6	Very high	6 Å²	6	50 Å²	50	5%	0.05	24%	0.241	C	C	.	.	H	α-helix	trans	-61.4	-44.2	-179.4	0	0	0	0	0	112.4	D226 F227 Q233 V234 L303	D226-A230 WeakPolarHBondContact O-CB 3.48Å; D226-A230 PolarHBondContact O-N 2.78Å; D226-A230 VanDerWaalsContact O-N 3.11Å; F227-A230 PolarHBondContact O-N 3.4Å; A230-Q233 PolarHBondContact O-N 3.45Å; A230-V234 WeakPolarHBondContact O-CG2 3.47Å; A230-V234 PolarHBondContact O-N 3.12Å; A230-L303 HydrophobicContact CB-CD1 3.91Å; A230-L303 HydrophobicContact CB-CD2 4Å
231	V	92	Very high	91.9	Very high	12 Å²	12	49.5 Å²	49.5	7%	0.073	24%	0.238	C	C	.	.	H	α-helix	trans	-59.5	-48.6	174.9	170.4	0	0	0	0	111	F227 E229 Q233 V234 E235 L303 L306	F227-V231 HydrophobicContact CD1-CG2 4.41Å; F227-V231 HydrophobicContact CD2-CG2 4.2Å; F227-V231 HydrophobicContact CE1-CG2 3.93Å; F227-V231 HydrophobicContact CE2-CG2 3.71Å; F227-V231 HydrophobicContact CZ-CG2 3.54Å; F227-V231 WeakPolarHBondContact O-CG2 3.24Å; F227-V231 PolarHBondContact O-N 2.94Å; E229-V231 PolarHBondContact O-N 3Å; V231-Q233 VanDerWaalsContact C-N 3.29Å; V231-Q233 PolarHBondContact O-N 3.49Å; V231-V234 PolarHBondContact O-N 2.71Å; V231-E235 HydrophobicContact CG1-CG 4.41Å; V231-E235 PolarHBondContact O-N 3.45Å; V231-L303 HydrophobicContact CG2-CD1 4.19Å; V231-L306 HydrophobicContact CG1-CD1 4.1Å; V231-L306 HydrophobicContact CG2-CD1 3.89Å
232	T	92.6	Very high	92.2	Very high	75 Å²	75	53.6 Å²	53.6	46%	0.46	25%	0.254	S	S	.	.	H	α-helix	trans	-60.5	-39.4	-179.5	-51.5	0	0	0	0	111.4	Q228 E229 F236	Q228-T232 PolarHBondContact NE2-OG1 3.44Å; Q228-T232 WeakPolarHBondContact O-CB 3.02Å; Q228-T232 PolarHBondContact O-N 3.1Å; Q228-T232 PolarHBondContact O-OG1 3.27Å; E229-T232 PolarHBondContact O-N 2.7Å; T232-F236 WeakPolarHBondContact O-CB 3.39Å; T232-F236 PolarHBondContact O-N 3.04Å; T232-F236 VanDerWaalsContact O-N 3.09Å
233	Q	95.4	Very high	92.2	Very high	57 Å²	57	57.7 Å²	57.7	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-68.3	-36.3	174.4	-70.7	-178.7	38.3	0	0	112.5	E229 A230 V231 F236 L237 L271	E229-Q233 VanDerWaalsContact CG-NE2 3.26Å; E229-Q233 WeakPolarHBondContact O-CG 3.46Å; E229-Q233 PolarHBondContact O-N 3.1Å; E229-Q233 PolarHBondContact OE1-NE2 3.18Å; A230-Q233 PolarHBondContact O-N 3.45Å; V231-Q233 VanDerWaalsContact C-N 3.29Å; V231-Q233 PolarHBondContact O-N 3.49Å; Q233-F236 PolarHBondContact O-N 3.1Å; Q233-L237 PolarHBondContact O-N 2.9Å; Q233-L271 VanDerWaalsContact C-CD2 3.49Å; Q233-L271 HydrophobicContact CB-CD1 3.62Å; Q233-L271 HydrophobicContact CB-CD2 3.7Å; Q233-L271 HydrophobicContact CB-CG 4.32Å
234	V	94	Very high	91.9	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-66.2	-46.1	176.6	168.9	0	0	0	0	110.5	A230 V231 F236 L237 L238 L271 L306 L310	A230-V234 WeakPolarHBondContact O-CG2 3.47Å; A230-V234 PolarHBondContact O-N 3.12Å; V231-V234 PolarHBondContact O-N 2.71Å; V234-F236 VanDerWaalsContact C-N 3.29Å; V234-F236 PolarHBondContact O-N 2.84Å; V234-L237 PolarHBondContact O-N 3.32Å; V234-L238 HydrophobicContact CG1-CD1 3.99Å; V234-L238 HydrophobicContact CG1-CG 4.48Å; V234-L238 WeakPolarHBondContact O-CG 3.27Å; V234-L238 PolarHBondContact O-N 2.87Å; V234-L271 HydrophobicContact CB-CD2 4.29Å; V234-L271 HydrophobicContact CG2-CD2 3.6Å; V234-L271 HydrophobicContact CG2-CG 4.13Å; V234-L306 HydrophobicContact CG1-CB 4.18Å; V234-L310 HydrophobicContact CG1-CB 4.21Å; V234-L310 HydrophobicContact CG1-CD2 4.25Å; V234-L310 HydrophobicContact CG2-CD2 4.18Å
235	E	92.8	Very high	91.4	Very high	109 Å²	109	57 Å²	57	51%	0.509	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-36.2	177.4	-68.3	-170.2	140.6	0	0	112.3	V231 L238 S239	V231-E235 HydrophobicContact CG1-CG 4.41Å; V231-E235 PolarHBondContact O-N 3.45Å; E235-L238 CarbonylContact O-C 3.59Å; E235-L238 PolarHBondContact O-N 3Å; E235-S239 PolarHBondContact O-N 3.46Å
236	F	94.5	Very high	90.8	Very high	126 Å²	126	56.7 Å²	56.7	55%	0.553	28%	0.281	S	S	*	.	H	α-helix	trans	-71.4	-32.9	176.1	178.5	-124.1	0	0	0	113.9	T232 Q233 V234 S239 Q240	T232-F236 WeakPolarHBondContact O-CB 3.39Å; T232-F236 PolarHBondContact O-N 3.04Å; T232-F236 VanDerWaalsContact O-N 3.09Å; Q233-F236 PolarHBondContact O-N 3.1Å; V234-F236 VanDerWaalsContact C-N 3.29Å; V234-F236 PolarHBondContact O-N 2.84Å; F236-S239 PolarHBondContact O-OG 2.76Å; F236-Q240 HydrophobicContact CE2-CG 4.49Å; F236-Q240 VanDerWaalsContact CZ-NE2 3.31Å; F236-Q240 PolarHBondContact O-N 3.47Å; F236-Q240 PolarHBondContact O-NE2 3.04Å; F236-Q240 VanDerWaalsContact O-NE2 3.1Å
237	L	94.6	Very high	90	Very high	12 Å²	12	55.5 Å²	55.5	6%	0.063	27%	0.274	C	S	.	.	H	α-helix	trans	-72.3	-35.3	168.8	-68.3	-174.7	0	0	0	111.4	Q233 V234 Q240 Q241 L264 K267 L271 L310	Q233-L237 PolarHBondContact O-N 2.9Å; V234-L237 PolarHBondContact O-N 3.32Å; L237-Q240 PolarHBondContact O-N 2.82Å; L237-Q241 WeakPolarHBondContact O-CB 3.11Å; L237-Q241 PolarHBondContact O-N 3.38Å; L237-L264 HydrophobicContact CD2-CD2 4.18Å; L237-K267 HydrophobicContact CD1-CB 4.36Å; L237-K267 HydrophobicContact CD2-CB 4.24Å; L237-L271 HydrophobicContact CD1-CB 4.4Å; L237-L271 HydrophobicContact CD1-CD2 3.72Å; L237-L271 HydrophobicContact CG-CD2 4.37Å; L237-L310 HydrophobicContact CB-CD1 3.89Å; L237-L310 HydrophobicContact CD1-CD2 4.27Å
238	L	93.3	Very high	89	Confident	23 Å²	23	57.7 Å²	57.7	12%	0.12	29%	0.288	C	S	.	.	H	α-helix	trans	-68.1	-29.1	172.7	-72.7	172.8	0	0	0	113	V234 E235 R242 I309 L310 E313	V234-L238 HydrophobicContact CG1-CD1 3.99Å; V234-L238 HydrophobicContact CG1-CG 4.48Å; V234-L238 WeakPolarHBondContact O-CG 3.27Å; V234-L238 PolarHBondContact O-N 2.87Å; E235-L238 CarbonylContact O-C 3.59Å; E235-L238 PolarHBondContact O-N 3Å; L238-R242 WeakPolarHBondContact O-CG 3.35Å; L238-R242 PolarHBondContact O-N 3.09Å; L238-R242 PolarHBondContact O-NE 3.29Å; L238-I309 HydrophobicContact CD1-CG2 4.19Å; L238-I309 HydrophobicContact CD2-CG2 4.3Å; L238-L310 HydrophobicContact CD2-CD1 3.96Å; L238-L310 HydrophobicContact CG-CD1 4.05Å; L238-E313 HydrophobicContact CD2-CB 4.1Å; L238-E313 HydrophobicContact CD2-CG 4.25Å
239	S	92.2	Very high	88.4	Confident	31 Å²	31	54.6 Å²	54.6	22%	0.217	28%	0.283	C	S	.	.	H	α-helix	trans	-69.4	-49.7	170.2	87.1	0	0	0	0	110.7	E235 F236 Q241 R242 E243	E235-S239 PolarHBondContact O-N 3.46Å; F236-S239 PolarHBondContact O-OG 2.76Å; S239-Q241 VanDerWaalsContact C-N 3.31Å; S239-Q241 PolarHBondContact O-N 3.41Å; S239-R242 WeakPolarHBondContact O-CA 3.33Å; S239-R242 WeakPolarHBondContact O-CB 3.29Å; S239-R242 PolarHBondContact O-N 2.9Å; S239-E243 WeakPolarHBondContact O-CG 3.37Å; S239-E243 PolarHBondContact O-N 3Å; S239-E243 PolarHBondContact OG-OE1 3.24Å; S239-E243 VanDerWaalsContact OG-OE1 3.1Å
240	Q	92.3	Very high	87.8	Confident	41 Å²	41	53.2 Å²	53.2	19%	0.192	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-37.1	177.6	-78	171.5	87.1	0	0	113.3	F236 L237 R242 E243 L244 L264	F236-Q240 HydrophobicContact CE2-CG 4.49Å; F236-Q240 VanDerWaalsContact CZ-NE2 3.31Å; F236-Q240 PolarHBondContact O-N 3.47Å; F236-Q240 PolarHBondContact O-NE2 3.04Å; F236-Q240 VanDerWaalsContact O-NE2 3.1Å; L237-Q240 PolarHBondContact O-N 2.82Å; Q240-R242 VanDerWaalsContact C-N 3.32Å; Q240-R242 PolarHBondContact O-N 3.43Å; Q240-E243 PolarHBondContact O-N 3.36Å; Q240-L244 PolarHBondContact O-N 3.25Å; Q240-L264 HydrophobicContact CB-CD1 4.01Å; Q240-L264 HydrophobicContact CB-CD2 3.86Å
241	Q	92.8	Very high	87.3	Confident	5 Å²	5	55 Å²	55	2%	0.023	29%	0.287	C	S	.	.	H	α-helix	trans	-61.2	-40.3	174.1	-176.1	-90.3	19.7	0	0	111.6	L237 S239 E313 I314	L237-Q241 WeakPolarHBondContact O-CB 3.11Å; L237-Q241 PolarHBondContact O-N 3.38Å; S239-Q241 VanDerWaalsContact C-N 3.31Å; S239-Q241 PolarHBondContact O-N 3.41Å; Q241-E313 PolarHBondContact NE2-O 3.19Å; Q241-E313 PolarHBondContact NE2-OE2 3.38Å; Q241-I314 HydrophobicContact CG-CG1 4.44Å
242	R	89.6	Confident	87.1	Confident	161 Å²	161	57.7 Å²	57.7	61%	0.608	31%	0.311	S	S	*	.	H	α-helix	trans	-71.8	-37.9	177	-71.6	175.7	-74.8	179.6	-2	111.6	L238 S239 Q240 L244 G245	L238-R242 WeakPolarHBondContact O-CG 3.35Å; L238-R242 PolarHBondContact O-N 3.09Å; L238-R242 PolarHBondContact O-NE 3.29Å; S239-R242 WeakPolarHBondContact O-CA 3.33Å; S239-R242 WeakPolarHBondContact O-CB 3.29Å; S239-R242 PolarHBondContact O-N 2.9Å; Q240-R242 VanDerWaalsContact C-N 3.32Å; Q240-R242 PolarHBondContact O-N 3.43Å; R242-L244 PolarHBondContact O-N 2.89Å; R242-G245 PolarHBondContact O-N 3.34Å
243	E	89.1	Confident	86.8	Confident	140 Å²	140	58.2 Å²	58.2	65%	0.654	31%	0.308	S	S	*	.	H	α-helix	trans	-65.3	-17.1	176.5	-71.1	166	-131.3	0	0	114.3	S239 Q240 G245	S239-E243 WeakPolarHBondContact O-CG 3.37Å; S239-E243 PolarHBondContact O-N 3Å; S239-E243 PolarHBondContact OG-OE1 3.24Å; S239-E243 VanDerWaalsContact OG-OE1 3.1Å; Q240-E243 PolarHBondContact O-N 3.36Å; E243-G245 PolarHBondContact O-N 2.94Å; E243-G245 VanDerWaalsContact O-N 3.14Å
244	L	85.3	Confident	86.5	Confident	20 Å²	20	55.5 Å²	55.5	11%	0.105	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.7	167.5	-63	-175.3	0	0	0	112.7	Q240 R242 R257 K260 L261 L264	Q240-L244 PolarHBondContact O-N 3.25Å; R242-L244 PolarHBondContact O-N 2.89Å; L244-R257 VanDerWaalsContact O-CD 3.26Å; L244-R257 WeakPolarHBondContact O-CD 3.28Å; L244-R257 PolarHBondContact O-NE 3.1Å; L244-K260 HydrophobicContact CD2-CB 3.62Å; L244-K260 HydrophobicContact CD2-CD 3.82Å; L244-K260 HydrophobicContact CD2-CG 4.4Å; L244-L261 HydrophobicContact CD1-CB 3.8Å; L244-L261 HydrophobicContact CD1-CD1 3.93Å; L244-L261 HydrophobicContact CD1-CG 4.38Å; L244-L264 HydrophobicContact CD1-CD1 4.03Å; L244-L264 HydrophobicContact CD2-CD1 4.49Å; L244-L264 HydrophobicContact CG-CD1 4.25Å
245	G	77	Confident	86.3	Confident	31 Å²	31	61.2 Å²	61.2	32%	0.32	32%	0.32	S	S	.	.			trans	80.4	-160.6	175	0	0	0	0	0	113.2	R242 E243 K317	R242-G245 PolarHBondContact O-N 3.34Å; E243-G245 PolarHBondContact O-N 2.94Å; E243-G245 VanDerWaalsContact O-N 3.14Å; G245-K317 VanDerWaalsContact O-CE 3.28Å; G245-K317 WeakPolarHBondContact O-CE 3.48Å; G245-K317 PolarHBondContact O-NZ 2.8Å
246	D	73.1	Confident	86.3	Confident	86 Å²	86	61.8 Å²	61.8	46%	0.46	32%	0.322	S	S	.	.			trans	-71.2	160.6	179.8	-174.4	38.4	0	0	0	112.9	T248 R257	D246-T248 PolarHBondContact O-N 3.43Å; D246-T248 VanDerWaalsContact OD2-CB 3.29Å; D246-T248 WeakPolarHBondContact OD2-CB 3.39Å; D246-T248 WeakPolarHBondContact OD2-CG2 3.45Å; D246-T248 PolarHBondContact OD2-N 3.28Å; D246-T248 PolarHBondContact OD2-OG1 2.93Å; D246-R257 PolarHBondContact O-NE 3.25Å; D246-R257 PolarHBondContact O-NH1 3.1Å; D246-R257 PolarHBondContact O-NH2 3.49Å
247	I	76.4	Confident	86.1	Confident	20 Å²	20	58.3 Å²	58.3	10%	0.103	31%	0.306	C	S	.	.	S	Bend	trans	-65.4	-27.7	180	-46.5	160.3	0	0	0	110.4	Q320 L321 T324 L391	I247-Q320 HydrophobicContact CD1-CB 3.88Å; I247-Q320 HydrophobicContact CD1-CG 3.97Å; I247-Q320 HydrophobicContact CG1-CB 4.12Å; I247-Q320 HydrophobicContact CG2-CB 4.09Å; I247-L321 HydrophobicContact CG2-CD2 4.07Å; I247-L321 HydrophobicContact CG2-CG 4.46Å; I247-T324 HydrophobicContact CG2-CG2 4.43Å; I247-T324 VanDerWaalsContact CG2-OG1 3.25Å; I247-T324 WeakPolarHBondContact CG2-OG1 3.34Å; I247-L391 HydrophobicContact CD1-CD2 3.88Å
248	T	72.3	Confident	86	Confident	51 Å²	51	59.5 Å²	59.5	31%	0.313	31%	0.312	S	S	.	.			trans	-74.3	152.2	-175.3	62.1	0	0	0	0	114.7	D246 R257	D246-T248 PolarHBondContact O-N 3.43Å; D246-T248 VanDerWaalsContact OD2-CB 3.29Å; D246-T248 WeakPolarHBondContact OD2-CB 3.39Å; D246-T248 WeakPolarHBondContact OD2-CG2 3.45Å; D246-T248 PolarHBondContact OD2-N 3.28Å; D246-T248 PolarHBondContact OD2-OG1 2.93Å; T248-R257 VanDerWaalsContact O-CZ 3.3Å; T248-R257 PolarHBondContact O-NH1 3.27Å; T248-R257 PolarHBondContact O-NH2 3.38Å
249	G	78.1	Confident	86	Confident	33 Å²	33	64.7 Å²	64.7	34%	0.34	33%	0.333	S	S	.	.	S	Bend	trans	162.3	-156.2	177.8	0	0	0	0	0	111.5	H328	G249-H328 PolarHBondContact O-CE1 3.27Å; G249-H328 PolarHBondContact O-NE2 3.05Å
250	N	81.6	Confident	86.1	Confident	78 Å²	78	68.6 Å²	68.6	42%	0.417	35%	0.347	S	S	.	.			trans	-101.5	167.2	166.2	71.1	44.9	0	0	0	112	A252 Q253 V254	N250-A252 VanDerWaalsContact C-N 3.25Å; N250-A252 PolarHBondContact O-N 2.89Å; N250-A252 VanDerWaalsContact O-N 3.14Å; N250-A252 WeakPolarHBondContact OD1-CB 3.32Å; N250-A252 PolarHBondContact OD1-N 3.44Å; N250-A252 VanDerWaalsContact OD1-N 3.09Å; N250-Q253 PolarHBondContact ND2-OE1 2.72Å; N250-Q253 PolarHBondContact O-N 3.37Å; N250-Q253 VanDerWaalsContact O-N 3.07Å; N250-Q253 WeakPolarHBondContact OD1-CG 3.29Å; N250-Q253 PolarHBondContact OD1-N 2.93Å; N250-V254 WeakPolarHBondContact O-CG2 3.32Å; N250-V254 PolarHBondContact O-N 3.11Å
251	L	84.6	Confident	86.2	Confident	44 Å²	44	66.7 Å²	66.7	23%	0.23	34%	0.338	C	S	.	.	H	α-helix	trans	-51.3	-39.8	-177.4	-177.2	69.4	0	0	0	113.7	K255 F325 H328	L251-K255 VanDerWaalsContact O-CB 3.27Å; L251-K255 WeakPolarHBondContact O-CB 3.37Å; L251-K255 PolarHBondContact O-N 2.93Å; L251-F325 HydrophobicContact CD1-CD2 3.61Å; L251-F325 HydrophobicContact CD1-CE2 3.4Å; L251-F325 VanDerWaalsContact CD1-CE2 3.4Å; L251-F325 HydrophobicContact CD1-CZ 4.2Å; L251-F325 HydrophobicContact CG-CE2 4.21Å; L251-H328 HydrophobicContact CB-CB 4.09Å; L251-H328 HydrophobicContact CD1-CB 3.59Å; L251-H328 HydrophobicContact CG-CB 4.42Å
252	A	87	Confident	86.3	Confident	68 Å²	68	71.5 Å²	71.5	56%	0.562	36%	0.36	S	S	*	.	H	α-helix	trans	-71.7	-42.5	-180	0	0	0	0	0	111.8	N250 K255 Q256	N250-A252 VanDerWaalsContact C-N 3.25Å; N250-A252 PolarHBondContact O-N 2.89Å; N250-A252 VanDerWaalsContact O-N 3.14Å; N250-A252 WeakPolarHBondContact OD1-CB 3.32Å; N250-A252 PolarHBondContact OD1-N 3.44Å; N250-A252 VanDerWaalsContact OD1-N 3.09Å; A252-K255 PolarHBondContact O-N 3.38Å; A252-Q256 WeakPolarHBondContact O-CB 3.36Å; A252-Q256 PolarHBondContact O-N 2.93Å
253	Q	87.6	Confident	86.5	Confident	86 Å²	86	68.4 Å²	68.4	40%	0.402	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-45.9	175.5	-69.1	166	-23.2	0	0	111.6	N250 K255 Q256 R257	N250-Q253 PolarHBondContact ND2-OE1 2.72Å; N250-Q253 PolarHBondContact O-N 3.37Å; N250-Q253 VanDerWaalsContact O-N 3.07Å; N250-Q253 WeakPolarHBondContact OD1-CG 3.29Å; N250-Q253 PolarHBondContact OD1-N 2.93Å; Q253-K255 PolarHBondContact O-N 2.93Å; Q253-Q256 PolarHBondContact O-N 3.42Å; Q253-R257 WeakPolarHBondContact O-CG 3.37Å; Q253-R257 PolarHBondContact O-N 3.03Å
254	V	88.4	Confident	86.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.2	-41.9	177.2	179.2	0	0	0	0	110.7	N250 Q256 R257 L258 L321 T324 F325	N250-V254 WeakPolarHBondContact O-CG2 3.32Å; N250-V254 PolarHBondContact O-N 3.11Å; V254-Q256 VanDerWaalsContact C-N 3.32Å; V254-Q256 PolarHBondContact O-N 2.84Å; V254-R257 PolarHBondContact O-N 3.33Å; V254-L258 HydrophobicContact CG1-CD1 4.45Å; V254-L258 PolarHBondContact O-N 3.3Å; V254-L321 HydrophobicContact CG1-CD2 4.18Å; V254-T324 HydrophobicContact CG2-CG2 4.41Å; V254-F325 HydrophobicContact CG1-CB 3.88Å; V254-F325 HydrophobicContact CG1-CD2 4.45Å
255	K	90.3	Very high	87.2	Confident	121 Å²	121	62.4 Å²	62.4	53%	0.526	33%	0.327	S	S	.	.	H	α-helix	trans	-61.6	-37.8	173.6	-167	176.9	-172.2	-179.4	0	112.6	L251 A252 Q253 K259 F325	L251-K255 VanDerWaalsContact O-CB 3.27Å; L251-K255 WeakPolarHBondContact O-CB 3.37Å; L251-K255 PolarHBondContact O-N 2.93Å; A252-K255 PolarHBondContact O-N 3.38Å; Q253-K255 PolarHBondContact O-N 2.93Å; K255-K259 PolarHBondContact O-N 3.27Å; K255-F325 HydrophobicContact CB-CD2 4.29Å; K255-F325 HydrophobicContact CB-CE2 3.86Å; K255-F325 HydrophobicContact CD-CE2 4.23Å; K255-F325 HydrophobicContact CG-CE2 4.08Å
256	Q	91.7	Very high	88.1	Confident	121 Å²	121	65.7 Å²	65.7	57%	0.565	34%	0.337	S	S	*	.	H	α-helix	trans	-69.7	-40.7	175.9	-168.5	-176.7	16.1	0	0	112	A252 Q253 V254 K259 K260	A252-Q256 WeakPolarHBondContact O-CB 3.36Å; A252-Q256 PolarHBondContact O-N 2.93Å; Q253-Q256 PolarHBondContact O-N 3.42Å; V254-Q256 VanDerWaalsContact C-N 3.32Å; V254-Q256 PolarHBondContact O-N 2.84Å; Q256-K259 PolarHBondContact O-N 3.19Å; Q256-K260 PolarHBondContact O-N 2.91Å
257	R	90.8	Very high	89.1	Confident	53 Å²	53	66.4 Å²	66.4	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-41.6	174.2	-71.1	-170.1	-171.2	112.1	-11.7	112.1	L244 D246 T248 Q253 V254 K259 K260 L261 L321	L244-R257 VanDerWaalsContact O-CD 3.26Å; L244-R257 WeakPolarHBondContact O-CD 3.28Å; L244-R257 PolarHBondContact O-NE 3.1Å; D246-R257 PolarHBondContact O-NE 3.25Å; D246-R257 PolarHBondContact O-NH1 3.1Å; D246-R257 PolarHBondContact O-NH2 3.49Å; T248-R257 VanDerWaalsContact O-CZ 3.3Å; T248-R257 PolarHBondContact O-NH1 3.27Å; T248-R257 PolarHBondContact O-NH2 3.38Å; Q253-R257 WeakPolarHBondContact O-CG 3.37Å; Q253-R257 PolarHBondContact O-N 3.03Å; V254-R257 PolarHBondContact O-N 3.33Å; R257-K259 PolarHBondContact O-N 3.25Å; R257-K260 PolarHBondContact O-N 3.28Å; R257-L261 WeakPolarHBondContact O-CB 3.47Å; R257-L261 PolarHBondContact O-N 3.47Å; R257-L321 HydrophobicContact CB-CD1 4.07Å; R257-L321 HydrophobicContact CB-CD2 4.25Å
258	L	92.2	Very high	90.1	Very high	36 Å²	36	65.5 Å²	65.5	19%	0.188	33%	0.331	C	S	.	.	H	α-helix	trans	-57.3	-48.3	174.8	-79.7	168.5	0	0	0	111.6	V254 K260 L261 E262 L321 F325	V254-L258 HydrophobicContact CG1-CD1 4.45Å; V254-L258 PolarHBondContact O-N 3.3Å; L258-K260 VanDerWaalsContact C-N 3.34Å; L258-K260 PolarHBondContact O-N 2.88Å; L258-L261 PolarHBondContact O-N 2.93Å; L258-E262 PolarHBondContact O-N 3Å; L258-L321 HydrophobicContact CD2-CB 3.55Å; L258-L321 HydrophobicContact CG-CB 3.92Å; L258-F325 HydrophobicContact CD1-CB 3.79Å; L258-F325 HydrophobicContact CD1-CD2 4.32Å; L258-F325 HydrophobicContact CD1-CG 3.96Å
259	K	93.6	Very high	91.2	Very high	132 Å²	132	66.8 Å²	66.8	57%	0.574	33%	0.334	S	S	*	.	H	α-helix	trans	-60.9	-37.1	174.7	-75.8	-165.9	167	-153	0	113.8	K255 Q256 R257 E262 I263	K255-K259 PolarHBondContact O-N 3.27Å; Q256-K259 PolarHBondContact O-N 3.19Å; R257-K259 PolarHBondContact O-N 3.25Å; K259-E262 WeakPolarHBondContact O-CB 3.23Å; K259-I263 WeakPolarHBondContact O-CG1 3.42Å; K259-I263 PolarHBondContact O-N 3.02Å
260	K	93.6	Very high	92	Very high	114 Å²	114	70.6 Å²	70.6	50%	0.496	34%	0.343	S	S	.	.	H	α-helix	trans	-67.6	-39.7	174.6	-73.8	-172.6	173.1	-168.6	0	111.8	L244 Q256 R257 L258 E262 I263 L264	L244-K260 HydrophobicContact CD2-CB 3.62Å; L244-K260 HydrophobicContact CD2-CD 3.82Å; L244-K260 HydrophobicContact CD2-CG 4.4Å; Q256-K260 PolarHBondContact O-N 2.91Å; R257-K260 PolarHBondContact O-N 3.28Å; L258-K260 VanDerWaalsContact C-N 3.34Å; L258-K260 PolarHBondContact O-N 2.88Å; K260-E262 VanDerWaalsContact C-N 3.34Å; K260-I263 PolarHBondContact O-N 3.37Å; K260-L264 WeakPolarHBondContact O-CG 3.35Å; K260-L264 PolarHBondContact O-N 3.15Å; K260-L264 VanDerWaalsContact O-N 3.08Å
261	L	94.8	Very high	92.6	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-69.7	-31.5	178.5	-175.3	61.1	0	0	0	112.5	L244 R257 L258 L264 D265 I314 K317 R318 L321	L244-L261 HydrophobicContact CD1-CB 3.8Å; L244-L261 HydrophobicContact CD1-CD1 3.93Å; L244-L261 HydrophobicContact CD1-CG 4.38Å; R257-L261 WeakPolarHBondContact O-CB 3.47Å; R257-L261 PolarHBondContact O-N 3.47Å; L258-L261 PolarHBondContact O-N 2.93Å; L261-L264 PolarHBondContact O-N 3.36Å; L261-D265 PolarHBondContact O-N 3.25Å; L261-I314 HydrophobicContact CD1-CG1 4.46Å; L261-I314 HydrophobicContact CD1-CG2 4.1Å; L261-K317 HydrophobicContact CD2-CB 3.9Å; L261-K317 HydrophobicContact CD2-CG 4.09Å; L261-R318 HydrophobicContact CD2-CB 3.83Å; L261-L321 HydrophobicContact CD2-CD1 4.04Å
262	E	94.9	Very high	93.2	Very high	106 Å²	106	65.3 Å²	65.3	50%	0.495	32%	0.315	S	S	.	.	H	α-helix	trans	-57.5	-52.7	170.1	-163	163.3	-135.9	0	0	110.5	L258 K259 K260 L264 D265 D266	L258-E262 PolarHBondContact O-N 3Å; K259-E262 WeakPolarHBondContact O-CB 3.23Å; K260-E262 VanDerWaalsContact C-N 3.34Å; E262-L264 VanDerWaalsContact C-N 3.27Å; E262-L264 PolarHBondContact O-N 2.92Å; E262-D265 WeakPolarHBondContact O-CB 3.39Å; E262-D265 PolarHBondContact O-N 3.37Å; E262-D266 PolarHBondContact O-N 2.86Å
263	I	94.3	Very high	93.6	Very high	95 Å²	95	65.5 Å²	65.5	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-29.9	175.9	-62.4	163.7	0	0	0	112.9	K259 K260 K267	K259-I263 WeakPolarHBondContact O-CG1 3.42Å; K259-I263 PolarHBondContact O-N 3.02Å; K260-I263 PolarHBondContact O-N 3.37Å; I263-K267 VanDerWaalsContact O-CG 3.32Å; I263-K267 WeakPolarHBondContact O-CG 3.39Å; I263-K267 PolarHBondContact O-N 2.9Å
264	L	94.5	Very high	93.9	Very high	11 Å²	11	65.3 Å²	65.3	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-75.9	-34.4	173.8	-70.2	-178.9	0	0	0	112.6	L237 Q240 L244 K260 L261 E262 S268	L237-L264 HydrophobicContact CD2-CD2 4.18Å; Q240-L264 HydrophobicContact CB-CD1 4.01Å; Q240-L264 HydrophobicContact CB-CD2 3.86Å; L244-L264 HydrophobicContact CD1-CD1 4.03Å; L244-L264 HydrophobicContact CD2-CD1 4.49Å; L244-L264 HydrophobicContact CG-CD1 4.25Å; K260-L264 WeakPolarHBondContact O-CG 3.35Å; K260-L264 PolarHBondContact O-N 3.15Å; K260-L264 VanDerWaalsContact O-N 3.08Å; L261-L264 PolarHBondContact O-N 3.36Å; E262-L264 VanDerWaalsContact C-N 3.27Å; E262-L264 PolarHBondContact O-N 2.92Å; L264-S268 WeakPolarHBondContact O-CB 3.43Å; L264-S268 PolarHBondContact O-N 3.48Å
265	D	94.9	Very high	94.3	Very high	23 Å²	23	65.3 Å²	65.3	12%	0.123	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-47.4	175.1	-174.8	35.1	0	0	0	110.8	L261 E262 K267 S268 Q269 I314 R318	L261-D265 PolarHBondContact O-N 3.25Å; E262-D265 WeakPolarHBondContact O-CB 3.39Å; E262-D265 PolarHBondContact O-N 3.37Å; D265-K267 VanDerWaalsContact C-N 3.33Å; D265-K267 PolarHBondContact O-N 2.99Å; D265-S268 CarbonylContact O-C 3.6Å; D265-S268 WeakPolarHBondContact O-CA 3.41Å; D265-S268 WeakPolarHBondContact O-CB 3.38Å; D265-S268 PolarHBondContact O-N 3.3Å; D265-S268 PolarHBondContact O-OG 3.28Å; D265-S268 PolarHBondContact OD1-OG 3.46Å; D265-Q269 WeakPolarHBondContact O-CG 3.35Å; D265-Q269 PolarHBondContact O-N 2.92Å; D265-Q269 PolarHBondContact OD1-NE2 3.19Å; D265-I314 HydrophobicContact CB-CG2 3.78Å; D265-R318 IonicContact OD2-CZ 2.66Å; D265-R318 IonicContact OD2-NH1 2.59Å; D265-R318 PolarHBondContact OD2-NH1 3.31Å; D265-R318 IonicContact OD2-NH2 3.1Å; D265-R318 PolarHBondContact OD2-NH2 2.99Å
266	D	95.2	Very high	94.6	Very high	100 Å²	100	67 Å²	67	54%	0.535	31%	0.31	S	S	.	.	H	α-helix	trans	-53.6	-49.1	176.8	-62.5	-30.1	0	0	0	111.5	E262 S268 Q269 E270	E262-D266 PolarHBondContact O-N 2.86Å; D266-S268 VanDerWaalsContact C-N 3.29Å; D266-S268 PolarHBondContact O-N 3.29Å; D266-Q269 PolarHBondContact O-N 3.47Å; D266-E270 PolarHBondContact O-N 3.3Å
267	K	95.1	Very high	94.9	Very high	102 Å²	102	66.5 Å²	66.5	44%	0.443	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-35.3	174.2	-72	176.3	179	-172.6	0	112.8	L237 I263 D265 L271	L237-K267 HydrophobicContact CD1-CB 4.36Å; L237-K267 HydrophobicContact CD2-CB 4.24Å; I263-K267 VanDerWaalsContact O-CG 3.32Å; I263-K267 WeakPolarHBondContact O-CG 3.39Å; I263-K267 PolarHBondContact O-N 2.9Å; D265-K267 VanDerWaalsContact C-N 3.33Å; D265-K267 PolarHBondContact O-N 2.99Å; K267-L271 PolarHBondContact O-N 3.02Å; K267-L271 VanDerWaalsContact O-N 3.1Å
268	S	96.2	Very high	95.2	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67	-38.6	175.9	84.4	0	0	0	0	111.5	L264 D265 D266 E270 L271 L272	L264-S268 WeakPolarHBondContact O-CB 3.43Å; L264-S268 PolarHBondContact O-N 3.48Å; D265-S268 CarbonylContact O-C 3.6Å; D265-S268 WeakPolarHBondContact O-CA 3.41Å; D265-S268 WeakPolarHBondContact O-CB 3.38Å; D265-S268 PolarHBondContact O-N 3.3Å; D265-S268 PolarHBondContact O-OG 3.28Å; D265-S268 PolarHBondContact OD1-OG 3.46Å; D266-S268 VanDerWaalsContact C-N 3.29Å; D266-S268 PolarHBondContact O-N 3.29Å; S268-E270 PolarHBondContact O-N 3.37Å; S268-L271 PolarHBondContact O-N 3.32Å; S268-L272 VanDerWaalsContact O-CB 3.27Å; S268-L272 WeakPolarHBondContact O-CB 3.47Å; S268-L272 WeakPolarHBondContact O-CD1 3.25Å; S268-L272 WeakPolarHBondContact O-CG 3.29Å; S268-L272 PolarHBondContact O-N 3.05Å
269	Q	96.1	Very high	95.4	Very high	79 Å²	79	63.7 Å²	63.7	37%	0.369	30%	0.299	S	S	.	.	H	α-helix	trans	-66.2	-36.8	178.2	-56.9	-49	-39.8	0	0	112.1	D265 D266 T273	D265-Q269 WeakPolarHBondContact O-CG 3.35Å; D265-Q269 PolarHBondContact O-N 2.92Å; D265-Q269 PolarHBondContact OD1-NE2 3.19Å; D266-Q269 PolarHBondContact O-N 3.47Å; Q269-T273 WeakPolarHBondContact O-CB 3.42Å; Q269-T273 PolarHBondContact O-N 2.81Å; Q269-T273 VanDerWaalsContact O-N 3.1Å; Q269-T273 PolarHBondContact O-OG1 2.98Å
270	E	94.4	Very high	95.5	Very high	112 Å²	112	63.2 Å²	63.2	52%	0.523	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-50	171.2	-166.2	-159.4	138.5	0	0	111.2	D266 S268 T273 K274	D266-E270 PolarHBondContact O-N 3.3Å; S268-E270 PolarHBondContact O-N 3.37Å; E270-T273 WeakPolarHBondContact O-CB 3.39Å; E270-T273 PolarHBondContact O-N 3.14Å; E270-T273 VanDerWaalsContact O-N 3.16Å; E270-K274 PolarHBondContact O-N 3.33Å; E270-K274 VanDerWaalsContact O-N 3.07Å; E270-K274 WeakPolarHBondContact OE1-CE 3.37Å; E270-K274 IonicContact OE1-NZ 2.63Å; E270-K274 PolarHBondContact OE1-NZ 2.78Å
271	L	94.8	Very high	95.6	Very high	5 Å²	5	62.4 Å²	62.4	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-41.1	179.6	177.6	59.4	0	0	0	112.9	Q233 V234 L237 K267 S268 T273 K274 A275 L310	Q233-L271 VanDerWaalsContact C-CD2 3.49Å; Q233-L271 HydrophobicContact CB-CD1 3.62Å; Q233-L271 HydrophobicContact CB-CD2 3.7Å; Q233-L271 HydrophobicContact CB-CG 4.32Å; V234-L271 HydrophobicContact CB-CD2 4.29Å; V234-L271 HydrophobicContact CG2-CD2 3.6Å; V234-L271 HydrophobicContact CG2-CG 4.13Å; L237-L271 HydrophobicContact CD1-CB 4.4Å; L237-L271 HydrophobicContact CD1-CD2 3.72Å; L237-L271 HydrophobicContact CG-CD2 4.37Å; K267-L271 PolarHBondContact O-N 3.02Å; K267-L271 VanDerWaalsContact O-N 3.1Å; S268-L271 PolarHBondContact O-N 3.32Å; L271-T273 PolarHBondContact O-N 3.07Å; L271-K274 WeakPolarHBondContact O-CB 3.39Å; L271-K274 PolarHBondContact O-N 3.16Å; L271-K274 VanDerWaalsContact O-N 3.14Å; L271-A275 WeakPolarHBondContact O-CB 3.34Å; L271-A275 PolarHBondContact O-N 3.25Å; L271-L310 HydrophobicContact CD2-CD2 4.28Å
272	L	96.2	Very high	95.7	Very high	7 Å²	7	62.4 Å²	62.4	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-31.8	175.2	-70.8	163.5	0	0	0	111.2	S268 R276 S307 V311	S268-L272 VanDerWaalsContact O-CB 3.27Å; S268-L272 WeakPolarHBondContact O-CB 3.47Å; S268-L272 WeakPolarHBondContact O-CD1 3.25Å; S268-L272 WeakPolarHBondContact O-CG 3.29Å; S268-L272 PolarHBondContact O-N 3.05Å; L272-R276 WeakPolarHBondContact O-CB 3.47Å; L272-R276 WeakPolarHBondContact O-CD 3.47Å; L272-R276 WeakPolarHBondContact O-CG 3.47Å; L272-R276 PolarHBondContact O-N 3.46Å; L272-S307 VanDerWaalsContact CD2-CB 3.44Å; L272-V311 HydrophobicContact CD1-CG2 3.41Å; L272-V311 VanDerWaalsContact CD1-CG2 3.41Å; L272-V311 HydrophobicContact CD2-CG2 4.02Å; L272-V311 HydrophobicContact CG-CG2 4.39Å
273	T	95.8	Very high	95.6	Very high	72 Å²	72	60.9 Å²	60.9	44%	0.442	29%	0.289	S	S	.	.	H	α-helix	trans	-69.1	-44.3	173	-57	0	0	0	0	111.2	Q269 E270 L271 R276 I277	Q269-T273 WeakPolarHBondContact O-CB 3.42Å; Q269-T273 PolarHBondContact O-N 2.81Å; Q269-T273 VanDerWaalsContact O-N 3.1Å; Q269-T273 PolarHBondContact O-OG1 2.98Å; E270-T273 WeakPolarHBondContact O-CB 3.39Å; E270-T273 PolarHBondContact O-N 3.14Å; E270-T273 VanDerWaalsContact O-N 3.16Å; L271-T273 PolarHBondContact O-N 3.07Å; T273-R276 PolarHBondContact O-N 3.25Å; T273-I277 WeakPolarHBondContact O-CG1 3.48Å; T273-I277 PolarHBondContact O-N 3.4Å
274	K	95	Very high	95.7	Very high	82 Å²	82	63.1 Å²	63.1	36%	0.357	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-49.1	172.3	-63.5	175.3	-170.6	170.8	0	111.5	E270 L271 R276 I277 V278	E270-K274 PolarHBondContact O-N 3.33Å; E270-K274 VanDerWaalsContact O-N 3.07Å; E270-K274 WeakPolarHBondContact OE1-CE 3.37Å; E270-K274 IonicContact OE1-NZ 2.63Å; E270-K274 PolarHBondContact OE1-NZ 2.78Å; L271-K274 WeakPolarHBondContact O-CB 3.39Å; L271-K274 PolarHBondContact O-N 3.16Å; L271-K274 VanDerWaalsContact O-N 3.14Å; K274-R276 VanDerWaalsContact C-N 3.31Å; K274-R276 PolarHBondContact O-N 2.8Å; K274-I277 WeakPolarHBondContact O-CA 3.38Å; K274-I277 WeakPolarHBondContact O-CB 3.49Å; K274-I277 PolarHBondContact O-N 2.95Å; K274-V278 WeakPolarHBondContact O-CG2 3.44Å; K274-V278 PolarHBondContact O-N 3.1Å
275	A	96.5	Very high	95.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.8	-39.8	178.5	0	0	0	0	0	112.7	L271 I277 V278 I279 L303	L271-A275 WeakPolarHBondContact O-CB 3.34Å; L271-A275 PolarHBondContact O-N 3.25Å; A275-I277 VanDerWaalsContact C-N 3.34Å; A275-I277 PolarHBondContact O-N 3.42Å; A275-V278 PolarHBondContact O-N 3.1Å; A275-I279 WeakPolarHBondContact O-CB 3.43Å; A275-I279 WeakPolarHBondContact O-CD1 3.36Å; A275-I279 VanDerWaalsContact O-CG1 3.25Å; A275-I279 WeakPolarHBondContact O-CG1 3.47Å; A275-I279 PolarHBondContact O-N 3Å; A275-L303 HydrophobicContact CB-CD1 4.13Å; A275-L303 HydrophobicContact CB-CD2 4.1Å; A275-L303 HydrophobicContact CB-CG 4.04Å
276	R	96.8	Very high	95.3	Very high	157 Å²	157	63 Å²	63	59%	0.592	30%	0.297	S	S	*	.	H	α-helix	trans	-61.8	-38.3	172.9	-74.4	164.5	-175.5	169.3	3.2	112.7	L272 T273 K274 I279 L280	L272-R276 WeakPolarHBondContact O-CB 3.47Å; L272-R276 WeakPolarHBondContact O-CD 3.47Å; L272-R276 WeakPolarHBondContact O-CG 3.47Å; L272-R276 PolarHBondContact O-N 3.46Å; T273-R276 PolarHBondContact O-N 3.25Å; K274-R276 VanDerWaalsContact C-N 3.31Å; K274-R276 PolarHBondContact O-N 2.8Å; R276-I279 PolarHBondContact O-N 3.01Å; R276-L280 WeakPolarHBondContact O-CB 3.5Å; R276-L280 PolarHBondContact O-N 2.92Å
277	I	96.8	Very high	95.2	Very high	110 Å²	110	61.7 Å²	61.7	56%	0.564	30%	0.296	S	S	*	.	H	α-helix	trans	-65.2	-44.1	175.7	-65.1	164	0	0	0	110.6	T273 K274 A275 L280 R281	T273-I277 WeakPolarHBondContact O-CG1 3.48Å; T273-I277 PolarHBondContact O-N 3.4Å; K274-I277 WeakPolarHBondContact O-CA 3.38Å; K274-I277 WeakPolarHBondContact O-CB 3.49Å; K274-I277 PolarHBondContact O-N 2.95Å; A275-I277 VanDerWaalsContact C-N 3.34Å; A275-I277 PolarHBondContact O-N 3.42Å; I277-L280 PolarHBondContact O-N 3.08Å; I277-R281 WeakPolarHBondContact O-CB 3.32Å; I277-R281 PolarHBondContact O-N 3.26Å
278	V	96.7	Very high	95	Very high	12 Å²	12	61.5 Å²	61.5	7%	0.073	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-44.5	175.8	-175.7	0	0	0	0	111.3	F223 D226 F227 K274 A275 L280 R281 G282 L303	F223-V278 HydrophobicContact CD2-CG1 4.14Å; F223-V278 HydrophobicContact CE2-CG1 4Å; D226-V278 HydrophobicContact CB-CB 4.42Å; D226-V278 HydrophobicContact CB-CG1 3.79Å; D226-V278 HydrophobicContact CB-CG2 3.75Å; F227-V278 HydrophobicContact CB-CG1 4.34Å; K274-V278 WeakPolarHBondContact O-CG2 3.44Å; K274-V278 PolarHBondContact O-N 3.1Å; A275-V278 PolarHBondContact O-N 3.1Å; V278-L280 PolarHBondContact O-N 3.04Å; V278-R281 WeakPolarHBondContact O-CB 3.11Å; V278-R281 PolarHBondContact O-N 3.04Å; V278-G282 PolarHBondContact O-N 3.36Å; V278-L303 HydrophobicContact CB-CD2 4.02Å; V278-L303 HydrophobicContact CG1-CD2 4.08Å
279	I	96.9	Very high	94.5	Very high	17 Å²	17	69.5 Å²	69.5	9%	0.087	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-45.1	175.8	-69.7	164.5	0	0	0	110.8	A275 R276 G282 H283 C300 L303 R304	A275-I279 WeakPolarHBondContact O-CB 3.43Å; A275-I279 WeakPolarHBondContact O-CD1 3.36Å; A275-I279 VanDerWaalsContact O-CG1 3.25Å; A275-I279 WeakPolarHBondContact O-CG1 3.47Å; A275-I279 PolarHBondContact O-N 3Å; R276-I279 PolarHBondContact O-N 3.01Å; I279-G282 PolarHBondContact O-N 3.04Å; I279-H283 WeakPolarHBondContact CG2-NE2 3.18Å; I279-H283 PolarHBondContact O-CD2 3.4Å; I279-H283 PolarHBondContact O-N 3.17Å; I279-C300 HydrophobicContact CG2-CB 4.35Å; I279-L303 HydrophobicContact CD1-CB 4.35Å; I279-L303 HydrophobicContact CD1-CG 4.22Å; I279-L303 HydrophobicContact CG1-CB 4.35Å; I279-L303 HydrophobicContact CG1-CD2 4.2Å; I279-L303 HydrophobicContact CG1-CG 4.34Å; I279-R304 HydrophobicContact CD1-CB 4.06Å
280	L	96.7	Very high	94.2	Very high	123 Å²	123	65.9 Å²	65.9	64%	0.644	32%	0.32	S	S	*	.	H	α-helix	trans	-64.4	-39.7	177.2	-176.9	63.2	0	0	0	112.4	R276 I277 V278 G282 H283 K284	R276-L280 WeakPolarHBondContact O-CB 3.5Å; R276-L280 PolarHBondContact O-N 2.92Å; I277-L280 PolarHBondContact O-N 3.08Å; V278-L280 PolarHBondContact O-N 3.04Å; L280-G282 VanDerWaalsContact C-N 3.35Å; L280-H283 PolarHBondContact O-N 3Å; L280-K284 PolarHBondContact O-N 3.13Å
281	R	96.3	Very high	93.7	Very high	97 Å²	97	66.5 Å²	66.5	37%	0.366	32%	0.318	S	S	.	.	H	α-helix	trans	-58.6	-46.6	173	-171.9	-179.2	-172.6	169	5.1	110.7	D226 I277 V278 K284 L285	D226-R281 IonicContact OD1-NH1 3.9Å; D226-R281 PolarHBondContact OD1-NH1 3.32Å; D226-R281 WeakPolarHBondContact OD2-CD 3.41Å; D226-R281 IonicContact OD2-CZ 3.72Å; D226-R281 IonicContact OD2-NE 3.47Å; D226-R281 IonicContact OD2-NH1 2.76Å; D226-R281 PolarHBondContact OD2-NH1 2.78Å; I277-R281 WeakPolarHBondContact O-CB 3.32Å; I277-R281 PolarHBondContact O-N 3.26Å; V278-R281 WeakPolarHBondContact O-CB 3.11Å; V278-R281 PolarHBondContact O-N 3.04Å; R281-K284 PolarHBondContact O-N 3.2Å; R281-L285 WeakPolarHBondContact O-CG 3.44Å; R281-L285 PolarHBondContact O-N 3.17Å
282	G	95.1	Very high	93	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-44.4	176.3	0	0	0	0	0	113.5	V278 I279 L280 K284 L285 A286 I296	V278-G282 PolarHBondContact O-N 3.36Å; I279-G282 PolarHBondContact O-N 3.04Å; L280-G282 VanDerWaalsContact C-N 3.35Å; G282-K284 VanDerWaalsContact C-N 3.3Å; G282-K284 PolarHBondContact O-N 3.48Å; G282-L285 PolarHBondContact O-N 3.01Å; G282-L285 VanDerWaalsContact O-N 3.15Å; G282-A286 PolarHBondContact O-N 2.92Å; G282-I296 VanDerWaalsContact O-CG2 3.29Å; G282-I296 WeakPolarHBondContact O-CG2 3.47Å
283	H	93.6	Very high	92.1	Very high	74 Å²	74	70 Å²	70	34%	0.343	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-35.9	174.5	-70.4	-56.6	0	0	0	112.9	I279 L280 A286 S287 R304	I279-H283 WeakPolarHBondContact CG2-NE2 3.18Å; I279-H283 PolarHBondContact O-CD2 3.4Å; I279-H283 PolarHBondContact O-N 3.17Å; L280-H283 PolarHBondContact O-N 3Å; H283-A286 WeakPolarHBondContact O-CB 3.43Å; H283-A286 PolarHBondContact O-N 3.16Å; H283-S287 PolarHBondContact O-N 3.34Å; H283-S287 PolarHBondContact O-OG 3.29Å; H283-R304 PolarHBondContact NE2-NH2 3.21Å
284	K	96.1	Very high	91	Very high	142 Å²	142	73.2 Å²	73.2	62%	0.617	35%	0.353	S	S	*	.	H	α-helix	trans	-68	-34.5	174.2	-175.2	173.8	178.7	177.3	0	112.7	L280 R281 G282 S287 N288	L280-K284 PolarHBondContact O-N 3.13Å; R281-K284 PolarHBondContact O-N 3.2Å; G282-K284 VanDerWaalsContact C-N 3.3Å; G282-K284 PolarHBondContact O-N 3.48Å; K284-S287 PolarHBondContact O-OG 2.93Å; K284-N288 WeakPolarHBondContact O-CB 3.08Å; K284-N288 PolarHBondContact O-N 3Å; K284-N288 PolarHBondContact O-OD1 3.19Å
285	L	93.6	Very high	90	Very high	14 Å²	14	72 Å²	72	7%	0.073	35%	0.35	C	S	.	.	H	α-helix	trans	-67.4	-43.6	170.6	-64.3	176.8	0	0	0	110.6	Q219 F223 R281 G282 S287 N288 H290 I296	Q219-L285 HydrophobicContact CB-CD1 4.39Å; Q219-L285 HydrophobicContact CB-CD2 3.87Å; Q219-L285 HydrophobicContact CG-CD2 4.12Å; Q219-L285 VanDerWaalsContact OE1-CD2 3.31Å; F223-L285 HydrophobicContact CB-CD1 4.09Å; F223-L285 HydrophobicContact CG-CD1 4.37Å; R281-L285 WeakPolarHBondContact O-CG 3.44Å; R281-L285 PolarHBondContact O-N 3.17Å; G282-L285 PolarHBondContact O-N 3.01Å; G282-L285 VanDerWaalsContact O-N 3.15Å; L285-S287 PolarHBondContact O-N 2.93Å; L285-N288 CarbonylContact O-C 3.54Å; L285-N288 PolarHBondContact O-N 3.33Å; L285-N288 VanDerWaalsContact O-N 3.13Å; L285-H290 HydrophobicContact CB-CB 4.27Å; L285-H290 WeakPolarHBondContact O-CB 3.27Å; L285-H290 PolarHBondContact O-N 2.95Å; L285-I296 HydrophobicContact CB-CD1 3.92Å; L285-I296 HydrophobicContact CD1-CD1 4.06Å
286	A	88.2	Confident	89.4	Confident	18 Å²	18	72 Å²	72	15%	0.149	35%	0.35	C	S	.	.	H	α-helix	trans	-58.5	-47.9	177.2	0	0	0	0	0	112.6	G282 H283 N288 H289 L293	G282-A286 PolarHBondContact O-N 2.92Å; H283-A286 WeakPolarHBondContact O-CB 3.43Å; H283-A286 PolarHBondContact O-N 3.16Å; A286-N288 PolarHBondContact O-N 3.43Å; A286-H289 PolarHBondContact O-N 3.03Å; A286-H289 VanDerWaalsContact O-N 3.1Å; A286-L293 HydrophobicContact CB-CD1 3.51Å
287	S	92.4	Very high	88.8	Confident	73 Å²	73	66.5 Å²	66.5	51%	0.51	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-28.2	176	61	0	0	0	0	113.2	H283 K284 L285 H289	H283-S287 PolarHBondContact O-N 3.34Å; H283-S287 PolarHBondContact O-OG 3.29Å; K284-S287 PolarHBondContact O-OG 2.93Å; L285-S287 PolarHBondContact O-N 2.93Å; S287-H289 PolarHBondContact O-CE1 3.36Å; S287-H289 PolarHBondContact O-N 3.41Å; S287-H289 PolarHBondContact O-ND1 2.96Å
288	N	90.4	Very high	88.2	Confident	97 Å²	97	66.7 Å²	66.7	52%	0.519	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	16.8	177.1	-68.9	8.1	0	0	0	113.1	K284 L285 A286 H290	K284-N288 WeakPolarHBondContact O-CB 3.08Å; K284-N288 PolarHBondContact O-N 3Å; K284-N288 PolarHBondContact O-OD1 3.19Å; L285-N288 CarbonylContact O-C 3.54Å; L285-N288 PolarHBondContact O-N 3.33Å; L285-N288 VanDerWaalsContact O-N 3.13Å; A286-N288 PolarHBondContact O-N 3.43Å; N288-H290 VanDerWaalsContact C-N 3.27Å; N288-H290 PolarHBondContact O-N 3.08Å
289	H	86.9	Confident	87.8	Confident	168 Å²	168	68.8 Å²	68.8	78%	0.778	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	38.7	174.8	-60.8	66.3	0	0	0	113.1	A286 S287	A286-H289 PolarHBondContact O-N 3.03Å; A286-H289 VanDerWaalsContact O-N 3.1Å; S287-H289 PolarHBondContact O-CE1 3.36Å; S287-H289 PolarHBondContact O-N 3.41Å; S287-H289 PolarHBondContact O-ND1 2.96Å
290	H	89.8	Confident	87.7	Confident	4 Å²	4	68 Å²	68	2%	0.019	34%	0.336	C	S	.	.			trans	-61.5	137.8	-178.2	-168	-79.9	0	0	0	112.7	Q216 L285 N288 A292 L293 I296	Q216-H290 WeakPolarHBondContact CA-NE2 3.23Å; Q216-H290 VanDerWaalsContact CB-NE2 3.34Å; Q216-H290 WeakPolarHBondContact CB-NE2 3.34Å; Q216-H290 PolarHBondContact O-CE1 3.38Å; Q216-H290 PolarHBondContact O-NE2 2.94Å; L285-H290 HydrophobicContact CB-CB 4.27Å; L285-H290 WeakPolarHBondContact O-CB 3.27Å; L285-H290 PolarHBondContact O-N 2.95Å; N288-H290 VanDerWaalsContact C-N 3.27Å; N288-H290 PolarHBondContact O-N 3.08Å; H290-A292 PolarHBondContact ND1-N 3.43Å; H290-A292 PolarHBondContact O-N 3.07Å; H290-L293 PolarHBondContact O-N 2.93Å; H290-I296 HydrophobicContact CB-CD1 4.21Å; H290-I296 WeakPolarHBondContact ND1-CD1 3.36Å
291	Y	82.6	Confident	87.3	Confident	125 Å²	125	66.3 Å²	66.3	49%	0.49	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.9	-173.1	79.2	-98.4	0	0	0	115.3	Q216 L220	Q216-Y291 HydrophobicContact CB-CD1 3.7Å; Q216-Y291 HydrophobicContact CB-CE1 3.83Å; L220-Y291 HydrophobicContact CD2-CE2 4.39Å; L220-Y291 WeakPolarHBondContact CD2-OH 3.39Å
292	A	80.9	Confident	87.2	Confident	13 Å²	13	65 Å²	65	11%	0.107	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	27.7	-178.2	0	0	0	0	0	113.4	L220 H290 D294 L295 I296	L220-A292 HydrophobicContact CD1-CB 4.01Å; L220-A292 HydrophobicContact CD2-CB 3.76Å; L220-A292 HydrophobicContact CG-CB 4.46Å; H290-A292 PolarHBondContact ND1-N 3.43Å; H290-A292 PolarHBondContact O-N 3.07Å; A292-D294 PolarHBondContact O-N 3.43Å; A292-L295 PolarHBondContact O-N 3.02Å; A292-L295 VanDerWaalsContact O-N 3.13Å; A292-I296 HydrophobicContact CB-CD1 4.38Å; A292-I296 PolarHBondContact O-N 3.38Å; A292-I296 VanDerWaalsContact O-N 3.08Å
293	L	78.3	Confident	87.1	Confident	73 Å²	73	65 Å²	65	38%	0.382	33%	0.326	S	S	.	.	H	α-helix	trans	-40.8	-56.4	-176.4	-179.5	64.1	0	0	0	113.8	A286 H290 L295 I296 C297	A286-L293 HydrophobicContact CB-CD1 3.51Å; H290-L293 PolarHBondContact O-N 2.93Å; L293-L295 VanDerWaalsContact C-N 3.32Å; L293-L295 PolarHBondContact O-N 3.45Å; L293-I296 PolarHBondContact O-N 3.32Å; L293-C297 WeakPolarHBondContact O-CB 3.25Å; L293-C297 PolarHBondContact O-N 3.32Å; L293-C297 PolarHBondContact O-SG 2.79Å; L293-C297 VanDerWaalsContact O-SG 3.36Å
294	D	70.9	Confident	87.2	Confident	138 Å²	138	65.9 Å²	65.9	74%	0.738	33%	0.326	S	S	*	.	H	α-helix	trans	-58.4	-43	-175.2	-52.5	-43.8	0	0	0	112.4	A292 Q298	A292-D294 PolarHBondContact O-N 3.43Å; D294-Q298 WeakPolarHBondContact O-CB 3.47Å; D294-Q298 PolarHBondContact O-N 3.11Å
295	L	73.8	Confident	87.1	Confident	58 Å²	58	66.6 Å²	66.6	30%	0.304	33%	0.326	S	S	.	.	H	α-helix	trans	-68.1	-44.9	-179.9	176.7	60.8	0	0	0	111.1	L220 A292 L293 Q298 R299	L220-L295 HydrophobicContact CD1-CD2 4.37Å; A292-L295 PolarHBondContact O-N 3.02Å; A292-L295 VanDerWaalsContact O-N 3.13Å; L293-L295 VanDerWaalsContact C-N 3.32Å; L293-L295 PolarHBondContact O-N 3.45Å; L295-Q298 WeakPolarHBondContact O-CB 3.17Å; L295-Q298 PolarHBondContact O-N 3.28Å; L295-R299 HydrophobicContact CD1-CG 4.32Å; L295-R299 WeakPolarHBondContact O-CG 3.25Å; L295-R299 PolarHBondContact O-N 2.9Å
296	I	84.4	Confident	87	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.6	-47.4	178.1	-65.9	171.7	0	0	0	109.9	L220 F223 G282 L285 H290 A292 L293 Q298 R299 C300	L220-I296 HydrophobicContact CD1-CD1 4.08Å; L220-I296 HydrophobicContact CD1-CG1 3.75Å; F223-I296 HydrophobicContact CD1-CG1 4.18Å; F223-I296 HydrophobicContact CE1-CB 4.2Å; F223-I296 HydrophobicContact CE1-CG1 4.06Å; F223-I296 HydrophobicContact CE1-CG2 4.02Å; F223-I296 HydrophobicContact CE2-CG2 4.31Å; F223-I296 HydrophobicContact CZ-CB 4.48Å; F223-I296 HydrophobicContact CZ-CG2 3.87Å; G282-I296 VanDerWaalsContact O-CG2 3.29Å; G282-I296 WeakPolarHBondContact O-CG2 3.47Å; L285-I296 HydrophobicContact CB-CD1 3.92Å; L285-I296 HydrophobicContact CD1-CD1 4.06Å; H290-I296 HydrophobicContact CB-CD1 4.21Å; H290-I296 WeakPolarHBondContact ND1-CD1 3.36Å; A292-I296 HydrophobicContact CB-CD1 4.38Å; A292-I296 PolarHBondContact O-N 3.38Å; A292-I296 VanDerWaalsContact O-N 3.08Å; L293-I296 PolarHBondContact O-N 3.32Å; I296-Q298 VanDerWaalsContact C-N 3.35Å; I296-Q298 PolarHBondContact O-N 2.85Å; I296-R299 PolarHBondContact O-N 3.37Å; I296-C300 PolarHBondContact O-N 3.28Å; I296-C300 PolarHBondContact O-SG 2.87Å
297	C	84.4	Confident	87.4	Confident	40 Å²	40	67.1 Å²	67.1	27%	0.27	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-40.7	175.6	-70.8	0	0	0	0	112.5	L293 C300 N301	L293-C297 WeakPolarHBondContact O-CB 3.25Å; L293-C297 PolarHBondContact O-N 3.32Å; L293-C297 PolarHBondContact O-SG 2.79Å; L293-C297 VanDerWaalsContact O-SG 3.36Å; C297-C300 PolarHBondContact O-N 3.25Å; C297-N301 VanDerWaalsContact O-CG 3.22Å; C297-N301 PolarHBondContact O-N 3.07Å; C297-N301 VanDerWaalsContact O-N 3.1Å; C297-N301 PolarHBondContact O-ND2 3Å
298	Q	85.3	Confident	87.5	Confident	115 Å²	115	68.2 Å²	68.2	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-59.2	-51.5	173.7	179.6	-178.6	-20	0	0	111.2	D294 L295 I296 C300 N301 E302	D294-Q298 WeakPolarHBondContact O-CB 3.47Å; D294-Q298 PolarHBondContact O-N 3.11Å; L295-Q298 WeakPolarHBondContact O-CB 3.17Å; L295-Q298 PolarHBondContact O-N 3.28Å; I296-Q298 VanDerWaalsContact C-N 3.35Å; I296-Q298 PolarHBondContact O-N 2.85Å; Q298-C300 PolarHBondContact O-N 3.45Å; Q298-N301 PolarHBondContact O-N 3.28Å; Q298-N301 VanDerWaalsContact O-N 3.11Å; Q298-E302 WeakPolarHBondContact O-CB 3.45Å; Q298-E302 PolarHBondContact O-N 2.68Å
299	R	87.9	Confident	87.7	Confident	56 Å²	56	66.1 Å²	66.1	21%	0.211	32%	0.315	C	S	.	.	H	α-helix	trans	-62.2	-40	179.6	-65.6	-38.6	-165.6	165.4	9.3	112.7	F223 E224 F227 L295 I296 N301 E302 L303	F223-R299 HydrophobicContact CE1-CB 3.75Å; F223-R299 HydrophobicContact CE1-CG 4.12Å; F223-R299 HydrophobicContact CZ-CB 3.8Å; E224-R299 IonicContact OE1-NE 2.75Å; E224-R299 IonicContact OE1-NH2 2.74Å; F227-R299 HydrophobicContact CD1-CG 4.39Å; F227-R299 HydrophobicContact CD2-CB 3.75Å; F227-R299 HydrophobicContact CD2-CG 4.33Å; F227-R299 HydrophobicContact CE1-CG 4.4Å; F227-R299 HydrophobicContact CE2-CB 3.85Å; F227-R299 HydrophobicContact CE2-CG 4.32Å; F227-R299 WeakPolarHBondContact CE2-O 3.24Å; F227-R299 HydrophobicContact CG-CB 4.19Å; F227-R299 HydrophobicContact CG-CG 4.37Å; F227-R299 HydrophobicContact CZ-CB 4.38Å; F227-R299 HydrophobicContact CZ-CG 4.37Å; L295-R299 HydrophobicContact CD1-CG 4.32Å; L295-R299 WeakPolarHBondContact O-CG 3.25Å; L295-R299 PolarHBondContact O-N 2.9Å; I296-R299 PolarHBondContact O-N 3.37Å; R299-N301 VanDerWaalsContact C-N 3.27Å; R299-N301 PolarHBondContact O-N 3.35Å; R299-E302 VanDerWaalsContact CD-OE2 3.23Å; R299-E302 WeakPolarHBondContact CD-OE2 3.5Å; R299-E302 IonicContact CZ-OE2 3.74Å; R299-E302 IonicContact NE-OE2 3.48Å; R299-E302 IonicContact NH1-OE1 2.65Å; R299-E302 PolarHBondContact NH1-OE1 3.47Å; R299-E302 IonicContact NH1-OE2 2.76Å; R299-E302 PolarHBondContact NH1-OE2 3.45Å; R299-E302 PolarHBondContact O-N 2.88Å; R299-L303 WeakPolarHBondContact O-CB 3.48Å; R299-L303 PolarHBondContact O-N 3.36Å
300	C	93.3	Very high	88.1	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-62.2	-33.8	174.3	-69.9	0	0	0	0	113	I279 I296 C297 Q298 R304	I279-C300 HydrophobicContact CG2-CB 4.35Å; I296-C300 PolarHBondContact O-N 3.28Å; I296-C300 PolarHBondContact O-SG 2.87Å; C297-C300 PolarHBondContact O-N 3.25Å; Q298-C300 PolarHBondContact O-N 3.45Å; C300-R304 WeakPolarHBondContact O-CB 3.46Å; C300-R304 PolarHBondContact O-N 3.22Å
301	N	90.1	Very high	88.4	Confident	86 Å²	86	60.8 Å²	60.8	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-77.9	-39.8	177.2	-68.6	-21.6	0	0	0	112	C297 Q298 R299 R304 Y305	C297-N301 VanDerWaalsContact O-CG 3.22Å; C297-N301 PolarHBondContact O-N 3.07Å; C297-N301 VanDerWaalsContact O-N 3.1Å; C297-N301 PolarHBondContact O-ND2 3Å; Q298-N301 PolarHBondContact O-N 3.28Å; Q298-N301 VanDerWaalsContact O-N 3.11Å; R299-N301 VanDerWaalsContact C-N 3.27Å; R299-N301 PolarHBondContact O-N 3.35Å; N301-R304 PolarHBondContact O-N 3.34Å; N301-R304 PolarHBondContact OD1-NH1 2.69Å; N301-Y305 WeakPolarHBondContact O-CB 3.3Å; N301-Y305 PolarHBondContact O-N 2.91Å
302	E	92.5	Very high	88.9	Confident	70 Å²	70	58 Å²	58	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-60.3	-50.2	174.8	-175.1	173	-163.9	0	0	111.7	F227 Q298 R299 R304 Y305 L306	F227-E302 HydrophobicContact CE2-CB 4.28Å; F227-E302 HydrophobicContact CE2-CG 4.29Å; F227-E302 HydrophobicContact CZ-CB 4.47Å; F227-E302 HydrophobicContact CZ-CG 4.07Å; F227-E302 WeakPolarHBondContact CZ-OE2 3.12Å; Q298-E302 WeakPolarHBondContact O-CB 3.45Å; Q298-E302 PolarHBondContact O-N 2.68Å; R299-E302 VanDerWaalsContact CD-OE2 3.23Å; R299-E302 WeakPolarHBondContact CD-OE2 3.5Å; R299-E302 IonicContact CZ-OE2 3.74Å; R299-E302 IonicContact NE-OE2 3.48Å; R299-E302 IonicContact NH1-OE1 2.65Å; R299-E302 PolarHBondContact NH1-OE1 3.47Å; R299-E302 IonicContact NH1-OE2 2.76Å; R299-E302 PolarHBondContact NH1-OE2 3.45Å; R299-E302 PolarHBondContact O-N 2.88Å; E302-R304 VanDerWaalsContact C-N 3.32Å; E302-R304 PolarHBondContact O-N 2.93Å; E302-Y305 PolarHBondContact O-N 3.16Å; E302-L306 HydrophobicContact CG-CD1 4.4Å; E302-L306 WeakPolarHBondContact O-CG 3.24Å; E302-L306 PolarHBondContact O-N 2.95Å
303	L	94.4	Very high	89.5	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-32.2	178.3	-175.2	55.7	0	0	0	112.7	F227 A230 V231 A275 V278 I279 R299 S307	F227-L303 HydrophobicContact CD2-CB 3.99Å; F227-L303 HydrophobicContact CD2-CD2 4.24Å; F227-L303 HydrophobicContact CE2-CB 3.93Å; A230-L303 HydrophobicContact CB-CD1 3.91Å; A230-L303 HydrophobicContact CB-CD2 4Å; V231-L303 HydrophobicContact CG2-CD1 4.19Å; A275-L303 HydrophobicContact CB-CD1 4.13Å; A275-L303 HydrophobicContact CB-CD2 4.1Å; A275-L303 HydrophobicContact CB-CG 4.04Å; V278-L303 HydrophobicContact CB-CD2 4.02Å; V278-L303 HydrophobicContact CG1-CD2 4.08Å; I279-L303 HydrophobicContact CD1-CB 4.35Å; I279-L303 HydrophobicContact CD1-CG 4.22Å; I279-L303 HydrophobicContact CG1-CB 4.35Å; I279-L303 HydrophobicContact CG1-CD2 4.2Å; I279-L303 HydrophobicContact CG1-CG 4.34Å; R299-L303 WeakPolarHBondContact O-CB 3.48Å; R299-L303 PolarHBondContact O-N 3.36Å; L303-S307 WeakPolarHBondContact O-CB 3.27Å; L303-S307 PolarHBondContact O-N 3.26Å; L303-S307 PolarHBondContact O-OG 3.43Å
304	R	95.6	Very high	90.2	Very high	92 Å²	92	57.4 Å²	57.4	35%	0.347	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-49.3	172.5	-167.7	-171.9	-62	103.7	-8.5	111	I279 H283 C300 N301 E302 L306 S307 D308	I279-R304 HydrophobicContact CD1-CB 4.06Å; H283-R304 PolarHBondContact NE2-NH2 3.21Å; C300-R304 WeakPolarHBondContact O-CB 3.46Å; C300-R304 PolarHBondContact O-N 3.22Å; N301-R304 PolarHBondContact O-N 3.34Å; N301-R304 PolarHBondContact OD1-NH1 2.69Å; E302-R304 VanDerWaalsContact C-N 3.32Å; E302-R304 PolarHBondContact O-N 2.93Å; R304-L306 VanDerWaalsContact C-N 3.34Å; R304-L306 PolarHBondContact O-N 2.94Å; R304-S307 WeakPolarHBondContact O-CA 3.33Å; R304-S307 VanDerWaalsContact O-CB 3.25Å; R304-S307 WeakPolarHBondContact O-CB 3.49Å; R304-S307 PolarHBondContact O-N 3.17Å; R304-S307 VanDerWaalsContact O-N 3.08Å; R304-D308 VanDerWaalsContact O-CG 3.29Å; R304-D308 PolarHBondContact O-N 3.16Å
305	Y	93.4	Very high	91.3	Very high	157 Å²	157	57.2 Å²	57.2	62%	0.616	27%	0.271	S	S	*	.	H	α-helix	trans	-59.4	-42.2	178.6	175.7	-110.7	0	0	0	112.7	N301 E302 S307 D308 I309	N301-Y305 WeakPolarHBondContact O-CB 3.3Å; N301-Y305 PolarHBondContact O-N 2.91Å; E302-Y305 PolarHBondContact O-N 3.16Å; Y305-S307 VanDerWaalsContact C-N 3.35Å; Y305-D308 PolarHBondContact O-N 2.88Å; Y305-I309 HydrophobicContact CD1-CD1 3.93Å; Y305-I309 HydrophobicContact CE1-CD1 3.49Å; Y305-I309 VanDerWaalsContact CE1-CD1 3.49Å; Y305-I309 HydrophobicContact CE2-CD1 4.19Å; Y305-I309 HydrophobicContact CG-CD1 4.46Å; Y305-I309 WeakPolarHBondContact O-CG1 3.25Å; Y305-I309 PolarHBondContact O-N 3.12Å
306	L	92.4	Very high	92.1	Very high	32 Å²	32	56.4 Å²	56.4	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-36.5	174.4	-69	170.8	0	0	0	112.5	V231 V234 E302 R304 I309 L310	V231-L306 HydrophobicContact CG1-CD1 4.1Å; V231-L306 HydrophobicContact CG2-CD1 3.89Å; V234-L306 HydrophobicContact CG1-CB 4.18Å; E302-L306 HydrophobicContact CG-CD1 4.4Å; E302-L306 WeakPolarHBondContact O-CG 3.24Å; E302-L306 PolarHBondContact O-N 2.95Å; R304-L306 VanDerWaalsContact C-N 3.34Å; R304-L306 PolarHBondContact O-N 2.94Å; L306-I309 PolarHBondContact O-N 2.98Å; L306-L310 PolarHBondContact O-N 3.45Å
307	S	95.6	Very high	92.4	Very high	10 Å²	10	57.7 Å²	57.7	7%	0.07	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-44.1	173	-62.5	0	0	0	0	111.9	L272 L303 R304 Y305 L310 V311	L272-S307 VanDerWaalsContact CD2-CB 3.44Å; L303-S307 WeakPolarHBondContact O-CB 3.27Å; L303-S307 PolarHBondContact O-N 3.26Å; L303-S307 PolarHBondContact O-OG 3.43Å; R304-S307 WeakPolarHBondContact O-CA 3.33Å; R304-S307 VanDerWaalsContact O-CB 3.25Å; R304-S307 WeakPolarHBondContact O-CB 3.49Å; R304-S307 PolarHBondContact O-N 3.17Å; R304-S307 VanDerWaalsContact O-N 3.08Å; Y305-S307 VanDerWaalsContact C-N 3.35Å; S307-L310 PolarHBondContact O-N 3.45Å; S307-V311 WeakPolarHBondContact O-CG2 3.39Å; S307-V311 PolarHBondContact O-N 3.16Å; S307-V311 VanDerWaalsContact O-N 3.08Å
308	D	94.5	Very high	92.8	Very high	97 Å²	97	59.9 Å²	59.9	52%	0.519	28%	0.276	S	S	.	.	H	α-helix	trans	-65.8	-37.9	179.1	-63.6	-34.3	0	0	0	111.7	R304 Y305 N312	R304-D308 VanDerWaalsContact O-CG 3.29Å; R304-D308 PolarHBondContact O-N 3.16Å; Y305-D308 PolarHBondContact O-N 2.88Å; D308-N312 WeakPolarHBondContact O-CB 3.41Å; D308-N312 PolarHBondContact O-N 2.89Å
309	I	94.8	Very high	92.9	Very high	52 Å²	52	57.5 Å²	57.5	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-60.5	-49.7	171.4	-70.8	165.7	0	0	0	111	L238 Y305 L306 V311 N312 E313	L238-I309 HydrophobicContact CD1-CG2 4.19Å; L238-I309 HydrophobicContact CD2-CG2 4.3Å; Y305-I309 HydrophobicContact CD1-CD1 3.93Å; Y305-I309 HydrophobicContact CE1-CD1 3.49Å; Y305-I309 VanDerWaalsContact CE1-CD1 3.49Å; Y305-I309 HydrophobicContact CE2-CD1 4.19Å; Y305-I309 HydrophobicContact CG-CD1 4.46Å; Y305-I309 WeakPolarHBondContact O-CG1 3.25Å; Y305-I309 PolarHBondContact O-N 3.12Å; L306-I309 PolarHBondContact O-N 2.98Å; I309-V311 PolarHBondContact O-N 3.21Å; I309-N312 PolarHBondContact O-N 2.8Å; I309-N312 VanDerWaalsContact O-N 3.14Å; I309-E313 HydrophobicContact CG2-CG 4.22Å; I309-E313 WeakPolarHBondContact O-CB 3.48Å; I309-E313 PolarHBondContact O-N 2.84Å
310	L	95	Very high	92.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57.8	-47.2	-178.6	178.7	62.8	0	0	0	111.8	V234 L237 L238 L271 L306 S307 E313 I314	V234-L310 HydrophobicContact CG1-CB 4.21Å; V234-L310 HydrophobicContact CG1-CD2 4.25Å; V234-L310 HydrophobicContact CG2-CD2 4.18Å; L237-L310 HydrophobicContact CB-CD1 3.89Å; L237-L310 HydrophobicContact CD1-CD2 4.27Å; L238-L310 HydrophobicContact CD2-CD1 3.96Å; L238-L310 HydrophobicContact CG-CD1 4.05Å; L271-L310 HydrophobicContact CD2-CD2 4.28Å; L306-L310 PolarHBondContact O-N 3.45Å; S307-L310 PolarHBondContact O-N 3.45Å; L310-E313 PolarHBondContact O-N 3.11Å; L310-I314 HydrophobicContact CD1-CD1 3.7Å; L310-I314 HydrophobicContact CD1-CG1 4.31Å; L310-I314 HydrophobicContact CG-CD1 4.14Å; L310-I314 WeakPolarHBondContact O-CG1 3.5Å; L310-I314 PolarHBondContact O-N 3.16Å; L310-I314 VanDerWaalsContact O-N 3.1Å
311	V	95.6	Very high	92.6	Very high	60 Å²	60	57.3 Å²	57.3	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-59.4	-47.1	174.7	172.5	0	0	0	0	110.9	L272 S307 I309 R315	L272-V311 HydrophobicContact CD1-CG2 3.41Å; L272-V311 VanDerWaalsContact CD1-CG2 3.41Å; L272-V311 HydrophobicContact CD2-CG2 4.02Å; L272-V311 HydrophobicContact CG-CG2 4.39Å; S307-V311 WeakPolarHBondContact O-CG2 3.39Å; S307-V311 PolarHBondContact O-N 3.16Å; S307-V311 VanDerWaalsContact O-N 3.08Å; I309-V311 PolarHBondContact O-N 3.21Å; V311-R315 WeakPolarHBondContact O-CB 3.44Å; V311-R315 PolarHBondContact O-N 2.9Å
312	N	94.6	Very high	92.5	Very high	66 Å²	66	55.3 Å²	55.3	35%	0.353	26%	0.264	S	S	.	.	H	α-helix	trans	-66.3	-40.1	-177.1	-174.4	64.6	0	0	0	113	D308 I309 R315 T316	D308-N312 WeakPolarHBondContact O-CB 3.41Å; D308-N312 PolarHBondContact O-N 2.89Å; I309-N312 PolarHBondContact O-N 2.8Å; I309-N312 VanDerWaalsContact O-N 3.14Å; N312-R315 PolarHBondContact OD1-NH2 3.37Å; N312-T316 VanDerWaalsContact O-CB 3.24Å; N312-T316 WeakPolarHBondContact O-CB 3.46Å; N312-T316 PolarHBondContact O-N 2.99Å; N312-T316 PolarHBondContact O-OG1 3.11Å
313	E	93.1	Very high	92.1	Very high	72 Å²	72	57.1 Å²	57.1	34%	0.336	27%	0.267	S	S	.	.	H	α-helix	trans	-69.5	-43.1	-179.9	-82.9	-55.4	126.8	0	0	112.7	L238 Q241 I309 L310 K317	L238-E313 HydrophobicContact CD2-CB 4.1Å; L238-E313 HydrophobicContact CD2-CG 4.25Å; Q241-E313 PolarHBondContact NE2-O 3.19Å; Q241-E313 PolarHBondContact NE2-OE2 3.38Å; I309-E313 HydrophobicContact CG2-CG 4.22Å; I309-E313 WeakPolarHBondContact O-CB 3.48Å; I309-E313 PolarHBondContact O-N 2.84Å; L310-E313 PolarHBondContact O-N 3.11Å; E313-K317 WeakPolarHBondContact O-CB 3.46Å; E313-K317 PolarHBondContact O-N 3.15Å
314	I	92.7	Very high	91.5	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-46.5	174.7	-70.3	174.7	0	0	0	110.2	Q241 L261 D265 L310 T316 K317 R318	Q241-I314 HydrophobicContact CG-CG1 4.44Å; L261-I314 HydrophobicContact CD1-CG1 4.46Å; L261-I314 HydrophobicContact CD1-CG2 4.1Å; D265-I314 HydrophobicContact CB-CG2 3.78Å; L310-I314 HydrophobicContact CD1-CD1 3.7Å; L310-I314 HydrophobicContact CD1-CG1 4.31Å; L310-I314 HydrophobicContact CG-CD1 4.14Å; L310-I314 WeakPolarHBondContact O-CG1 3.5Å; L310-I314 PolarHBondContact O-N 3.16Å; L310-I314 VanDerWaalsContact O-N 3.1Å; I314-T316 PolarHBondContact O-N 3.25Å; I314-K317 PolarHBondContact O-N 3.47Å; I314-R318 WeakPolarHBondContact O-CB 3.23Å; I314-R318 PolarHBondContact O-N 3.44Å
315	R	93.9	Very high	91.1	Very high	134 Å²	134	55.2 Å²	55.2	51%	0.506	26%	0.262	S	S	.	.	H	α-helix	trans	-58.3	-47.1	177	-176.4	-170.8	69.8	84.6	4.3	112	V311 N312 R318 V319	V311-R315 WeakPolarHBondContact O-CB 3.44Å; V311-R315 PolarHBondContact O-N 2.9Å; N312-R315 PolarHBondContact OD1-NH2 3.37Å; R315-R318 PolarHBondContact O-N 3.18Å; R315-V319 WeakPolarHBondContact O-CG2 3.36Å; R315-V319 PolarHBondContact O-N 3.5Å
316	T	90.6	Very high	90.7	Very high	41 Å²	41	54.2 Å²	54.2	25%	0.252	26%	0.261	S	S	.	.	H	α-helix	trans	-64.5	-47.5	-178.9	-60.5	0	0	0	0	110.9	N312 I314 R318 V319 Q320	N312-T316 VanDerWaalsContact O-CB 3.24Å; N312-T316 WeakPolarHBondContact O-CB 3.46Å; N312-T316 PolarHBondContact O-N 2.99Å; N312-T316 PolarHBondContact O-OG1 3.11Å; I314-T316 PolarHBondContact O-N 3.25Å; T316-R318 VanDerWaalsContact C-N 3.31Å; T316-R318 PolarHBondContact O-N 3.01Å; T316-V319 PolarHBondContact O-N 3.23Å; T316-Q320 WeakPolarHBondContact O-CG 3.46Å; T316-Q320 PolarHBondContact O-N 2.62Å
317	K	90.2	Very high	90	Very high	27 Å²	27	53 Å²	53	12%	0.117	26%	0.255	C	S	.	.	H	α-helix	trans	-61.5	-37.7	176.6	-156.2	76.5	172	-172.1	0	112.2	G245 L261 E313 I314 Q320 L321	G245-K317 VanDerWaalsContact O-CE 3.28Å; G245-K317 WeakPolarHBondContact O-CE 3.48Å; G245-K317 PolarHBondContact O-NZ 2.8Å; L261-K317 HydrophobicContact CD2-CB 3.9Å; L261-K317 HydrophobicContact CD2-CG 4.09Å; E313-K317 WeakPolarHBondContact O-CB 3.46Å; E313-K317 PolarHBondContact O-N 3.15Å; I314-K317 PolarHBondContact O-N 3.47Å; K317-Q320 PolarHBondContact O-N 2.89Å; K317-L321 HydrophobicContact CG-CD1 4.2Å; K317-L321 WeakPolarHBondContact O-CB 3.43Å; K317-L321 WeakPolarHBondContact O-CG 3.29Å; K317-L321 PolarHBondContact O-N 3.34Å
318	R	92.4	Very high	89.4	Confident	86 Å²	86	53.5 Å²	53.5	33%	0.325	26%	0.256	S	S	.	.	H	α-helix	trans	-64.6	-45.9	176	178.7	-177.9	-87.3	150.7	-4.7	111.2	L261 D265 I314 R315 T316 S322	L261-R318 HydrophobicContact CD2-CB 3.83Å; D265-R318 IonicContact OD2-CZ 2.66Å; D265-R318 IonicContact OD2-NH1 2.59Å; D265-R318 PolarHBondContact OD2-NH1 3.31Å; D265-R318 IonicContact OD2-NH2 3.1Å; D265-R318 PolarHBondContact OD2-NH2 2.99Å; I314-R318 WeakPolarHBondContact O-CB 3.23Å; I314-R318 PolarHBondContact O-N 3.44Å; R315-R318 PolarHBondContact O-N 3.18Å; T316-R318 VanDerWaalsContact C-N 3.31Å; T316-R318 PolarHBondContact O-N 3.01Å; R318-S322 WeakPolarHBondContact O-CB 3.47Å; R318-S322 PolarHBondContact O-N 3.17Å; R318-S322 PolarHBondContact O-OG 2.84Å
319	V	88.9	Confident	88.9	Confident	65 Å²	65	55.8 Å²	55.8	39%	0.394	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-46.2	177.2	171.3	0	0	0	0	110.9	R315 T316 S322 R323	R315-V319 WeakPolarHBondContact O-CG2 3.36Å; R315-V319 PolarHBondContact O-N 3.5Å; T316-V319 PolarHBondContact O-N 3.23Å; V319-S322 PolarHBondContact O-N 3.37Å; V319-R323 WeakPolarHBondContact O-CG 3.35Å; V319-R323 PolarHBondContact O-N 3.13Å
320	Q	86.1	Confident	88.2	Confident	53 Å²	53	56 Å²	56	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-57.7	177.7	-73.5	171	-19.3	0	0	112.3	I247 T316 K317 S322 R323 T324 L391	I247-Q320 HydrophobicContact CD1-CB 3.88Å; I247-Q320 HydrophobicContact CD1-CG 3.97Å; I247-Q320 HydrophobicContact CG1-CB 4.12Å; I247-Q320 HydrophobicContact CG2-CB 4.09Å; T316-Q320 WeakPolarHBondContact O-CG 3.46Å; T316-Q320 PolarHBondContact O-N 2.62Å; K317-Q320 PolarHBondContact O-N 2.89Å; Q320-S322 VanDerWaalsContact C-N 3.26Å; Q320-S322 PolarHBondContact O-N 2.76Å; Q320-R323 WeakPolarHBondContact O-CB 3.41Å; Q320-R323 PolarHBondContact O-N 3.46Å; Q320-R323 VanDerWaalsContact O-N 3.12Å; Q320-T324 PolarHBondContact O-N 3.08Å; Q320-T324 PolarHBondContact O-OG1 2.93Å; Q320-L391 HydrophobicContact CG-CD2 4.09Å
321	L	88	Confident	87.4	Confident	0 Å²	0	57 Å²	57	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-34.2	-179.9	-73.2	168.6	0	0	0	112.3	I247 V254 R257 L258 L261 K317 F325	I247-L321 HydrophobicContact CG2-CD2 4.07Å; I247-L321 HydrophobicContact CG2-CG 4.46Å; V254-L321 HydrophobicContact CG1-CD2 4.18Å; R257-L321 HydrophobicContact CB-CD1 4.07Å; R257-L321 HydrophobicContact CB-CD2 4.25Å; L258-L321 HydrophobicContact CD2-CB 3.55Å; L258-L321 HydrophobicContact CG-CB 3.92Å; L261-L321 HydrophobicContact CD2-CD1 4.04Å; K317-L321 HydrophobicContact CG-CD1 4.2Å; K317-L321 WeakPolarHBondContact O-CB 3.43Å; K317-L321 WeakPolarHBondContact O-CG 3.29Å; K317-L321 PolarHBondContact O-N 3.34Å; L321-F325 VanDerWaalsContact O-CB 3.28Å; L321-F325 WeakPolarHBondContact O-CB 3.31Å; L321-F325 PolarHBondContact O-N 2.91Å
322	S	88.5	Confident	86.8	Confident	44 Å²	44	58.5 Å²	58.5	31%	0.308	27%	0.267	S	S	.	.	H	α-helix	trans	-68.3	-37.4	176.3	-60.4	0	0	0	0	112.5	R318 V319 Q320 K326	R318-S322 WeakPolarHBondContact O-CB 3.47Å; R318-S322 PolarHBondContact O-N 3.17Å; R318-S322 PolarHBondContact O-OG 2.84Å; V319-S322 PolarHBondContact O-N 3.37Å; Q320-S322 VanDerWaalsContact C-N 3.26Å; Q320-S322 PolarHBondContact O-N 2.76Å; S322-K326 WeakPolarHBondContact O-CG 3.16Å; S322-K326 PolarHBondContact O-N 3.15Å; S322-K326 VanDerWaalsContact O-N 3.15Å
323	R	84	Confident	86.3	Confident	107 Å²	107	59 Å²	59	40%	0.404	27%	0.267	S	S	.	.	H	α-helix	trans	-64	-51.7	172.6	-78	-178.3	-177.1	-145.2	3.4	110.8	V319 Q320 F325 K326 V327 F388 L391	V319-R323 WeakPolarHBondContact O-CG 3.35Å; V319-R323 PolarHBondContact O-N 3.13Å; Q320-R323 WeakPolarHBondContact O-CB 3.41Å; Q320-R323 PolarHBondContact O-N 3.46Å; Q320-R323 VanDerWaalsContact O-N 3.12Å; R323-F325 VanDerWaalsContact C-N 3.3Å; R323-F325 PolarHBondContact O-N 3.33Å; R323-K326 WeakPolarHBondContact O-CB 3.43Å; R323-K326 PolarHBondContact O-N 3.1Å; R323-V327 PolarHBondContact O-N 3.06Å; R323-V327 VanDerWaalsContact O-N 3.11Å; R323-F388 HydrophobicContact CB-CD1 4.3Å; R323-F388 HydrophobicContact CB-CE1 3.89Å; R323-F388 HydrophobicContact CG-CE1 4.24Å; R323-L391 HydrophobicContact CB-CD1 4.03Å
324	T	82.6	Confident	85.7	Confident	5 Å²	5	56 Å²	56	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-36	179.5	-54.2	0	0	0	0	112.3	I247 V254 Q320 V327 H328	I247-T324 HydrophobicContact CG2-CG2 4.43Å; I247-T324 VanDerWaalsContact CG2-OG1 3.25Å; I247-T324 WeakPolarHBondContact CG2-OG1 3.34Å; V254-T324 HydrophobicContact CG2-CG2 4.41Å; Q320-T324 PolarHBondContact O-N 3.08Å; Q320-T324 PolarHBondContact O-OG1 2.93Å; T324-V327 PolarHBondContact O-N 3.23Å; T324-H328 PolarHBondContact O-CD2 3.03Å; T324-H328 PolarHBondContact O-N 2.9Å
325	F	86.7	Confident	85.2	Confident	48 Å²	48	63.2 Å²	63.2	21%	0.211	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-40	172.6	-177.5	-101.5	0	0	0	113	L251 V254 K255 L258 L321 R323 R329	L251-F325 HydrophobicContact CD1-CD2 3.61Å; L251-F325 HydrophobicContact CD1-CE2 3.4Å; L251-F325 VanDerWaalsContact CD1-CE2 3.4Å; L251-F325 HydrophobicContact CD1-CZ 4.2Å; L251-F325 HydrophobicContact CG-CE2 4.21Å; V254-F325 HydrophobicContact CG1-CB 3.88Å; V254-F325 HydrophobicContact CG1-CD2 4.45Å; K255-F325 HydrophobicContact CB-CD2 4.29Å; K255-F325 HydrophobicContact CB-CE2 3.86Å; K255-F325 HydrophobicContact CD-CE2 4.23Å; K255-F325 HydrophobicContact CG-CE2 4.08Å; L258-F325 HydrophobicContact CD1-CB 3.79Å; L258-F325 HydrophobicContact CD1-CD2 4.32Å; L258-F325 HydrophobicContact CD1-CG 3.96Å; L321-F325 VanDerWaalsContact O-CB 3.28Å; L321-F325 WeakPolarHBondContact O-CB 3.31Å; L321-F325 PolarHBondContact O-N 2.91Å; R323-F325 VanDerWaalsContact C-N 3.3Å; R323-F325 PolarHBondContact O-N 3.33Å; F325-R329 WeakPolarHBondContact O-CB 3.34Å; F325-R329 PolarHBondContact O-N 3.33Å
326	K	84	Confident	84.7	Confident	136 Å²	136	61.5 Å²	61.5	59%	0.591	28%	0.279	S	S	*	.	H	α-helix	trans	-61	-47	173.4	-73	175.5	177.4	-172.1	0	111.5	S322 R323 R329 L330	S322-K326 WeakPolarHBondContact O-CG 3.16Å; S322-K326 PolarHBondContact O-N 3.15Å; S322-K326 VanDerWaalsContact O-N 3.15Å; R323-K326 WeakPolarHBondContact O-CB 3.43Å; R323-K326 PolarHBondContact O-N 3.1Å; K326-R329 PolarHBondContact O-N 3.31Å; K326-R329 VanDerWaalsContact O-N 3.15Å; K326-L330 WeakPolarHBondContact O-CG 3.48Å; K326-L330 PolarHBondContact O-N 3.47Å
327	V	78.9	Confident	84.4	Confident	6 Å²	6	59.7 Å²	59.7	4%	0.036	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-47.6	179.7	-179.6	0	0	0	0	111.3	R323 T324 R329 L330 L331 F388 L392 L396 M400	R323-V327 PolarHBondContact O-N 3.06Å; R323-V327 VanDerWaalsContact O-N 3.11Å; T324-V327 PolarHBondContact O-N 3.23Å; V327-R329 VanDerWaalsContact C-N 3.27Å; V327-R329 PolarHBondContact O-N 3.46Å; V327-L330 PolarHBondContact O-N 2.97Å; V327-L331 HydrophobicContact CG1-CD1 3.93Å; V327-L331 WeakPolarHBondContact O-CG 3.46Å; V327-L331 PolarHBondContact O-N 3.1Å; V327-F388 HydrophobicContact CG2-CD1 3.45Å; V327-F388 VanDerWaalsContact CG2-CD1 3.45Å; V327-F388 HydrophobicContact CG2-CD2 4.35Å; V327-F388 HydrophobicContact CG2-CE1 3.39Å; V327-F388 HydrophobicContact CG2-CE2 4.28Å; V327-F388 HydrophobicContact CG2-CG 3.96Å; V327-F388 HydrophobicContact CG2-CZ 3.84Å; V327-L392 HydrophobicContact CG1-CD2 4.13Å; V327-L396 HydrophobicContact CB-CD2 4.47Å; V327-L396 HydrophobicContact CG1-CD2 3.84Å; V327-L396 HydrophobicContact CG1-CG 4.39Å; V327-M400 HydrophobicContact CG1-SD 4.42Å
328	H	82.3	Confident	84	Confident	21 Å²	21	58.4 Å²	58.4	10%	0.097	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-35.2	175.3	-75.1	-65.4	0	0	0	113.2	G249 L251 T324 Q332	G249-H328 PolarHBondContact O-CE1 3.27Å; G249-H328 PolarHBondContact O-NE2 3.05Å; L251-H328 HydrophobicContact CB-CB 4.09Å; L251-H328 HydrophobicContact CD1-CB 3.59Å; L251-H328 HydrophobicContact CG-CB 4.42Å; T324-H328 PolarHBondContact O-CD2 3.03Å; T324-H328 PolarHBondContact O-N 2.9Å; H328-Q332 PolarHBondContact O-N 3.39Å
329	R	84.2	Confident	83.5	Confident	146 Å²	146	57.6 Å²	57.6	55%	0.551	27%	0.265	S	S	*	.	H	α-helix	trans	-69	-44.8	177.3	-174.7	179.7	177.7	176.6	0.3	111.7	F325 K326 V327 L331 Q332 Q333	F325-R329 WeakPolarHBondContact O-CB 3.34Å; F325-R329 PolarHBondContact O-N 3.33Å; K326-R329 PolarHBondContact O-N 3.31Å; K326-R329 VanDerWaalsContact O-N 3.15Å; V327-R329 VanDerWaalsContact C-N 3.27Å; V327-R329 PolarHBondContact O-N 3.46Å; R329-L331 VanDerWaalsContact C-N 3.32Å; R329-L331 PolarHBondContact O-N 3.28Å; R329-Q332 PolarHBondContact O-N 3.24Å; R329-Q333 WeakPolarHBondContact O-CG 3.25Å; R329-Q333 PolarHBondContact O-N 3.09Å; R329-Q333 PolarHBondContact O-OE1 3.43Å
330	L	79	Confident	83.2	Confident	56 Å²	56	59.3 Å²	59.3	29%	0.293	27%	0.269	S	S	.	.	H	α-helix	trans	-59.5	-43.6	174.5	-70.5	170.9	0	0	0	111.1	K326 V327 Q332 Q333 A334	K326-L330 WeakPolarHBondContact O-CG 3.48Å; K326-L330 PolarHBondContact O-N 3.47Å; V327-L330 PolarHBondContact O-N 2.97Å; L330-Q332 PolarHBondContact O-N 3.36Å; L330-Q333 PolarHBondContact O-N 2.97Å; L330-A334 WeakPolarHBondContact O-CB 3.49Å; L330-A334 PolarHBondContact O-N 3.17Å
331	L	78.5	Confident	83.1	Confident	21 Å²	21	56.8 Å²	56.8	11%	0.11	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-37.5	176.1	-76.3	166.1	0	0	0	113.3	V327 R329 Q333 R335 L396 M400 I403	V327-L331 HydrophobicContact CG1-CD1 3.93Å; V327-L331 WeakPolarHBondContact O-CG 3.46Å; V327-L331 PolarHBondContact O-N 3.1Å; R329-L331 VanDerWaalsContact C-N 3.32Å; R329-L331 PolarHBondContact O-N 3.28Å; L331-Q333 VanDerWaalsContact C-N 3.35Å; L331-R335 VanDerWaalsContact O-CB 3.29Å; L331-R335 WeakPolarHBondContact O-CB 3.46Å; L331-R335 PolarHBondContact O-N 3.11Å; L331-L396 HydrophobicContact CD1-CD1 3.5Å; L331-L396 VanDerWaalsContact CD1-CD1 3.5Å; L331-L396 HydrophobicContact CD1-CG 3.98Å; L331-M400 HydrophobicContact CD1-CG 3.71Å; L331-M400 HydrophobicContact CD2-CB 4.18Å; L331-M400 HydrophobicContact CD2-CG 3.52Å; L331-M400 HydrophobicContact CG-CG 4.09Å; L331-I403 HydrophobicContact CB-CD1 4.44Å; L331-I403 HydrophobicContact CD2-CD1 3.76Å
332	Q	84.2	Confident	82.8	Confident	91 Å²	91	60.5 Å²	60.5	43%	0.425	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-42.7	173.4	-172.7	-180	13.7	0	0	111.4	H328 R329 L330 R335 Q336	H328-Q332 PolarHBondContact O-N 3.39Å; R329-Q332 PolarHBondContact O-N 3.24Å; L330-Q332 PolarHBondContact O-N 3.36Å; Q332-R335 PolarHBondContact O-N 3.27Å; Q332-Q336 WeakPolarHBondContact O-CG 3.42Å; Q332-Q336 PolarHBondContact O-N 2.95Å
333	Q	82.9	Confident	82.5	Confident	76 Å²	76	62.7 Å²	62.7	36%	0.355	29%	0.289	S	S	.	.	H	α-helix	trans	-68.2	-44.1	179.1	-67.1	175.8	-90.5	0	0	111.9	R329 L330 L331 R335 Q336 C337 F376	R329-Q333 WeakPolarHBondContact O-CG 3.25Å; R329-Q333 PolarHBondContact O-N 3.09Å; R329-Q333 PolarHBondContact O-OE1 3.43Å; L330-Q333 PolarHBondContact O-N 2.97Å; L331-Q333 VanDerWaalsContact C-N 3.35Å; Q333-R335 VanDerWaalsContact C-N 3.32Å; Q333-R335 PolarHBondContact O-N 3.28Å; Q333-Q336 PolarHBondContact O-N 2.65Å; Q333-C337 PolarHBondContact O-N 3.13Å; Q333-F376 HydrophobicContact CB-CE1 3.95Å; Q333-F376 HydrophobicContact CB-CZ 3.95Å
334	A	80.8	Confident	82.4	Confident	10 Å²	10	59.8 Å²	59.8	8%	0.083	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-38.1	175.2	0	0	0	0	0	112.2	L330 C337 C338 F376 I403	L330-A334 WeakPolarHBondContact O-CB 3.49Å; L330-A334 PolarHBondContact O-N 3.17Å; A334-C337 WeakPolarHBondContact O-CB 3.24Å; A334-C337 PolarHBondContact O-N 3.49Å; A334-C338 PolarHBondContact O-N 3.26Å; A334-C338 PolarHBondContact O-SG 2.96Å; A334-F376 HydrophobicContact CB-CB 4.34Å; A334-F376 HydrophobicContact CB-CD1 3.81Å; A334-F376 HydrophobicContact CB-CE1 4.47Å; A334-F376 HydrophobicContact CB-CG 4.26Å; A334-I403 HydrophobicContact CB-CG2 3.68Å
335	R	82	Confident	82.2	Confident	155 Å²	155	61.4 Å²	61.4	59%	0.585	29%	0.289	S	S	*	.	H	α-helix	trans	-66	-44.8	173.1	-174.6	174.3	180	160.7	3.5	112.4	L331 Q332 Q333 C337 C338 D339 I403	L331-R335 VanDerWaalsContact O-CB 3.29Å; L331-R335 WeakPolarHBondContact O-CB 3.46Å; L331-R335 PolarHBondContact O-N 3.11Å; Q332-R335 PolarHBondContact O-N 3.27Å; Q333-R335 VanDerWaalsContact C-N 3.32Å; Q333-R335 PolarHBondContact O-N 3.28Å; R335-C337 PolarHBondContact O-N 3.02Å; R335-C338 WeakPolarHBondContact O-CA 3.41Å; R335-C338 VanDerWaalsContact O-CB 3.28Å; R335-C338 WeakPolarHBondContact O-CB 3.36Å; R335-C338 PolarHBondContact O-N 3.23Å; R335-D339 PolarHBondContact O-N 2.7Å; R335-I403 HydrophobicContact CB-CD1 4.08Å
336	Q	84	Confident	81.7	Confident	97 Å²	97	62.6 Å²	62.6	45%	0.453	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-34.2	174.5	-74.8	173.6	-35	0	0	112.1	Q332 Q333 D339 Q340	Q332-Q336 WeakPolarHBondContact O-CG 3.42Å; Q332-Q336 PolarHBondContact O-N 2.95Å; Q333-Q336 PolarHBondContact O-N 2.65Å; Q336-D339 PolarHBondContact O-N 2.74Å; Q336-Q340 WeakPolarHBondContact O-CB 3.44Å; Q336-Q340 VanDerWaalsContact O-CG 3.27Å; Q336-Q340 WeakPolarHBondContact O-CG 3.15Å; Q336-Q340 PolarHBondContact O-N 2.91Å
337	C	83.3	Confident	81	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.02	31%	0.309	C	S	.	.	H	α-helix	trans	-66.2	-40.9	171.6	-174.7	0	0	0	0	112.1	Q333 A334 R335 Q340 G341 F369 A373 F376 L407	Q333-C337 PolarHBondContact O-N 3.13Å; A334-C337 WeakPolarHBondContact O-CB 3.24Å; A334-C337 PolarHBondContact O-N 3.49Å; R335-C337 PolarHBondContact O-N 3.02Å; C337-Q340 PolarHBondContact O-N 3.17Å; C337-G341 PolarHBondContact O-N 3.34Å; C337-F369 WeakPolarHBondContact O-CE2 3.38Å; C337-F369 VanDerWaalsContact O-CZ 3.32Å; C337-F369 WeakPolarHBondContact O-CZ 2.95Å; C337-A373 WeakPolarHBondContact SG-CB 3.48Å; C337-F376 HydrophobicContact CB-CD2 4.47Å; C337-L407 HydrophobicContact CB-CD2 4.49Å
338	C	81.8	Confident	80.6	Confident	1 Å²	1	62 Å²	62	1%	0.007	32%	0.317	C	S	.	.	H	α-helix	trans	-59.5	-49.3	171	-59	0	0	0	0	111.7	A334 R335 Q340 G341 E342 K406 L407 I410	A334-C338 PolarHBondContact O-N 3.26Å; A334-C338 PolarHBondContact O-SG 2.96Å; R335-C338 WeakPolarHBondContact O-CA 3.41Å; R335-C338 VanDerWaalsContact O-CB 3.28Å; R335-C338 WeakPolarHBondContact O-CB 3.36Å; R335-C338 PolarHBondContact O-N 3.23Å; C338-Q340 VanDerWaalsContact C-N 3.27Å; C338-Q340 PolarHBondContact O-N 3.3Å; C338-G341 PolarHBondContact O-N 3.27Å; C338-G341 VanDerWaalsContact O-N 3.09Å; C338-E342 PolarHBondContact O-N 3.11Å; C338-K406 HydrophobicContact CB-CB 4.49Å; C338-L407 VanDerWaalsContact SG-CD2 3.58Å; C338-I410 HydrophobicContact CB-CD1 4.04Å
339	D	82.9	Confident	79.6	Confident	69 Å²	69	63 Å²	63	37%	0.369	33%	0.333	S	S	.	.	H	α-helix	trans	-61.6	-36.8	-177.6	-57	-30.1	0	0	0	110.8	R335 Q336 C343	R335-D339 PolarHBondContact O-N 2.7Å; Q336-D339 PolarHBondContact O-N 2.74Å; D339-C343 WeakPolarHBondContact O-CB 3.48Å; D339-C343 PolarHBondContact O-N 3.14Å; D339-C343 VanDerWaalsContact O-N 3.1Å; D339-C343 PolarHBondContact O-SG 3.19Å; D339-C343 VanDerWaalsContact O-SG 3.39Å
340	Q	83	Confident	78	Confident	100 Å²	100	65 Å²	65	47%	0.467	35%	0.351	S	S	.	.	H	α-helix	trans	-68.1	-42	172.1	-75	170.8	-7.5	0	0	112.9	Q336 C337 C338 C343 L344 F369	Q336-Q340 WeakPolarHBondContact O-CB 3.44Å; Q336-Q340 VanDerWaalsContact O-CG 3.27Å; Q336-Q340 WeakPolarHBondContact O-CG 3.15Å; Q336-Q340 PolarHBondContact O-N 2.91Å; C337-Q340 PolarHBondContact O-N 3.17Å; C338-Q340 VanDerWaalsContact C-N 3.27Å; C338-Q340 PolarHBondContact O-N 3.3Å; Q340-C343 PolarHBondContact O-N 3.29Å; Q340-L344 WeakPolarHBondContact O-CG 3.5Å; Q340-L344 PolarHBondContact O-N 3.09Å; Q340-F369 HydrophobicContact CB-CE2 4.08Å
341	G	83.4	Confident	76.6	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-64.9	-40.7	176.8	0	0	0	0	0	112.9	C337 C338 L344 L345 F369	C337-G341 PolarHBondContact O-N 3.34Å; C338-G341 PolarHBondContact O-N 3.27Å; C338-G341 VanDerWaalsContact O-N 3.09Å; G341-L344 PolarHBondContact O-N 2.87Å; G341-L345 WeakPolarHBondContact O-CB 3.22Å; G341-L345 WeakPolarHBondContact O-CG 3.46Å; G341-L345 PolarHBondContact O-N 3.5Å; G341-F369 VanDerWaalsContact CA-CZ 3.43Å
342	E	82	Confident	75.6	Confident	78 Å²	78	76.4 Å²	76.4	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-64.8	-41.1	174	-77.9	170.2	-154.4	0	0	111.5	C338 A346 K406 I410	C338-E342 PolarHBondContact O-N 3.11Å; E342-A346 VanDerWaalsContact O-CB 3.3Å; E342-A346 WeakPolarHBondContact O-CB 3.38Å; E342-A346 PolarHBondContact O-N 3.13Å; E342-K406 VanDerWaalsContact CD-NZ 3.25Å; E342-K406 IonicContact OE1-NZ 3.87Å; E342-K406 PolarHBondContact OE1-NZ 2.92Å; E342-K406 IonicContact OE2-NZ 3.86Å; E342-K406 PolarHBondContact OE2-NZ 3.34Å; E342-K406 VanDerWaalsContact OE2-NZ 3.1Å; E342-I410 HydrophobicContact CG-CD1 4.01Å; E342-I410 HydrophobicContact CG-CG1 4.32Å
343	C	81.4	Confident	74.3	Confident	90 Å²	90	76.9 Å²	76.9	61%	0.608	40%	0.404	S	S	*	.	H	α-helix	trans	-62.9	-41	171.4	-78.7	0	0	0	0	113	D339 Q340 A346 S347	D339-C343 WeakPolarHBondContact O-CB 3.48Å; D339-C343 PolarHBondContact O-N 3.14Å; D339-C343 VanDerWaalsContact O-N 3.1Å; D339-C343 PolarHBondContact O-SG 3.19Å; D339-C343 VanDerWaalsContact O-SG 3.39Å; Q340-C343 PolarHBondContact O-N 3.29Å; C343-A346 PolarHBondContact O-N 2.93Å; C343-S347 WeakPolarHBondContact O-CB 3.38Å; C343-S347 PolarHBondContact O-N 3.16Å; C343-S347 PolarHBondContact O-OG 2.88Å
344	L	81.6	Confident	73.1	Confident	47 Å²	47	81.6 Å²	81.6	25%	0.246	43%	0.426	C	S	.	.	H	α-helix	trans	-65.6	-46.9	177.4	-79.3	169.2	0	0	0	111.6	Q340 G341 A346 S347 Q348 F369 F414	Q340-L344 WeakPolarHBondContact O-CG 3.5Å; Q340-L344 PolarHBondContact O-N 3.09Å; G341-L344 PolarHBondContact O-N 2.87Å; L344-A346 VanDerWaalsContact C-N 3.32Å; L344-A346 PolarHBondContact O-N 2.67Å; L344-S347 WeakPolarHBondContact CA-OG 3.24Å; L344-S347 PolarHBondContact O-N 2.97Å; L344-S347 PolarHBondContact O-OG 3.44Å; L344-Q348 WeakPolarHBondContact O-CG 3.33Å; L344-Q348 PolarHBondContact O-N 2.91Å; L344-Q348 VanDerWaalsContact O-N 3.11Å; L344-F369 HydrophobicContact CD1-CB 3.71Å; L344-F369 HydrophobicContact CD1-CD2 3.59Å; L344-F369 HydrophobicContact CD1-CE2 4.42Å; L344-F369 HydrophobicContact CD1-CG 3.69Å; L344-F414 HydrophobicContact CB-CE1 4.44Å; L344-F414 HydrophobicContact CB-CZ 3.81Å
345	L	78.4	Confident	72.2	Confident	39 Å²	39	84.2 Å²	84.2	20%	0.204	44%	0.441	C	S	.	.	H	α-helix	trans	-57.4	-44.1	173.7	-74.7	169.4	0	0	0	111.7	G341 Q348 G349 I410 A413 F414 Q417	G341-L345 WeakPolarHBondContact O-CB 3.22Å; G341-L345 WeakPolarHBondContact O-CG 3.46Å; G341-L345 PolarHBondContact O-N 3.5Å; L345-Q348 PolarHBondContact O-N 3.04Å; L345-G349 PolarHBondContact O-N 3.07Å; L345-I410 HydrophobicContact CD1-CB 4.37Å; L345-I410 HydrophobicContact CD1-CG1 4.17Å; L345-I410 HydrophobicContact CD1-CG2 4.13Å; L345-A413 HydrophobicContact CD1-CB 4.05Å; L345-A413 HydrophobicContact CD2-CB 3.86Å; L345-F414 HydrophobicContact CD2-CD1 3.62Å; L345-F414 HydrophobicContact CD2-CE1 3.42Å; L345-F414 VanDerWaalsContact CD2-CE1 3.42Å; L345-F414 HydrophobicContact CD2-CE2 4.4Å; L345-F414 HydrophobicContact CD2-CG 4.18Å; L345-F414 HydrophobicContact CD2-CZ 3.86Å; L345-F414 HydrophobicContact CG-CD1 4.32Å; L345-F414 HydrophobicContact CG-CE1 3.71Å; L345-F414 HydrophobicContact CG-CE2 4.16Å; L345-F414 HydrophobicContact CG-CZ 3.63Å; L345-Q417 VanDerWaalsContact CD2-OE1 3.29Å
346	A	76.6	Confident	71.3	Confident	72 Å²	72	84.9 Å²	84.9	60%	0.595	45%	0.449	S	S	*	.	H	α-helix	trans	-64.6	-39.4	176.3	0	0	0	0	0	112.5	E342 C343 L344 Q348 G349	E342-A346 VanDerWaalsContact O-CB 3.3Å; E342-A346 WeakPolarHBondContact O-CB 3.38Å; E342-A346 PolarHBondContact O-N 3.13Å; C343-A346 PolarHBondContact O-N 2.93Å; L344-A346 VanDerWaalsContact C-N 3.32Å; L344-A346 PolarHBondContact O-N 2.67Å; A346-Q348 PolarHBondContact O-N 3.04Å; A346-G349 PolarHBondContact O-N 3.23Å; A346-G349 VanDerWaalsContact O-N 3.1Å
347	S	70.9	Confident	70.4	Confident	89 Å²	89	87.5 Å²	87.5	62%	0.622	46%	0.461	S	S	*	.	H	α-helix	trans	-69.3	-19	178.2	74.2	0	0	0	0	114.2	C343 L344	C343-S347 WeakPolarHBondContact O-CB 3.38Å; C343-S347 PolarHBondContact O-N 3.16Å; C343-S347 PolarHBondContact O-OG 2.88Å; L344-S347 WeakPolarHBondContact CA-OG 3.24Å; L344-S347 PolarHBondContact O-N 2.97Å; L344-S347 PolarHBondContact O-OG 3.44Å
348	Q	69.7	Low	69.5	Low	42 Å²	42	90.9 Å²	90.9	20%	0.196	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-0.2	174	-65.2	172.3	23.9	0	0	112.3	L344 L345 A346 V366	L344-Q348 WeakPolarHBondContact O-CG 3.33Å; L344-Q348 PolarHBondContact O-N 2.91Å; L344-Q348 VanDerWaalsContact O-N 3.11Å; L345-Q348 PolarHBondContact O-N 3.04Å; A346-Q348 PolarHBondContact O-N 3.04Å; Q348-V366 VanDerWaalsContact NE2-CG2 3.28Å
349	G	60.3	Low	68.8	Low	42 Å²	42	92 Å²	92	43%	0.433	49%	0.488	S	S	.	.	S	Bend	trans	-93.6	133.5	177.6	0	0	0	0	0	112.4	L345 A346	L345-G349 PolarHBondContact O-N 3.07Å; A346-G349 PolarHBondContact O-N 3.23Å; A346-G349 VanDerWaalsContact O-N 3.1Å
350	M	51.3	Low	68.2	Low	188 Å²	188	94.4 Å²	94.4	93%	0.926	50%	0.497	S	S	*	.	S	Bend	trans	70.1	35.4	163.2	-54.3	-63	-68.3	0	0	118.1
351	D	49.2	Very low	67.8	Low	141 Å²	141	96.2 Å²	96.2	75%	0.754	50%	0.503	S	S	*	.	S	Bend		-156.4	166.2	127.4	-126.4	-38	0	0	0	113.8
352	K	58.2	Low	67.2	Low	174 Å²	174	96.9 Å²	96.9	76%	0.757	51%	0.509	S	S	*	.			trans	-70.1	137.9	-169.4	-60.5	167.5	-173.2	169.1	0	112.8	Q354	K352-Q354 WeakPolarHBondContact O-CG 3.2Å; K352-Q354 PolarHBondContact O-N 3.36Å; K352-Q354 VanDerWaalsContact O-N 3.08Å
353	F	56.4	Low	66.8	Low	102 Å²	102	96 Å²	96	45%	0.447	51%	0.506	S	S	.	.			trans	-57	112.4	160.2	-61.6	-65.8	0	0	0	109.2	D358 A359 A362	F353-D358 HydrophobicContact CD1-CB 4.11Å; F353-A359 HydrophobicContact CB-CB 4.15Å; F353-A359 HydrophobicContact CD1-CB 4.13Å; F353-A359 HydrophobicContact CD2-CB 4.13Å; F353-A359 HydrophobicContact CG-CB 3.88Å; F353-A362 HydrophobicContact CE1-CB 3.56Å; F353-A362 HydrophobicContact CZ-CB 3.9Å
354	Q	58	Low	66.7	Low	174 Å²	174	96.5 Å²	96.5	81%	0.813	50%	0.5	S	S	*	.			trans	-85.1	-25.1	-175.7	-57.5	-167.2	12.9	0	0	112	K352	K352-Q354 WeakPolarHBondContact O-CG 3.2Å; K352-Q354 PolarHBondContact O-N 3.36Å; K352-Q354 VanDerWaalsContact O-N 3.08Å
355	T	62.3	Low	66.6	Low	65 Å²	65	97.3 Å²	97.3	40%	0.399	50%	0.504	S	S	.	.	S	Bend	trans	-123.5	162.2	171.6	76.9	0	0	0	0	112.3	E357 D358	T355-E357 PolarHBondContact O-N 3.43Å; T355-E357 PolarHBondContact OG1-N 3.26Å; T355-D358 WeakPolarHBondContact CB-OD2 3.38Å; T355-D358 PolarHBondContact N-OD2 2.79Å; T355-D358 PolarHBondContact OG1-N 2.78Å; T355-D358 PolarHBondContact OG1-OD2 3.43Å
356	K	62.6	Low	66.6	Low	170 Å²	170	95.7 Å²	95.7	74%	0.739	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-28.6	171.3	-173.1	177.8	178.8	-179.2	0	112.1	Q360	K356-Q360 WeakPolarHBondContact O-CG 3.48Å; K356-Q360 PolarHBondContact O-N 2.92Å; K356-Q360 VanDerWaalsContact O-N 3.09Å
357	E	65.3	Low	66.7	Low	152 Å²	152	95.1 Å²	95.1	71%	0.71	48%	0.483	S	S	*	.	H	α-helix	trans	-76.4	-36.7	-177.7	-65.5	171	141.1	0	0	111.1	T355 A359 Q360 K361	T355-E357 PolarHBondContact O-N 3.43Å; T355-E357 PolarHBondContact OG1-N 3.26Å; E357-A359 VanDerWaalsContact C-N 3.34Å; E357-A359 PolarHBondContact O-N 3.03Å; E357-Q360 PolarHBondContact O-N 3.46Å; E357-K361 WeakPolarHBondContact O-CB 3.39Å; E357-K361 PolarHBondContact O-N 3.33Å
358	D	64.2	Low	67.2	Low	74 Å²	74	94.6 Å²	94.6	40%	0.396	47%	0.473	S	S	.	.	H	α-helix	trans	-59.3	-44.2	171.3	-59.4	-53.3	0	0	0	111.6	F353 T355 K361 A362	F353-D358 HydrophobicContact CD1-CB 4.11Å; T355-D358 WeakPolarHBondContact CB-OD2 3.38Å; T355-D358 PolarHBondContact N-OD2 2.79Å; T355-D358 PolarHBondContact OG1-N 2.78Å; T355-D358 PolarHBondContact OG1-OD2 3.43Å; D358-K361 PolarHBondContact O-N 3.1Å; D358-A362 WeakPolarHBondContact O-CB 3.39Å; D358-A362 PolarHBondContact O-N 2.93Å
359	A	67.9	Low	67.8	Low	24 Å²	24	93.1 Å²	93.1	20%	0.198	47%	0.466	C	S	.	.	H	α-helix	trans	-66.5	-39	177.7	0	0	0	0	0	112.2	F353 E357 L363	F353-A359 HydrophobicContact CB-CB 4.15Å; F353-A359 HydrophobicContact CD1-CB 4.13Å; F353-A359 HydrophobicContact CD2-CB 4.13Å; F353-A359 HydrophobicContact CG-CB 3.88Å; E357-A359 VanDerWaalsContact C-N 3.34Å; E357-A359 PolarHBondContact O-N 3.03Å; A359-L363 WeakPolarHBondContact O-CB 3.34Å; A359-L363 VanDerWaalsContact O-CG 3.28Å; A359-L363 WeakPolarHBondContact O-CG 3.47Å; A359-L363 PolarHBondContact O-N 2.67Å; A359-L363 VanDerWaalsContact O-N 3.1Å
360	Q	69.1	Low	68.6	Low	119 Å²	119	92.2 Å²	92.2	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-66.8	-39.5	173.8	-74.3	-176	-102	0	0	112.1	K356 E357 L363 Q364	K356-Q360 WeakPolarHBondContact O-CG 3.48Å; K356-Q360 PolarHBondContact O-N 2.92Å; K356-Q360 VanDerWaalsContact O-N 3.09Å; E357-Q360 PolarHBondContact O-N 3.46Å; Q360-L363 PolarHBondContact O-N 2.91Å; Q360-Q364 PolarHBondContact O-N 2.89Å
361	K	74.4	Confident	69.9	Low	138 Å²	138	89.4 Å²	89.4	60%	0.6	44%	0.436	S	S	*	.	H	α-helix	trans	-64	-48.4	176.4	-176.9	-178.9	173.8	-172.1	0	111.5	E357 D358 L363 Q364 D365	E357-K361 WeakPolarHBondContact O-CB 3.39Å; E357-K361 PolarHBondContact O-N 3.33Å; D358-K361 PolarHBondContact O-N 3.1Å; K361-L363 VanDerWaalsContact C-N 3.31Å; K361-L363 PolarHBondContact O-N 3.25Å; K361-Q364 CarbonylContact O-C 3.58Å; K361-Q364 WeakPolarHBondContact O-CB 3.45Å; K361-Q364 PolarHBondContact O-N 2.99Å; K361-D365 PolarHBondContact O-N 3.2Å
362	A	72.6	Confident	71.3	Confident	14 Å²	14	87 Å²	87	12%	0.116	42%	0.421	C	S	.	.	H	α-helix	trans	-59.9	-40.7	176.7	0	0	0	0	0	112.1	F353 D358 Q364 D365 V366	F353-A362 HydrophobicContact CE1-CB 3.56Å; F353-A362 HydrophobicContact CZ-CB 3.9Å; D358-A362 WeakPolarHBondContact O-CB 3.39Å; D358-A362 PolarHBondContact O-N 2.93Å; A362-Q364 VanDerWaalsContact C-N 3.33Å; A362-Q364 PolarHBondContact O-N 3.48Å; A362-D365 PolarHBondContact O-N 3.47Å; A362-V366 VanDerWaalsContact O-CG2 3.3Å; A362-V366 WeakPolarHBondContact O-CG2 3.08Å; A362-V366 PolarHBondContact O-N 3.11Å
363	L	73.2	Confident	72	Confident	59 Å²	59	78.8 Å²	78.8	31%	0.309	39%	0.385	S	S	.	.	H	α-helix	trans	-62.8	-37.6	173.6	-73.8	168.5	0	0	0	112.7	A359 Q360 K361 D367 Q418 C421	A359-L363 WeakPolarHBondContact O-CB 3.34Å; A359-L363 VanDerWaalsContact O-CG 3.28Å; A359-L363 WeakPolarHBondContact O-CG 3.47Å; A359-L363 PolarHBondContact O-N 2.67Å; A359-L363 VanDerWaalsContact O-N 3.1Å; Q360-L363 PolarHBondContact O-N 2.91Å; K361-L363 VanDerWaalsContact C-N 3.31Å; K361-L363 PolarHBondContact O-N 3.25Å; L363-D367 PolarHBondContact O-N 3.41Å; L363-Q418 HydrophobicContact CD2-CG 3.94Å; L363-C421 HydrophobicContact CD1-CB 4.23Å; L363-C421 HydrophobicContact CD2-CB 4.12Å
364	Q	78.6	Confident	72.7	Confident	102 Å²	102	78 Å²	78	48%	0.477	38%	0.384	S	S	.	.	H	α-helix	trans	-69.3	-40.8	175	-172.2	62.4	61.9	0	0	112	Q360 K361 A362 V366 D367 N368	Q360-Q364 PolarHBondContact O-N 2.89Å; K361-Q364 CarbonylContact O-C 3.58Å; K361-Q364 WeakPolarHBondContact O-CB 3.45Å; K361-Q364 PolarHBondContact O-N 2.99Å; A362-Q364 VanDerWaalsContact C-N 3.33Å; A362-Q364 PolarHBondContact O-N 3.48Å; Q364-V366 VanDerWaalsContact C-N 3.29Å; Q364-V366 PolarHBondContact O-N 2.95Å; Q364-D367 PolarHBondContact O-N 2.99Å; Q364-N368 PolarHBondContact NE2-OD1 3.11Å; Q364-N368 WeakPolarHBondContact O-CB 3.42Å; Q364-N368 PolarHBondContact O-N 3.45Å; Q364-N368 PolarHBondContact O-ND2 3.37Å; Q364-N368 PolarHBondContact O-OD1 2.84Å
365	D	79.3	Confident	73.3	Confident	64 Å²	64	73.6 Å²	73.6	34%	0.342	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-34.8	176.6	-69.8	-30.7	0	0	0	111.4	K361 A362 F369	K361-D365 PolarHBondContact O-N 3.2Å; A362-D365 PolarHBondContact O-N 3.47Å; D365-F369 WeakPolarHBondContact O-CB 3.35Å; D365-F369 PolarHBondContact O-N 3.5Å
366	V	79.1	Confident	73.6	Confident	4 Å²	4	72.6 Å²	72.6	2%	0.024	36%	0.361	C	S	.	.	H	α-helix	trans	-66	-45.8	170.3	170.7	0	0	0	0	112.1	Q348 A362 Q364 F369 L370 F414 Q418	Q348-V366 VanDerWaalsContact NE2-CG2 3.28Å; A362-V366 VanDerWaalsContact O-CG2 3.3Å; A362-V366 WeakPolarHBondContact O-CG2 3.08Å; A362-V366 PolarHBondContact O-N 3.11Å; Q364-V366 VanDerWaalsContact C-N 3.29Å; Q364-V366 PolarHBondContact O-N 2.95Å; V366-F369 PolarHBondContact O-N 3.3Å; V366-L370 HydrophobicContact CG1-CD1 3.9Å; V366-L370 HydrophobicContact CG1-CG 4.37Å; V366-L370 WeakPolarHBondContact O-CB 3.47Å; V366-L370 WeakPolarHBondContact O-CG 3.17Å; V366-L370 PolarHBondContact O-N 3.08Å; V366-F414 HydrophobicContact CB-CD1 4.23Å; V366-F414 HydrophobicContact CG1-CB 3.7Å; V366-F414 HydrophobicContact CG1-CD1 3.67Å; V366-F414 HydrophobicContact CG1-CD2 4.47Å; V366-F414 HydrophobicContact CG1-CE1 4.42Å; V366-F414 HydrophobicContact CG1-CG 3.72Å; V366-F414 HydrophobicContact CG2-CD1 3.5Å; V366-F414 HydrophobicContact CG2-CE1 3.61Å; V366-F414 HydrophobicContact CG2-CG 4.37Å; V366-Q418 HydrophobicContact CG1-CG 4.46Å
367	D	78.5	Confident	73.6	Confident	61 Å²	61	65.7 Å²	65.7	33%	0.326	33%	0.332	S	S	.	.	H	α-helix	trans	-65.5	-42.5	179.2	-160.4	78.1	0	0	0	111.5	L363 Q364 F369 L370 Q371	L363-D367 PolarHBondContact O-N 3.41Å; Q364-D367 PolarHBondContact O-N 2.99Å; D367-F369 VanDerWaalsContact C-N 3.34Å; D367-F369 PolarHBondContact O-N 3.22Å; D367-L370 PolarHBondContact O-N 2.94Å; D367-Q371 WeakPolarHBondContact O-CG 3.27Å; D367-Q371 PolarHBondContact O-N 2.94Å; D367-Q371 PolarHBondContact OD2-NE2 3.25Å
368	N	81.5	Confident	73.5	Confident	77 Å²	77	62.9 Å²	62.9	41%	0.412	32%	0.321	S	S	.	.	H	α-helix	trans	-56.4	-46.3	172.6	-67	-16.8	0	0	0	111.6	Q364 M372	Q364-N368 PolarHBondContact NE2-OD1 3.11Å; Q364-N368 WeakPolarHBondContact O-CB 3.42Å; Q364-N368 PolarHBondContact O-N 3.45Å; Q364-N368 PolarHBondContact O-ND2 3.37Å; Q364-N368 PolarHBondContact O-OD1 2.84Å; N368-M372 WeakPolarHBondContact O-CB 3.37Å; N368-M372 PolarHBondContact O-N 2.91Å
369	F	82.8	Confident	73.3	Confident	11 Å²	11	63.5 Å²	63.5	5%	0.048	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-45.3	176.2	174.3	-94.7	0	0	0	111.8	C337 Q340 G341 L344 D365 V366 D367 Q371 M372 A373 I410 F414	C337-F369 WeakPolarHBondContact O-CE2 3.38Å; C337-F369 VanDerWaalsContact O-CZ 3.32Å; C337-F369 WeakPolarHBondContact O-CZ 2.95Å; Q340-F369 HydrophobicContact CB-CE2 4.08Å; G341-F369 VanDerWaalsContact CA-CZ 3.43Å; L344-F369 HydrophobicContact CD1-CB 3.71Å; L344-F369 HydrophobicContact CD1-CD2 3.59Å; L344-F369 HydrophobicContact CD1-CE2 4.42Å; L344-F369 HydrophobicContact CD1-CG 3.69Å; D365-F369 WeakPolarHBondContact O-CB 3.35Å; D365-F369 PolarHBondContact O-N 3.5Å; V366-F369 PolarHBondContact O-N 3.3Å; D367-F369 VanDerWaalsContact C-N 3.34Å; D367-F369 PolarHBondContact O-N 3.22Å; F369-Q371 PolarHBondContact O-N 2.98Å; F369-M372 HydrophobicContact CD2-CE 3.89Å; F369-M372 HydrophobicContact CE2-CE 3.92Å; F369-M372 PolarHBondContact O-N 3.25Å; F369-A373 HydrophobicContact CE1-CB 4.1Å; F369-A373 HydrophobicContact CZ-CB 4.2Å; F369-A373 VanDerWaalsContact O-CB 3.23Å; F369-A373 WeakPolarHBondContact O-CB 3.46Å; F369-A373 PolarHBondContact O-N 3.01Å; F369-I410 HydrophobicContact CE1-CG2 3.88Å; F369-I410 HydrophobicContact CZ-CG2 4.34Å; F369-F414 HydrophobicContact CD1-CD2 4.07Å; F369-F414 AromaticContact CD1-CE2 3.52Å; F369-F414 HydrophobicContact CD1-CE2 3.52Å; F369-F414 HydrophobicContact CD1-CZ 4.35Å; F369-F414 HydrophobicContact CE1-CD2 4.23Å; F369-F414 AromaticContact CE1-CE2 3.65Å; F369-F414 HydrophobicContact CE1-CE2 3.65Å; F369-F414 HydrophobicContact CG-CE2 4.44Å
370	L	77	Confident	73	Confident	24 Å²	24	66.2 Å²	66.2	13%	0.126	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-43.2	178.6	-72.5	171.7	0	0	0	111.4	V366 D367 M372 A373 M374 I377 R411 F414	V366-L370 HydrophobicContact CG1-CD1 3.9Å; V366-L370 HydrophobicContact CG1-CG 4.37Å; V366-L370 WeakPolarHBondContact O-CB 3.47Å; V366-L370 WeakPolarHBondContact O-CG 3.17Å; V366-L370 PolarHBondContact O-N 3.08Å; D367-L370 PolarHBondContact O-N 2.94Å; L370-M372 PolarHBondContact O-N 3.45Å; L370-A373 PolarHBondContact O-N 3.19Å; L370-M374 WeakPolarHBondContact O-CG 3.5Å; L370-M374 PolarHBondContact O-N 2.76Å; L370-I377 HydrophobicContact CD2-CD1 4.42Å; L370-R411 HydrophobicContact CD2-CG 4.16Å; L370-F414 HydrophobicContact CD1-CB 4.41Å; L370-F414 HydrophobicContact CD2-CD2 4.39Å
371	Q	78.9	Confident	72.3	Confident	129 Å²	129	64.1 Å²	64.1	60%	0.603	32%	0.322	S	S	*	.	H	α-helix	trans	-61	-41.3	174.3	-70.8	-173	39	0	0	112.3	D367 F369 A373	D367-Q371 WeakPolarHBondContact O-CG 3.27Å; D367-Q371 PolarHBondContact O-N 2.94Å; D367-Q371 PolarHBondContact OD2-NE2 3.25Å; F369-Q371 PolarHBondContact O-N 2.98Å; Q371-A373 VanDerWaalsContact C-N 3.35Å
372	M	78.4	Confident	71.5	Confident	91 Å²	91	64.9 Å²	64.9	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-67.4	-33.9	175	-173	-155.1	70.2	0	0	112.6	N368 F369 L370 P375	N368-M372 WeakPolarHBondContact O-CB 3.37Å; N368-M372 PolarHBondContact O-N 2.91Å; F369-M372 HydrophobicContact CD2-CE 3.89Å; F369-M372 HydrophobicContact CE2-CE 3.92Å; F369-M372 PolarHBondContact O-N 3.25Å; L370-M372 PolarHBondContact O-N 3.45Å; M372-P375 WeakPolarHBondContact O-CD 3.47Å
373	A	72.8	Confident	70.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-83.2	-22.9	-178.2	0	0	0	0	0	113.8	C337 F369 L370 Q371 P375 F376 I377	C337-A373 WeakPolarHBondContact SG-CB 3.48Å; F369-A373 HydrophobicContact CE1-CB 4.1Å; F369-A373 HydrophobicContact CZ-CB 4.2Å; F369-A373 VanDerWaalsContact O-CB 3.23Å; F369-A373 WeakPolarHBondContact O-CB 3.46Å; F369-A373 PolarHBondContact O-N 3.01Å; L370-A373 PolarHBondContact O-N 3.19Å; Q371-A373 VanDerWaalsContact C-N 3.35Å; A373-P375 VanDerWaalsContact C-N 3.33Å; A373-P375 VanDerWaalsContact O-N 3.14Å; A373-F376 WeakPolarHBondContact O-CA 3.32Å; A373-F376 PolarHBondContact O-N 3.45Å; A373-I377 HydrophobicContact CB-CD1 3.54Å; A373-I377 HydrophobicContact CB-CG1 4.15Å; A373-I377 WeakPolarHBondContact O-CG1 3.44Å; A373-I377 PolarHBondContact O-N 3.39Å
374	M	70.6	Confident	70.3	Confident	87 Å²	87	65.3 Å²	65.3	43%	0.429	33%	0.333	S	S	.	.	H	α-helix	trans	-45.9	-41.6	-178.6	-87.9	-82	-77.5	0	0	115.3	L370 F376 I377 N378	L370-M374 WeakPolarHBondContact O-CG 3.5Å; L370-M374 PolarHBondContact O-N 2.76Å; M374-F376 PolarHBondContact O-N 3.37Å; M374-I377 PolarHBondContact O-N 2.91Å; M374-N378 VanDerWaalsContact CE-ND2 3.33Å; M374-N378 WeakPolarHBondContact CE-ND2 3.49Å; M374-N378 PolarHBondContact O-N 3.24Å; M374-N378 PolarHBondContact SD-ND2 3.04Å
375	P	70.3	Confident	69.2	Low	81 Å²	81	63.2 Å²	63.2	53%	0.526	32%	0.324	S	S	.	.	H	α-helix	trans	-62.5	-26	176.2	-24	35.5	0	0	0	114.5	M372 A373 Y379	M372-P375 WeakPolarHBondContact O-CD 3.47Å; A373-P375 VanDerWaalsContact C-N 3.33Å; A373-P375 VanDerWaalsContact O-N 3.14Å; P375-Y379 VanDerWaalsContact O-CD2 3.23Å; P375-Y379 WeakPolarHBondContact O-CD2 3.37Å
376	F	69.6	Low	68.4	Low	43 Å²	43	70.4 Å²	70.4	19%	0.189	35%	0.347	C	S	.	.	H	α-helix	trans	-94.9	-30.7	177.7	-53.4	-77.2	0	0	0	112.3	Q333 A334 C337 A373 M374 L407	Q333-F376 HydrophobicContact CB-CE1 3.95Å; Q333-F376 HydrophobicContact CB-CZ 3.95Å; A334-F376 HydrophobicContact CB-CB 4.34Å; A334-F376 HydrophobicContact CB-CD1 3.81Å; A334-F376 HydrophobicContact CB-CE1 4.47Å; A334-F376 HydrophobicContact CB-CG 4.26Å; C337-F376 HydrophobicContact CB-CD2 4.47Å; A373-F376 WeakPolarHBondContact O-CA 3.32Å; A373-F376 PolarHBondContact O-N 3.45Å; M374-F376 PolarHBondContact O-N 3.37Å; F376-L407 HydrophobicContact CB-CD1 3.75Å
377	I	62.5	Low	67.5	Low	25 Å²	25	75.1 Å²	75.1	13%	0.128	37%	0.369	C	S	.	.	H	α-helix	trans	-71	-46	177.1	-68.5	169.5	0	0	0	111	L370 A373 M374 Y379 L407 R411	L370-I377 HydrophobicContact CD2-CD1 4.42Å; A373-I377 HydrophobicContact CB-CD1 3.54Å; A373-I377 HydrophobicContact CB-CG1 4.15Å; A373-I377 WeakPolarHBondContact O-CG1 3.44Å; A373-I377 PolarHBondContact O-N 3.39Å; M374-I377 PolarHBondContact O-N 2.91Å; I377-Y379 PolarHBondContact O-N 3.01Å; I377-L407 HydrophobicContact CG1-CB 4.23Å; I377-R411 HydrophobicContact CD1-CB 4.46Å; I377-R411 HydrophobicContact CD1-CG 4.45Å; I377-R411 VanDerWaalsContact CG2-CZ 3.41Å
378	N	61.9	Low	66.7	Low	93 Å²	93	72.8 Å²	72.8	50%	0.497	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	19.5	179.3	-66.3	-9	0	0	0	112.7	M374 D380 R411	M374-N378 VanDerWaalsContact CE-ND2 3.33Å; M374-N378 WeakPolarHBondContact CE-ND2 3.49Å; M374-N378 PolarHBondContact O-N 3.24Å; M374-N378 PolarHBondContact SD-ND2 3.04Å; N378-D380 PolarHBondContact O-N 3.47Å; N378-D380 VanDerWaalsContact O-N 3.15Å; N378-R411 PolarHBondContact OD1-NH2 3.47Å
379	Y	61.2	Low	65.7	Low	88 Å²	88	73.1 Å²	73.1	35%	0.345	36%	0.358	S	S	.	.			trans	-77.7	103.2	-178.9	-144.8	-54.2	0	0	0	109.7	P375 I377 I381 L384 Q404	P375-Y379 VanDerWaalsContact O-CD2 3.23Å; P375-Y379 WeakPolarHBondContact O-CD2 3.37Å; I377-Y379 PolarHBondContact O-N 3.01Å; Y379-I381 PolarHBondContact O-N 2.98Å; Y379-L384 HydrophobicContact CD1-CD1 3.73Å; Y379-L384 HydrophobicContact CD1-CG 4.44Å; Y379-L384 HydrophobicContact CE1-CB 4.39Å; Y379-L384 HydrophobicContact CE1-CD1 3.65Å; Y379-L384 HydrophobicContact CE1-CG 4.06Å; Y379-Q404 PolarHBondContact O-NE2 3.07Å
380	D	60.2	Low	64.6	Low	80 Å²	80	79.7 Å²	79.7	43%	0.428	40%	0.398	S	S	.	.			trans	-58.8	127.8	-174.6	174.9	31.8	0	0	0	112.7	N378 E382 S383 L384	N378-D380 PolarHBondContact O-N 3.47Å; N378-D380 VanDerWaalsContact O-N 3.15Å; D380-E382 PolarHBondContact OD1-N 3.15Å; D380-S383 WeakPolarHBondContact OD2-CB 3.32Å; D380-S383 PolarHBondContact OD2-N 3.29Å; D380-L384 WeakPolarHBondContact O-CB 3.23Å; D380-L384 PolarHBondContact O-N 2.96Å
381	I	55.9	Low	63.7	Low	75 Å²	75	80 Å²	80	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-71.5	-35.6	179.1	-65.5	172.6	0	0	0	110.7	Y379 Q385 Q404	Y379-I381 PolarHBondContact O-N 2.98Å; I381-Q385 HydrophobicContact CG2-CG 4.47Å; I381-Q385 WeakPolarHBondContact O-CB 3.33Å; I381-Q385 VanDerWaalsContact O-CG 3.29Å; I381-Q385 WeakPolarHBondContact O-CG 3.31Å; I381-Q385 PolarHBondContact O-N 3.29Å; I381-Q404 VanDerWaalsContact CG1-NE2 3.25Å
382	E	57.5	Low	63	Low	155 Å²	155	74.9 Å²	74.9	72%	0.724	38%	0.377	S	S	*	.	H	α-helix	trans	-74.2	-45.6	-175.8	-61.8	-169	167.9	0	0	110.6	D380 Q385 Y386	D380-E382 PolarHBondContact OD1-N 3.15Å; E382-Q385 PolarHBondContact O-N 2.86Å; E382-Y386 VanDerWaalsContact O-CB 3.26Å; E382-Y386 WeakPolarHBondContact O-CB 3.3Å; E382-Y386 PolarHBondContact O-N 3.27Å
383	S	59.8	Low	62.5	Low	65 Å²	65	71.9 Å²	71.9	46%	0.455	37%	0.365	S	S	.	.	H	α-helix	trans	-59.2	-44.6	171	-177.5	0	0	0	0	113	D380 Y386 E387	D380-S383 WeakPolarHBondContact OD2-CB 3.32Å; D380-S383 PolarHBondContact OD2-N 3.29Å; S383-Y386 PolarHBondContact O-N 3.4Å; S383-E387 PolarHBondContact O-N 2.96Å
384	L	59.3	Low	62.4	Low	17 Å²	17	77.2 Å²	77.2	9%	0.089	40%	0.4	C	S	.	.	H	α-helix	trans	-72.4	-33.6	-179.6	-151.3	175	0	0	0	111.9	Y379 D380 F388 M400	Y379-L384 HydrophobicContact CD1-CD1 3.73Å; Y379-L384 HydrophobicContact CD1-CG 4.44Å; Y379-L384 HydrophobicContact CE1-CB 4.39Å; Y379-L384 HydrophobicContact CE1-CD1 3.65Å; Y379-L384 HydrophobicContact CE1-CG 4.06Å; D380-L384 WeakPolarHBondContact O-CB 3.23Å; D380-L384 PolarHBondContact O-N 2.96Å; L384-F388 HydrophobicContact CD2-CB 4.47Å; L384-F388 HydrophobicContact CD2-CD2 3.67Å; L384-F388 HydrophobicContact CD2-CE2 4.23Å; L384-F388 HydrophobicContact CD2-CG 4.33Å; L384-F388 HydrophobicContact CG-CD2 4.4Å; L384-F388 WeakPolarHBondContact O-CD2 3.47Å; L384-F388 PolarHBondContact O-N 3.42Å; L384-M400 HydrophobicContact CD1-CE 3.41Å; L384-M400 VanDerWaalsContact CD1-CE 3.41Å; L384-M400 HydrophobicContact CD2-CE 3.33Å; L384-M400 HydrophobicContact CD2-SD 4.46Å; L384-M400 HydrophobicContact CG-CE 3.92Å
385	Q	56.9	Low	62.3	Low	58 Å²	58	79 Å²	79	27%	0.271	41%	0.407	S	S	.	.	H	α-helix	trans	-63.9	-50.3	166.6	-74.6	-176	54.7	0	0	110.1	I381 E382 E387 F388 D389 K397	I381-Q385 HydrophobicContact CG2-CG 4.47Å; I381-Q385 WeakPolarHBondContact O-CB 3.33Å; I381-Q385 VanDerWaalsContact O-CG 3.29Å; I381-Q385 WeakPolarHBondContact O-CG 3.31Å; I381-Q385 PolarHBondContact O-N 3.29Å; E382-Q385 PolarHBondContact O-N 2.86Å; Q385-E387 VanDerWaalsContact C-N 3.32Å; Q385-E387 PolarHBondContact O-N 3.13Å; Q385-F388 PolarHBondContact O-N 3.43Å; Q385-F388 VanDerWaalsContact O-N 3.08Å; Q385-D389 WeakPolarHBondContact O-CA 3.42Å; Q385-D389 VanDerWaalsContact O-CB 3.27Å; Q385-D389 WeakPolarHBondContact O-CB 3.31Å; Q385-D389 PolarHBondContact O-N 3.12Å; Q385-K397 VanDerWaalsContact CD-CE 3.46Å
386	Y	62.3	Low	62.4	Low	215 Å²	215	75.4 Å²	75.4	84%	0.843	38%	0.383	S	S	*	.	H	α-helix	trans	-57	-38.9	179.9	-175.6	-99.5	0	0	0	113.9	E382 S383	E382-Y386 VanDerWaalsContact O-CB 3.26Å; E382-Y386 WeakPolarHBondContact O-CB 3.3Å; E382-Y386 PolarHBondContact O-N 3.27Å; S383-Y386 PolarHBondContact O-N 3.4Å
387	E	60.6	Low	62.6	Low	103 Å²	103	76 Å²	76	48%	0.481	39%	0.386	S	S	.	.	H	α-helix	trans	-74.9	-24.3	178.3	-171.2	-177.1	-179.5	0	0	113.5	S383 Q385	S383-E387 PolarHBondContact O-N 2.96Å; Q385-E387 VanDerWaalsContact C-N 3.32Å; Q385-E387 PolarHBondContact O-N 3.13Å
388	F	60.7	Low	63.2	Low	12 Å²	12	77.2 Å²	77.2	5%	0.053	40%	0.4	C	S	.	.	H	α-helix	trans	-132.5	-2.8	-168.8	-63.2	-92	0	0	0	117.7	R323 V327 L384 Q385 V390 L391 L392	R323-F388 HydrophobicContact CB-CD1 4.3Å; R323-F388 HydrophobicContact CB-CE1 3.89Å; R323-F388 HydrophobicContact CG-CE1 4.24Å; V327-F388 HydrophobicContact CG2-CD1 3.45Å; V327-F388 VanDerWaalsContact CG2-CD1 3.45Å; V327-F388 HydrophobicContact CG2-CD2 4.35Å; V327-F388 HydrophobicContact CG2-CE1 3.39Å; V327-F388 HydrophobicContact CG2-CE2 4.28Å; V327-F388 HydrophobicContact CG2-CG 3.96Å; V327-F388 HydrophobicContact CG2-CZ 3.84Å; L384-F388 HydrophobicContact CD2-CB 4.47Å; L384-F388 HydrophobicContact CD2-CD2 3.67Å; L384-F388 HydrophobicContact CD2-CE2 4.23Å; L384-F388 HydrophobicContact CD2-CG 4.33Å; L384-F388 HydrophobicContact CG-CD2 4.4Å; L384-F388 WeakPolarHBondContact O-CD2 3.47Å; L384-F388 PolarHBondContact O-N 3.42Å; Q385-F388 PolarHBondContact O-N 3.43Å; Q385-F388 VanDerWaalsContact O-N 3.08Å; F388-V390 VanDerWaalsContact C-N 3.26Å; F388-V390 PolarHBondContact O-N 2.82Å; F388-L391 CarbonylContact O-C 3.57Å; F388-L391 WeakPolarHBondContact O-CA 3.41Å; F388-L391 WeakPolarHBondContact O-CB 3.33Å; F388-L391 PolarHBondContact O-N 3.29Å; F388-L392 HydrophobicContact CB-CD1 4.24Å; F388-L392 HydrophobicContact CB-CD2 4.09Å; F388-L392 HydrophobicContact CB-CG 3.91Å; F388-L392 PolarHBondContact O-N 3.34Å
389	D	61.3	Low	63.7	Low	84 Å²	84	76.9 Å²	76.9	45%	0.449	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-54.9	-38.3	-165.2	-144.7	34.9	0	0	0	113.9	Q385 L391 L392 K397	Q385-D389 WeakPolarHBondContact O-CA 3.42Å; Q385-D389 VanDerWaalsContact O-CB 3.27Å; Q385-D389 WeakPolarHBondContact O-CB 3.31Å; Q385-D389 PolarHBondContact O-N 3.12Å; D389-L391 PolarHBondContact O-N 3.19Å; D389-L391 VanDerWaalsContact O-N 3.13Å; D389-L392 PolarHBondContact O-N 2.82Å; D389-K397 IonicContact OD1-NZ 2.68Å; D389-K397 PolarHBondContact OD1-NZ 3.09Å; D389-K397 IonicContact OD2-NZ 3.06Å
390	V	58.5	Low	64.3	Low	148 Å²	148	73.5 Å²	73.5	90%	0.897	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-66.8	-10.2	177.9	-170.5	0	0	0	0	113.1	F388	F388-V390 VanDerWaalsContact C-N 3.26Å; F388-V390 PolarHBondContact O-N 2.82Å
391	L	58.2	Low	65	Low	32 Å²	32	74.8 Å²	74.8	17%	0.168	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-123.5	-6.9	-175.3	-58.3	175.6	0	0	0	113.9	I247 Q320 R323 F388 D389	I247-L391 HydrophobicContact CD1-CD2 3.88Å; Q320-L391 HydrophobicContact CG-CD2 4.09Å; R323-L391 HydrophobicContact CB-CD1 4.03Å; F388-L391 CarbonylContact O-C 3.57Å; F388-L391 WeakPolarHBondContact O-CA 3.41Å; F388-L391 WeakPolarHBondContact O-CB 3.33Å; F388-L391 PolarHBondContact O-N 3.29Å; D389-L391 PolarHBondContact O-N 3.19Å; D389-L391 VanDerWaalsContact O-N 3.13Å
392	L	64.4	Low	66.2	Low	20 Å²	20	75.8 Å²	75.8	11%	0.105	39%	0.392	C	S	.	.			trans	-84.6	117.1	178.9	-66.4	177.2	0	0	0	110.2	V327 F388 D389 L396 M400	V327-L392 HydrophobicContact CG1-CD2 4.13Å; F388-L392 HydrophobicContact CB-CD1 4.24Å; F388-L392 HydrophobicContact CB-CD2 4.09Å; F388-L392 HydrophobicContact CB-CG 3.91Å; F388-L392 PolarHBondContact O-N 3.34Å; D389-L392 PolarHBondContact O-N 2.82Å; L392-L396 HydrophobicContact CD2-CD2 3.91Å; L392-L396 HydrophobicContact CD2-CG 4.44Å; L392-M400 HydrophobicContact CD1-SD 4.21Å; L392-M400 HydrophobicContact CD2-SD 3.97Å
393	S	68.1	Low	67.2	Low	28 Å²	28	69.2 Å²	69.2	20%	0.196	36%	0.361	C	S	.	.			trans	-67.4	153.2	167.2	65.5	0	0	0	0	110.6	E395 L396 K397	S393-E395 PolarHBondContact O-N 3.07Å; S393-L396 PolarHBondContact O-N 2.86Å; S393-L396 WeakPolarHBondContact OG-CB 3.27Å; S393-L396 PolarHBondContact OG-N 2.74Å; S393-K397 PolarHBondContact O-N 3.21Å
394	P	70.6	Confident	67.9	Low	113 Å²	113	68 Å²	68	73%	0.734	35%	0.349	S	S	*	.	H	α-helix	trans	-54.8	-38.4	175.4	-27	35.4	0	0	0	112.6	L396 K397 A398	P394-L396 PolarHBondContact O-N 3.19Å; P394-K397 PolarHBondContact O-N 3.45Å; P394-A398 WeakPolarHBondContact O-CB 3.26Å; P394-A398 PolarHBondContact O-N 3.32Å
395	E	69.1	Low	68.9	Low	125 Å²	125	72.2 Å²	72.2	58%	0.584	37%	0.371	S	S	*	.	H	α-helix	trans	-58.2	-44.3	173.8	-173.2	61.2	-143	0	0	112.2	S393 Q399	S393-E395 PolarHBondContact O-N 3.07Å; E395-Q399 VanDerWaalsContact O-CG 3.3Å; E395-Q399 WeakPolarHBondContact O-CG 3.4Å; E395-Q399 PolarHBondContact O-N 3.1Å; E395-Q399 VanDerWaalsContact O-N 3.07Å; E395-Q399 PolarHBondContact OE1-NE2 2.88Å
396	L	71.1	Confident	70.1	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.026	37%	0.372	C	S	.	.	H	α-helix	trans	-71.2	-41.6	178.6	-159.7	63.3	0	0	0	111.2	V327 L331 L392 S393 P394 A398 Q399 M400	V327-L396 HydrophobicContact CB-CD2 4.47Å; V327-L396 HydrophobicContact CG1-CD2 3.84Å; V327-L396 HydrophobicContact CG1-CG 4.39Å; L331-L396 HydrophobicContact CD1-CD1 3.5Å; L331-L396 VanDerWaalsContact CD1-CD1 3.5Å; L331-L396 HydrophobicContact CD1-CG 3.98Å; L392-L396 HydrophobicContact CD2-CD2 3.91Å; L392-L396 HydrophobicContact CD2-CG 4.44Å; S393-L396 PolarHBondContact O-N 2.86Å; S393-L396 WeakPolarHBondContact OG-CB 3.27Å; S393-L396 PolarHBondContact OG-N 2.74Å; P394-L396 PolarHBondContact O-N 3.19Å; L396-A398 VanDerWaalsContact C-N 3.31Å; L396-A398 PolarHBondContact O-N 2.81Å; L396-Q399 PolarHBondContact O-N 2.59Å; L396-M400 VanDerWaalsContact O-CG 3.25Å; L396-M400 WeakPolarHBondContact O-CG 3.45Å; L396-M400 PolarHBondContact O-N 2.87Å
397	K	73.9	Confident	70.7	Confident	55 Å²	55	62.8 Å²	62.8	24%	0.239	33%	0.334	C	S	.	.	H	α-helix	trans	-60.8	-39	177	-160.1	160.5	-175.3	165.9	0	111.4	Q385 D389 S393 P394 Q401	Q385-K397 VanDerWaalsContact CD-CE 3.46Å; D389-K397 IonicContact OD1-NZ 2.68Å; D389-K397 PolarHBondContact OD1-NZ 3.09Å; D389-K397 IonicContact OD2-NZ 3.06Å; S393-K397 PolarHBondContact O-N 3.21Å; P394-K397 PolarHBondContact O-N 3.45Å; K397-Q401 WeakPolarHBondContact O-CG 3.34Å; K397-Q401 PolarHBondContact O-N 3.08Å
398	A	74.9	Confident	71.5	Confident	51 Å²	51	61.7 Å²	61.7	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-68	-41.8	173	0	0	0	0	0	113.3	P394 L396 M400 Q401 N402	P394-A398 WeakPolarHBondContact O-CB 3.26Å; P394-A398 PolarHBondContact O-N 3.32Å; L396-A398 VanDerWaalsContact C-N 3.31Å; L396-A398 PolarHBondContact O-N 2.81Å; A398-M400 VanDerWaalsContact C-N 3.32Å; A398-M400 PolarHBondContact O-N 2.9Å; A398-Q401 PolarHBondContact O-N 2.91Å; A398-N402 WeakPolarHBondContact O-CB 3.46Å; A398-N402 PolarHBondContact O-N 2.79Å
399	Q	72.4	Confident	72.5	Confident	85 Å²	85	65.5 Å²	65.5	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-37.6	176.5	-73.3	174.2	25.3	0	0	112.2	E395 L396 I403	E395-Q399 VanDerWaalsContact O-CG 3.3Å; E395-Q399 WeakPolarHBondContact O-CG 3.4Å; E395-Q399 PolarHBondContact O-N 3.1Å; E395-Q399 VanDerWaalsContact O-N 3.07Å; E395-Q399 PolarHBondContact OE1-NE2 2.88Å; L396-Q399 PolarHBondContact O-N 2.59Å; Q399-I403 WeakPolarHBondContact O-CG1 3.45Å; Q399-I403 PolarHBondContact O-N 2.83Å; Q399-I403 VanDerWaalsContact O-N 3.13Å
400	M	75	Confident	73.4	Confident	17 Å²	17	61.8 Å²	61.8	8%	0.084	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-52.8	173.9	-69.4	174.4	73.7	0	0	112.2	V327 L331 L384 L392 L396 A398 N402 I403 Q404	V327-M400 HydrophobicContact CG1-SD 4.42Å; L331-M400 HydrophobicContact CD1-CG 3.71Å; L331-M400 HydrophobicContact CD2-CB 4.18Å; L331-M400 HydrophobicContact CD2-CG 3.52Å; L331-M400 HydrophobicContact CG-CG 4.09Å; L384-M400 HydrophobicContact CD1-CE 3.41Å; L384-M400 VanDerWaalsContact CD1-CE 3.41Å; L384-M400 HydrophobicContact CD2-CE 3.33Å; L384-M400 HydrophobicContact CD2-SD 4.46Å; L384-M400 HydrophobicContact CG-CE 3.92Å; L392-M400 HydrophobicContact CD1-SD 4.21Å; L392-M400 HydrophobicContact CD2-SD 3.97Å; L396-M400 VanDerWaalsContact O-CG 3.25Å; L396-M400 WeakPolarHBondContact O-CG 3.45Å; L396-M400 PolarHBondContact O-N 2.87Å; A398-M400 VanDerWaalsContact C-N 3.32Å; A398-M400 PolarHBondContact O-N 2.9Å; M400-N402 VanDerWaalsContact C-N 3.29Å; M400-N402 PolarHBondContact O-N 2.88Å; M400-I403 PolarHBondContact O-N 3.36Å; M400-Q404 PolarHBondContact O-N 3Å
401	Q	75.3	Confident	74.4	Confident	108 Å²	108	57.5 Å²	57.5	51%	0.505	30%	0.297	S	S	.	.	H	α-helix	trans	-59.3	-39.3	179.4	-71.2	171.6	-22.6	0	0	112.1	K397 A398 L405	K397-Q401 WeakPolarHBondContact O-CG 3.34Å; K397-Q401 PolarHBondContact O-N 3.08Å; A398-Q401 PolarHBondContact O-N 2.91Å; Q401-L405 WeakPolarHBondContact O-CB 3.5Å; Q401-L405 PolarHBondContact O-N 2.66Å
402	N	80.8	Confident	75.4	Confident	95 Å²	95	57.9 Å²	57.9	51%	0.508	30%	0.302	S	S	.	.	H	α-helix	trans	-64.1	-43.5	176.9	-169	-83.1	0	0	0	112.5	A398 M400 L405 K406	A398-N402 WeakPolarHBondContact O-CB 3.46Å; A398-N402 PolarHBondContact O-N 2.79Å; M400-N402 VanDerWaalsContact C-N 3.29Å; M400-N402 PolarHBondContact O-N 2.88Å; N402-L405 PolarHBondContact O-N 3.36Å; N402-K406 PolarHBondContact O-N 2.9Å
403	I	78.2	Confident	76.2	Confident	17 Å²	17	58.5 Å²	58.5	9%	0.087	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-40.6	178.8	-72.2	166.2	0	0	0	111.1	L331 A334 R335 Q399 M400 K406 L407	L331-I403 HydrophobicContact CB-CD1 4.44Å; L331-I403 HydrophobicContact CD2-CD1 3.76Å; A334-I403 HydrophobicContact CB-CG2 3.68Å; R335-I403 HydrophobicContact CB-CD1 4.08Å; Q399-I403 WeakPolarHBondContact O-CG1 3.45Å; Q399-I403 PolarHBondContact O-N 2.83Å; Q399-I403 VanDerWaalsContact O-N 3.13Å; M400-I403 PolarHBondContact O-N 3.36Å; I403-K406 WeakPolarHBondContact O-CB 3.24Å; I403-K406 PolarHBondContact O-N 3.02Å; I403-L407 HydrophobicContact CG2-CD1 4.37Å; I403-L407 WeakPolarHBondContact O-CG 3.43Å; I403-L407 PolarHBondContact O-N 2.9Å
404	Q	74.4	Confident	76.6	Confident	39 Å²	39	57.1 Å²	57.1	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-66	-41.8	176.3	-72.5	173.9	-54.8	0	0	112.2	Y379 I381 M400 K406 L407 E408	Y379-Q404 PolarHBondContact O-NE2 3.07Å; I381-Q404 VanDerWaalsContact CG1-NE2 3.25Å; M400-Q404 PolarHBondContact O-N 3Å; Q404-K406 VanDerWaalsContact C-N 3.32Å; Q404-K406 PolarHBondContact O-N 3.28Å; Q404-L407 PolarHBondContact O-N 2.77Å; Q404-E408 PolarHBondContact O-N 2.65Å
405	L	80.8	Confident	76.9	Confident	107 Å²	107	56.2 Å²	56.2	56%	0.56	29%	0.287	S	S	*	.	H	α-helix	trans	-61.6	-39.3	173.3	-178.2	61.7	0	0	0	112	Q401 N402 N409	Q401-L405 WeakPolarHBondContact O-CB 3.5Å; Q401-L405 PolarHBondContact O-N 2.66Å; N402-L405 PolarHBondContact O-N 3.36Å; L405-N409 WeakPolarHBondContact O-CB 3.5Å; L405-N409 PolarHBondContact O-N 2.83Å; L405-N409 PolarHBondContact O-ND2 3.48Å
406	K	80.6	Confident	77.1	Confident	69 Å²	69	55.8 Å²	55.8	30%	0.3	29%	0.289	S	S	.	.	H	α-helix	trans	-60.9	-49	171.7	-91.9	171.9	160.3	-87.2	0	112.1	C338 E342 N402 I403 Q404 E408 N409 I410	C338-K406 HydrophobicContact CB-CB 4.49Å; E342-K406 VanDerWaalsContact CD-NZ 3.25Å; E342-K406 IonicContact OE1-NZ 3.87Å; E342-K406 PolarHBondContact OE1-NZ 2.92Å; E342-K406 IonicContact OE2-NZ 3.86Å; E342-K406 PolarHBondContact OE2-NZ 3.34Å; E342-K406 VanDerWaalsContact OE2-NZ 3.1Å; N402-K406 PolarHBondContact O-N 2.9Å; I403-K406 WeakPolarHBondContact O-CB 3.24Å; I403-K406 PolarHBondContact O-N 3.02Å; Q404-K406 VanDerWaalsContact C-N 3.32Å; Q404-K406 PolarHBondContact O-N 3.28Å; K406-E408 PolarHBondContact O-N 2.96Å; K406-N409 PolarHBondContact O-N 3.49Å; K406-I410 WeakPolarHBondContact O-CB 3.41Å; K406-I410 WeakPolarHBondContact O-CD1 3.34Å; K406-I410 VanDerWaalsContact O-CG1 3.23Å; K406-I410 WeakPolarHBondContact O-CG1 3.2Å; K406-I410 PolarHBondContact O-N 2.95Å
407	L	76.7	Confident	77.1	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-43.7	179.3	-73.8	174.5	0	0	0	112.5	C337 C338 F376 I377 I403 Q404 I410 R411	C337-L407 HydrophobicContact CB-CD2 4.49Å; C338-L407 VanDerWaalsContact SG-CD2 3.58Å; F376-L407 HydrophobicContact CB-CD1 3.75Å; I377-L407 HydrophobicContact CG1-CB 4.23Å; I403-L407 HydrophobicContact CG2-CD1 4.37Å; I403-L407 WeakPolarHBondContact O-CG 3.43Å; I403-L407 PolarHBondContact O-N 2.9Å; Q404-L407 PolarHBondContact O-N 2.77Å; L407-I410 PolarHBondContact O-N 2.91Å; L407-R411 WeakPolarHBondContact O-CB 3.36Å; L407-R411 PolarHBondContact O-N 3.19Å
408	E	77.4	Confident	76.8	Confident	79 Å²	79	57.8 Å²	57.8	37%	0.369	30%	0.299	S	S	.	.	H	α-helix	trans	-73.2	-32.5	179.7	-165.8	60.1	-154.5	0	0	112.5	Q404 K406 R411 S412	Q404-E408 PolarHBondContact O-N 2.65Å; K406-E408 PolarHBondContact O-N 2.96Å; E408-R411 PolarHBondContact O-N 2.88Å; E408-R411 VanDerWaalsContact OE1-CD 3.31Å; E408-R411 WeakPolarHBondContact OE1-CD 3.48Å; E408-R411 IonicContact OE1-NH1 3.31Å; E408-R411 PolarHBondContact OE1-NH1 2.83Å; E408-R411 WeakPolarHBondContact OE2-CD 3.24Å; E408-R411 IonicContact OE2-CZ 3.69Å; E408-R411 IonicContact OE2-NE 2.69Å; E408-R411 IonicContact OE2-NH1 2.76Å; E408-R411 PolarHBondContact OE2-NH1 3.15Å; E408-S412 WeakPolarHBondContact O-CB 3.41Å; E408-S412 PolarHBondContact O-N 3.37Å; E408-S412 PolarHBondContact O-OG 3.35Å
409	N	81.8	Confident	76.4	Confident	92 Å²	92	58 Å²	58	49%	0.492	30%	0.3	S	S	.	.	H	α-helix	trans	-64.1	-42	170	-73.5	-20.4	0	0	0	111.8	L405 K406 S412 A413	L405-N409 WeakPolarHBondContact O-CB 3.5Å; L405-N409 PolarHBondContact O-N 2.83Å; L405-N409 PolarHBondContact O-ND2 3.48Å; K406-N409 PolarHBondContact O-N 3.49Å; N409-S412 PolarHBondContact O-OG 3.06Å; N409-S412 VanDerWaalsContact O-OG 3.09Å; N409-A413 WeakPolarHBondContact O-CB 3.35Å; N409-A413 PolarHBondContact O-N 3.49Å
410	I	80.2	Confident	75.8	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.036	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-44.9	175.3	-68.9	163.3	0	0	0	110.4	C338 E342 L345 F369 K406 L407 A413 F414	C338-I410 HydrophobicContact CB-CD1 4.04Å; E342-I410 HydrophobicContact CG-CD1 4.01Å; E342-I410 HydrophobicContact CG-CG1 4.32Å; L345-I410 HydrophobicContact CD1-CB 4.37Å; L345-I410 HydrophobicContact CD1-CG1 4.17Å; L345-I410 HydrophobicContact CD1-CG2 4.13Å; F369-I410 HydrophobicContact CE1-CG2 3.88Å; F369-I410 HydrophobicContact CZ-CG2 4.34Å; K406-I410 WeakPolarHBondContact O-CB 3.41Å; K406-I410 WeakPolarHBondContact O-CD1 3.34Å; K406-I410 VanDerWaalsContact O-CG1 3.23Å; K406-I410 WeakPolarHBondContact O-CG1 3.2Å; K406-I410 PolarHBondContact O-N 2.95Å; L407-I410 PolarHBondContact O-N 2.91Å; I410-A413 PolarHBondContact O-N 2.98Å; I410-F414 HydrophobicContact CG2-CD2 3.71Å; I410-F414 HydrophobicContact CG2-CE2 3.43Å; I410-F414 VanDerWaalsContact CG2-CE2 3.43Å; I410-F414 HydrophobicContact CG2-CZ 4.48Å; I410-F414 VanDerWaalsContact O-CD2 3.27Å; I410-F414 WeakPolarHBondContact O-CD2 3.28Å; I410-F414 PolarHBondContact O-N 3.24Å
411	R	77.8	Confident	75	Confident	58 Å²	58	56.3 Å²	56.3	22%	0.219	30%	0.304	C	S	.	.	H	α-helix	trans	-58.8	-49	177	-173.4	-159.4	-161.9	165.7	9.8	111.9	L370 I377 N378 L407 E408 F414 Q415	L370-R411 HydrophobicContact CD2-CG 4.16Å; I377-R411 HydrophobicContact CD1-CB 4.46Å; I377-R411 HydrophobicContact CD1-CG 4.45Å; I377-R411 VanDerWaalsContact CG2-CZ 3.41Å; N378-R411 PolarHBondContact OD1-NH2 3.47Å; L407-R411 WeakPolarHBondContact O-CB 3.36Å; L407-R411 PolarHBondContact O-N 3.19Å; E408-R411 PolarHBondContact O-N 2.88Å; E408-R411 VanDerWaalsContact OE1-CD 3.31Å; E408-R411 WeakPolarHBondContact OE1-CD 3.48Å; E408-R411 IonicContact OE1-NH1 3.31Å; E408-R411 PolarHBondContact OE1-NH1 2.83Å; E408-R411 WeakPolarHBondContact OE2-CD 3.24Å; E408-R411 IonicContact OE2-CZ 3.69Å; E408-R411 IonicContact OE2-NE 2.69Å; E408-R411 IonicContact OE2-NH1 2.76Å; E408-R411 PolarHBondContact OE2-NH1 3.15Å; R411-F414 PolarHBondContact O-N 3.44Å; R411-Q415 WeakPolarHBondContact O-CB 3.48Å; R411-Q415 VanDerWaalsContact O-CG 3.31Å; R411-Q415 WeakPolarHBondContact O-CG 3.43Å; R411-Q415 PolarHBondContact O-N 2.82Å
412	S	79.5	Confident	74	Confident	39 Å²	39	57.2 Å²	57.2	27%	0.273	31%	0.306	S	S	.	.	H	α-helix	trans	-68.1	-35.8	179.6	55.8	0	0	0	0	112.3	E408 N409 Q415 N416	E408-S412 WeakPolarHBondContact O-CB 3.41Å; E408-S412 PolarHBondContact O-N 3.37Å; E408-S412 PolarHBondContact O-OG 3.35Å; N409-S412 PolarHBondContact O-OG 3.06Å; N409-S412 VanDerWaalsContact O-OG 3.09Å; S412-Q415 PolarHBondContact O-N 3.41Å; S412-N416 WeakPolarHBondContact O-CB 3.47Å; S412-N416 PolarHBondContact O-N 2.8Å; S412-N416 PolarHBondContact O-ND2 2.69Å
413	A	80.8	Confident	72.5	Confident	33 Å²	33	56.2 Å²	56.2	27%	0.273	31%	0.307	S	S	.	.	H	α-helix	trans	-58.8	-49.1	170.5	0	0	0	0	0	111.8	L345 N409 I410 N416 Q417	L345-A413 HydrophobicContact CD1-CB 4.05Å; L345-A413 HydrophobicContact CD2-CB 3.86Å; N409-A413 WeakPolarHBondContact O-CB 3.35Å; N409-A413 PolarHBondContact O-N 3.49Å; I410-A413 PolarHBondContact O-N 2.98Å; A413-N416 PolarHBondContact O-N 2.71Å; A413-Q417 WeakPolarHBondContact O-CG 3.41Å; A413-Q417 PolarHBondContact O-N 3.05Å
414	F	77.9	Confident	71	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.2	-39.5	175.9	-75.9	-48.9	0	0	0	113.1	L344 L345 V366 F369 L370 I410 R411 Q417 Q418	L344-F414 HydrophobicContact CB-CE1 4.44Å; L344-F414 HydrophobicContact CB-CZ 3.81Å; L345-F414 HydrophobicContact CD2-CD1 3.62Å; L345-F414 HydrophobicContact CD2-CE1 3.42Å; L345-F414 VanDerWaalsContact CD2-CE1 3.42Å; L345-F414 HydrophobicContact CD2-CE2 4.4Å; L345-F414 HydrophobicContact CD2-CG 4.18Å; L345-F414 HydrophobicContact CD2-CZ 3.86Å; L345-F414 HydrophobicContact CG-CD1 4.32Å; L345-F414 HydrophobicContact CG-CE1 3.71Å; L345-F414 HydrophobicContact CG-CE2 4.16Å; L345-F414 HydrophobicContact CG-CZ 3.63Å; V366-F414 HydrophobicContact CB-CD1 4.23Å; V366-F414 HydrophobicContact CG1-CB 3.7Å; V366-F414 HydrophobicContact CG1-CD1 3.67Å; V366-F414 HydrophobicContact CG1-CD2 4.47Å; V366-F414 HydrophobicContact CG1-CE1 4.42Å; V366-F414 HydrophobicContact CG1-CG 3.72Å; V366-F414 HydrophobicContact CG2-CD1 3.5Å; V366-F414 HydrophobicContact CG2-CE1 3.61Å; V366-F414 HydrophobicContact CG2-CG 4.37Å; F369-F414 HydrophobicContact CD1-CD2 4.07Å; F369-F414 AromaticContact CD1-CE2 3.52Å; F369-F414 HydrophobicContact CD1-CE2 3.52Å; F369-F414 HydrophobicContact CD1-CZ 4.35Å; F369-F414 HydrophobicContact CE1-CD2 4.23Å; F369-F414 AromaticContact CE1-CE2 3.65Å; F369-F414 HydrophobicContact CE1-CE2 3.65Å; F369-F414 HydrophobicContact CG-CE2 4.44Å; L370-F414 HydrophobicContact CD1-CB 4.41Å; L370-F414 HydrophobicContact CD2-CD2 4.39Å; I410-F414 HydrophobicContact CG2-CD2 3.71Å; I410-F414 HydrophobicContact CG2-CE2 3.43Å; I410-F414 VanDerWaalsContact CG2-CE2 3.43Å; I410-F414 HydrophobicContact CG2-CZ 4.48Å; I410-F414 VanDerWaalsContact O-CD2 3.27Å; I410-F414 WeakPolarHBondContact O-CD2 3.28Å; I410-F414 PolarHBondContact O-N 3.24Å; R411-F414 PolarHBondContact O-N 3.44Å; F414-Q417 VanDerWaalsContact CD1-OE1 3.28Å; F414-Q417 PolarHBondContact O-N 3.42Å; F414-Q418 WeakPolarHBondContact O-CG 3.43Å; F414-Q418 PolarHBondContact O-N 3Å
415	Q	76.2	Confident	69.5	Low	93 Å²	93	68.7 Å²	68.7	44%	0.435	37%	0.366	S	S	.	.	H	α-helix	trans	-63	-40.8	175.1	-75.3	172.7	-10.6	0	0	112	R411 S412 Q418 A419	R411-Q415 WeakPolarHBondContact O-CB 3.48Å; R411-Q415 VanDerWaalsContact O-CG 3.31Å; R411-Q415 WeakPolarHBondContact O-CG 3.43Å; R411-Q415 PolarHBondContact O-N 2.82Å; S412-Q415 PolarHBondContact O-N 3.41Å; Q415-Q418 PolarHBondContact O-N 2.65Å; Q415-A419 WeakPolarHBondContact O-CB 3.5Å; Q415-A419 PolarHBondContact O-N 3.46Å
416	N	73.8	Confident	67.6	Low	117 Å²	117	71.8 Å²	71.8	63%	0.626	38%	0.377	S	S	*	.	H	α-helix	trans	-67	-39.7	175.7	-72.6	-34.9	0	0	0	112.1	S412 A413 A419 G420	S412-N416 WeakPolarHBondContact O-CB 3.47Å; S412-N416 PolarHBondContact O-N 2.8Å; S412-N416 PolarHBondContact O-ND2 2.69Å; A413-N416 PolarHBondContact O-N 2.71Å; N416-A419 PolarHBondContact O-N 2.92Å; N416-G420 PolarHBondContact O-N 3.05Å
417	Q	70	Confident	65.5	Low	68 Å²	68	74.2 Å²	74.2	32%	0.318	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-45.3	171.3	-74.7	173.8	-42.8	0	0	111.6	L345 A413 F414 A419 G420 C421	L345-Q417 VanDerWaalsContact CD2-OE1 3.29Å; A413-Q417 WeakPolarHBondContact O-CG 3.41Å; A413-Q417 PolarHBondContact O-N 3.05Å; F414-Q417 VanDerWaalsContact CD1-OE1 3.28Å; F414-Q417 PolarHBondContact O-N 3.42Å; Q417-A419 VanDerWaalsContact C-N 3.28Å; Q417-A419 PolarHBondContact O-N 3.41Å; Q417-G420 PolarHBondContact O-N 3.08Å; Q417-C421 PolarHBondContact O-N 3.25Å
418	Q	68.9	Low	63.4	Low	34 Å²	34	79.8 Å²	79.8	16%	0.159	43%	0.434	C	S	.	.	H	α-helix	trans	-59.8	-37.2	174	-74.6	-164	10.1	0	0	112.3	L363 V366 F414 Q415 K422	L363-Q418 HydrophobicContact CD2-CG 3.94Å; V366-Q418 HydrophobicContact CG1-CG 4.46Å; F414-Q418 WeakPolarHBondContact O-CG 3.43Å; F414-Q418 PolarHBondContact O-N 3Å; Q415-Q418 PolarHBondContact O-N 2.65Å; Q418-K422 WeakPolarHBondContact O-CB 3.26Å; Q418-K422 VanDerWaalsContact O-CD 3.26Å; Q418-K422 WeakPolarHBondContact O-CD 3.47Å; Q418-K422 WeakPolarHBondContact O-CG 3.28Å; Q418-K422 PolarHBondContact O-N 3.41Å; Q418-K422 VanDerWaalsContact O-N 3.07Å
419	A	65.7	Low	61.2	Low	54 Å²	54	85.7 Å²	85.7	45%	0.446	46%	0.462	S	S	.	.	H	α-helix	trans	-67.2	-44.8	176	0	0	0	0	0	111.8	Q415 N416 Q417 K422 S423	Q415-A419 WeakPolarHBondContact O-CB 3.5Å; Q415-A419 PolarHBondContact O-N 3.46Å; N416-A419 PolarHBondContact O-N 2.92Å; Q417-A419 VanDerWaalsContact C-N 3.28Å; Q417-A419 PolarHBondContact O-N 3.41Å; A419-K422 WeakPolarHBondContact O-CB 3.5Å; A419-K422 PolarHBondContact O-N 3.03Å; A419-K422 VanDerWaalsContact O-N 3.09Å; A419-S423 PolarHBondContact O-N 3.22Å
420	G	60.5	Low	58.8	Low	32 Å²	32	84.8 Å²	84.8	33%	0.33	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-40.3	174.9	0	0	0	0	0	113.6	N416 Q417 K422 S423 L424	N416-G420 PolarHBondContact O-N 3.05Å; Q417-G420 PolarHBondContact O-N 3.08Å; G420-K422 PolarHBondContact O-N 2.91Å; G420-S423 PolarHBondContact O-N 3.32Å; G420-S423 PolarHBondContact O-OG 3.5Å; G420-S423 VanDerWaalsContact O-OG 3.08Å; G420-L424 WeakPolarHBondContact O-CG 3.33Å; G420-L424 PolarHBondContact O-N 2.96Å
421	C	56.9	Low	56.2	Low	35 Å²	35	89.3 Å²	89.3	24%	0.236	51%	0.513	C	S	.	.	H	α-helix	trans	-70.3	-19.2	173	-70.7	0	0	0	0	113.5	L363 Q417	L363-C421 HydrophobicContact CD1-CB 4.23Å; L363-C421 HydrophobicContact CD2-CB 4.12Å; Q417-C421 PolarHBondContact O-N 3.25Å
422	K	56.1	Low	53.9	Low	127 Å²	127	96 Å²	96	55%	0.552	54%	0.544	S	S	*	.	H	α-helix	trans	-80.5	-41	171.8	-74.7	161.3	-169.1	165.1	0	111.3	Q418 A419 G420 K425	Q418-K422 WeakPolarHBondContact O-CB 3.26Å; Q418-K422 VanDerWaalsContact O-CD 3.26Å; Q418-K422 WeakPolarHBondContact O-CD 3.47Å; Q418-K422 WeakPolarHBondContact O-CG 3.28Å; Q418-K422 PolarHBondContact O-N 3.41Å; Q418-K422 VanDerWaalsContact O-N 3.07Å; A419-K422 WeakPolarHBondContact O-CB 3.5Å; A419-K422 PolarHBondContact O-N 3.03Å; A419-K422 VanDerWaalsContact O-N 3.09Å; G420-K422 PolarHBondContact O-N 2.91Å; K422-K425 PolarHBondContact O-N 3.15Å
423	S	49.2	Very low	51.6	Low	74 Å²	74	102.2 Å²	102.2	52%	0.517	57%	0.569	S	S	.	*	H	α-helix	trans	-71.4	-26.7	176.2	59.7	0	0	0	0	113.8	A419 G420 K425 E426	A419-S423 PolarHBondContact O-N 3.22Å; G420-S423 PolarHBondContact O-N 3.32Å; G420-S423 PolarHBondContact O-OG 3.5Å; G420-S423 VanDerWaalsContact O-OG 3.08Å; S423-K425 PolarHBondContact O-N 3.24Å; S423-E426 PolarHBondContact O-N 2.86Å
424	L	45.6	Very low	49.2	Very low	140 Å²	140	106.9 Å²	106.9	73%	0.733	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-0.6	171	-81.9	168.1	0	0	0	114.9	G420	G420-L424 WeakPolarHBondContact O-CG 3.33Å; G420-L424 PolarHBondContact O-N 2.96Å
425	K	43.6	Very low	46.6	Very low	178 Å²	178	115.1 Å²	115.1	77%	0.774	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-8.2	170.1	-69.5	-177.6	174.9	178.9	0	114.3	K422 S423	K422-K425 PolarHBondContact O-N 3.15Å; S423-K425 PolarHBondContact O-N 3.24Å
426	E	40.6	Very low	44.3	Very low	172 Å²	172	116.4 Å²	116.4	80%	0.804	65%	0.646	S	S	*	*	S	Bend	trans	-130.4	54.7	-169.4	-63.3	-171.1	158.2	0	0	113.7	S423	S423-E426 PolarHBondContact O-N 2.86Å
427	V	36.6	Very low	43.1	Very low	121 Å²	121	116.5 Å²	116.5	73%	0.733	65%	0.653	S	S	*	*			trans	-136.8	118	166.5	-173	0	0	0	0	110.4
428	P	33.1	Very low	40.9	Very low	123 Å²	123	117.7 Å²	117.7	80%	0.799	68%	0.675	S	S	*	*			trans	-69.5	161.3	172.6	-20.7	34.2	0	0	0	113.8
429	E	30.9	Very low	38.9	Very low	202 Å²	202	121.8 Å²	121.8	94%	0.944	71%	0.707	S	S	*	*			trans	-73.8	144.3	-174.2	-58.2	175.5	120.8	0	0	114
430	G	30.1	Very low	37.1	Very low	74 Å²	74	127 Å²	127	76%	0.763	72%	0.723	S	S	*	*			trans	111.7	89.5	146.4	0	0	0	0	0	118.8
431	A	27.3	Very low	35.7	Very low	102 Å²	102	132.1 Å²	132.1	84%	0.843	74%	0.742	S	S	*	*			trans	-164.6	129.2	137	0	0	0	0	0	110.8
432	F	29.7	Very low	34.2	Very low	197 Å²	197	135.8 Å²	135.8	86%	0.864	76%	0.763	S	S	*	*			trans	-105.2	146.7	172.3	-67.6	-107.3	0	0	0	109.8
433	Q	30.4	Very low	32.8	Very low	170 Å²	170	137.1 Å²	137.1	79%	0.794	77%	0.773	S	S	*	*				167.4	129.9	108	-88.7	-175.4	11.3	0	0	114.9
434	N	29.6	Very low	31.7	Very low	131 Å²	131	143.3 Å²	143.3	70%	0.701	79%	0.785	S	S	*	*			trans	38.3	126.9	130.6	-51	-14.8	0	0	0	122.1
435	L	24.3	Very low	30.8	Very low	173 Å²	173	140.9 Å²	140.9	91%	0.906	78%	0.78	S	S	*	*				-156.8	157.8	120.8	-110	156.9	0	0	0	111.8
436	V	26.6	Very low	30	Very low	121 Å²	121	143 Å²	143	73%	0.733	78%	0.783	S	S	*	*			trans	-157.4	157.6	-159.3	174.6	0	0	0	0	107.8
437	P	48.7	Very low	29.3	Very low	119 Å²	119	142.9 Å²	142.9	77%	0.773	78%	0.784	S	S	*	*			cis	-118.8	-162.6	-24.1	38.6	-22.6	0	0	0	111.5
438	A	24.1	Very low	28.8	Very low	93 Å²	93	144.6 Å²	144.6	77%	0.769	79%	0.788	S	S	*	*				168.9	151.3	115.2	0	0	0	0	0	116.3
439	S	28.2	Very low	28.4	Very low	120 Å²	120	146.6 Å²	146.6	84%	0.839	78%	0.784	S	S	*	*			trans	78.8	150	156.1	-153.3	0	0	0	0	120.7
440	E	26.4	Very low	28.1	Very low	164 Å²	164	146.3 Å²	146.3	77%	0.766	78%	0.78	S	S	*	*			trans	-118.8	-173.1	-170.9	-54.5	171	108.3	0	0	112.4
441	N	30.7	Very low	27.9	Very low	138 Å²	138	148 Å²	148	74%	0.738	78%	0.78	S	S	*	*			trans	89.8	146	159.2	-62.8	-60.9	0	0	0	119.8
442	V	27	Very low	28.5	Very low	112 Å²	112	147.9 Å²	147.9	68%	0.679	77%	0.771	S	S	*	*			cis	-168.9	155.8	-35.9	111.6	0	0	0	0	110.3
443	M	26.2	Very low	28.3	Very low	155 Å²	155	147.6 Å²	147.6	76%	0.764	77%	0.77	S	S	*	*			trans	66.4	168.1	165.4	-104.3	37.5	156.7	0	0	119.5
444	R	26.4	Very low	28	Very low	204 Å²	204	148 Å²	148	77%	0.77	77%	0.771	S	S	*	*				-172.6	161.2	-61.2	-150.2	176.9	-173.3	167.6	3.6	110.1
445	S	26.8	Very low	27.8	Very low	89 Å²	89	147.8 Å²	147.8	62%	0.622	77%	0.774	S	S	*	*			trans	72.2	156.5	153.5	-65.9	0	0	0	0	117.6
446	R	25.6	Very low	27.7	Very low	224 Å²	224	148.3 Å²	148.3	85%	0.845	77%	0.769	S	S	*	*			cis	-161.1	160.9	-8.8	-120	172.6	-178.2	169.5	-1.2	110.8
447	M	26.3	Very low	27.5	Very low	168 Å²	168	151.5 Å²	151.5	83%	0.828	77%	0.773	S	S	*	*			trans	-84.7	161	152.4	-80.1	-172	171.2	0	0	111.2
448	I	26.1	Very low	26.2	Very low	157 Å²	157	150.1 Å²	150.1	81%	0.805	77%	0.766	S	S	*	*			trans	-172.9	164	130.7	-98.1	156.8	0	0	0	111.8
449	F	25.8	Very low	26.1	Very low	166 Å²	166	156.4 Å²	156.4	73%	0.728	77%	0.77	S	S	*	*			trans	-87.3	167	-167.2	-81.4	-124	0	0	0	116.6
450	F	24.2	Very low	25.9	Very low	196 Å²	196	160.8 Å²	160.8	86%	0.86	77%	0.768	S	S	*	*			trans	133.3	168.1	131.8	-73.1	-64.2	0	0	0	117.8
451	S	24.9	Very low	25.9	Very low	109 Å²	109	158.9 Å²	158.9	76%	0.762	76%	0.759	S	S	*	*			trans	-147.7	-171.9	-165.5	-139	0	0	0	0	109
452	P	41.3	Very low	25.7	Very low	100 Å²	100	160.2 Å²	160.2	65%	0.649	77%	0.765	S	S	*	*			cis	-137.5	-170.3	-17.8	28.4	-3.9	0	0	0	114.7
453	K	24	Very low	25.5	Very low	191 Å²	191	164.7 Å²	164.7	83%	0.83	77%	0.77	S	S	*	*			trans	118.1	157.9	148.8	-63.6	179.5	179.2	176.8	0	120.6
454	H	25.1	Very low	25.4	Very low	178 Å²	178	161 Å²	161	82%	0.824	76%	0.764	S	S	*	*			trans	-73.1	174.5	-164.4	-45.8	-88	0	0	0	116.5
455	V	24.2	Very low	25.4	Very low	127 Å²	127	159.1 Å²	159.1	77%	0.77	76%	0.763	S	S	*	*				-172.7	127.6	75.2	161.2	0	0	0	0	115.5
456	K	22.1	Very low	25.3	Very low	184 Å²	184	160.5 Å²	160.5	80%	0.8	77%	0.773	S	S	*	*			trans	49.4	143.4	142.4	-66.1	178.2	178	171.9	0	127
457	K	23.7	Very low	25.2	Very low	188 Å²	188	157 Å²	157	82%	0.817	77%	0.771	S	S	*	*			trans	78.3	129.3	153.3	-71.3	165	178.3	-175.3	0	117.5
458	S	20.6	Very low	25.2	Very low	89 Å²	89	156.3 Å²	156.3	62%	0.622	78%	0.776	S	S	*	*			cis	91.7	126.1	43	-161.6	0	0	0	0	112.2
459	W	21.7	Very low	25.1	Very low	225 Å²	225	156.5 Å²	156.5	85%	0.852	77%	0.771	S	S	*	*				-167.1	171.2	58.1	-85.9	94.9	0	0	0	115.3
460	R	24.7	Very low	25	Very low	213 Å²	213	154.8 Å²	154.8	80%	0.804	77%	0.774	S	S	*	*			trans	90.8	158.5	150.9	-56.9	-159.2	-165.8	-112.5	4.9	120.4
461	Q	26.4	Very low	25	Very low	123 Å²	123	152.6 Å²	152.6	58%	0.575	77%	0.767	S	S	*	*			cis	180	123.5	-34.1	178.6	171.5	13.2	0	0	112.6
462	I	26.7	Very low	25	Very low	166 Å²	166	152.1 Å²	152.1	85%	0.851	77%	0.769	S	S	*	*			trans	-150.4	112.7	161.7	-64.1	-176.1	0	0	0	105
463	R	23.2	Very low	24.2	Very low	207 Å²	207	153.4 Å²	153.4	78%	0.781	78%	0.775	S	S	*	*				60.7	137.9	55.4	-84.8	-160.8	171.9	179.9	-1.2	114.6
464	A	24.7	Very low	24.4	Very low	78 Å²	78	153.6 Å²	153.6	65%	0.645	78%	0.779	S	S	*	*			cis	-171	-178.8	-16.4	0	0	0	0	0	106.8
465	Q	25.1	Very low	24.2	Very low	163 Å²	163	152.4 Å²	152.4	76%	0.762	78%	0.779	S	S	*	*			cis	-165.9	144.3	-4.5	-143.4	162.8	-100.9	0	0	109.3
466	S	24.7	Very low	24.2	Very low	119 Å²	119	151.1 Å²	151.1	83%	0.832	78%	0.775	S	S	*	*			trans	-166.4	145.4	152.1	50.8	0	0	0	0	112.3
467	N	23.4	Very low	24.4	Very low	150 Å²	150	150.7 Å²	150.7	80%	0.802	78%	0.776	S	S	*	*			trans	-127.3	152.5	-179.1	-63.7	-29.7	0	0	0	110.2
468	V	26.3	Very low	24.5	Very low	154 Å²	154	148.8 Å²	148.8	93%	0.933	77%	0.77	S	S	*	*			trans	-131.3	149.2	143.3	-177.9	0	0	0	0	107.4
469	K	23.5	Very low	25.1	Very low	160 Å²	160	151.4 Å²	151.4	70%	0.696	77%	0.77	S	S	*	*			trans	-114.8	150.8	-162.8	-173	-164.4	162.7	-151.2	0	110.9	E471	K469-E471 IonicContact NZ-OE1 2.64Å; K469-E471 PolarHBondContact NZ-OE1 3.48Å
470	V	25.3	Very low	25.4	Very low	130 Å²	130	147.8 Å²	147.8	79%	0.788	77%	0.768	S	S	*	*			trans	-80.9	138.5	167.7	175.1	0	0	0	0	109.6
471	E	23.3	Very low	25.5	Very low	151 Å²	151	143.7 Å²	143.7	71%	0.706	77%	0.771	S	S	*	*			trans	-126.4	145.4	160.8	-72.3	-174.7	164.4	0	0	110.4	K469	K469-E471 IonicContact NZ-OE1 2.64Å; K469-E471 PolarHBondContact NZ-OE1 3.48Å
472	A	24.4	Very low	25.8	Very low	98 Å²	98	144.9 Å²	144.9	81%	0.81	78%	0.782	S	S	*	*			trans	-130	143.2	172.4	0	0	0	0	0	106.4
473	V	24.7	Very low	26.1	Very low	128 Å²	128	146 Å²	146	78%	0.776	78%	0.784	S	S	*	*			trans	-131	110.8	-177.7	-179.4	0	0	0	0	108.4
474	E	27.8	Very low	26.5	Very low	194 Å²	194	140.2 Å²	140.2	91%	0.907	78%	0.775	S	S	*	*			trans	-94.6	139.8	145.7	-65.9	-179.8	129.4	0	0	106.5
475	D	22	Very low	27.4	Very low	154 Å²	154	140 Å²	140	82%	0.824	77%	0.766	S	S	*	*			trans	-152	166.6	156.6	-149.2	-16.1	0	0	0	109.5
476	S	23.3	Very low	28.4	Very low	99 Å²	99	140.8 Å²	140.8	69%	0.692	77%	0.767	S	S	*	*			trans	-145.7	146.1	-163.9	-72.6	0	0	0	0	116
477	Q	26.1	Very low	29.3	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	77%	0.767	S	S	*	*			trans	90.5	154.2	144.8	-151.6	170.7	-0.1	0	0	119.7
478	E	27	Very low	30.7	Very low	148 Å²	148	139.4 Å²	139.4	69%	0.692	75%	0.75	S	S	*	*			trans	91.4	135.1	169.9	-54	-139.1	143.3	0	0	118.8
479	K	31.9	Very low	32.2	Very low	145 Å²	145	136 Å²	136	63%	0.63	73%	0.727	S	S	*	*			cis	-166	153	-24.6	-121.7	172.6	-167.8	160.5	0	111.3
480	N	28.1	Very low	34.6	Very low	149 Å²	149	131.5 Å²	131.5	80%	0.797	72%	0.715	S	S	*	*			trans	52.7	119.5	153	-61.1	-0.8	0	0	0	122.4
481	S	28.2	Very low	37.3	Very low	126 Å²	126	127.8 Å²	127.8	88%	0.881	69%	0.69	S	S	*	*				-159.2	151.2	124.8	-165.9	0	0	0	0	110.6
482	D	32.1	Very low	40.1	Very low	148 Å²	148	122.8 Å²	122.8	79%	0.791	67%	0.668	S	S	*	*			trans	-87.1	143.8	-177	-74.1	-69.2	0	0	0	113.5
483	Q	33.8	Very low	43	Very low	191 Å²	191	122.5 Å²	122.5	89%	0.893	65%	0.652	S	S	*	*				174.6	166	110	-91.7	178.4	38.3	0	0	111.7
484	S	30.8	Very low	46	Very low	85 Å²	85	119.6 Å²	119.6	59%	0.594	63%	0.632	S	S	*	*			trans	-119.2	128.5	-167.6	58.7	0	0	0	0	115.6
485	P	43.3	Very low	48.9	Very low	72 Å²	72	111.8 Å²	111.8	47%	0.468	60%	0.595	S	S	.	*			trans	-120.3	69.9	141.1	33.9	-21.7	0	0	0	108.9	L487 D488 N489	P485-L487 VanDerWaalsContact C-N 3.29Å; P485-L487 PolarHBondContact O-N 2.9Å; P485-L487 VanDerWaalsContact O-N 3.08Å; P485-D488 PolarHBondContact O-N 3.38Å; P485-N489 WeakPolarHBondContact CG-OD1 3.2Å; P485-N489 PolarHBondContact O-N 2.76Å
486	K	47.3	Very low	52.1	Low	180 Å²	180	108 Å²	108	78%	0.783	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-11.6	-158.8	-91.9	176.2	179.5	178.8	0	117.4
487	L	43.5	Very low	55.4	Low	158 Å²	158	108.7 Å²	108.7	83%	0.827	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-42.3	175.7	-167.6	67.2	0	0	0	111.9	P485 S490	P485-L487 VanDerWaalsContact C-N 3.29Å; P485-L487 PolarHBondContact O-N 2.9Å; P485-L487 VanDerWaalsContact O-N 3.08Å; L487-S490 WeakPolarHBondContact O-CB 3.38Å; L487-S490 PolarHBondContact O-N 2.96Å
488	D	51.2	Low	58.5	Low	83 Å²	83	101 Å²	101	44%	0.444	53%	0.532	S	S	.	.	H	α-helix	trans	-78	-45.6	-172.3	-150.6	37.5	0	0	0	111.4	P485 S490 L491 D492 K649	P485-D488 PolarHBondContact O-N 3.38Å; D488-S490 PolarHBondContact O-N 2.67Å; D488-S490 VanDerWaalsContact O-N 3.11Å; D488-L491 WeakPolarHBondContact O-CB 3.41Å; D488-L491 PolarHBondContact O-N 2.98Å; D488-D492 PolarHBondContact O-N 2.89Å; D488-K649 WeakPolarHBondContact OD1-CE 3.25Å; D488-K649 IonicContact OD1-NZ 3.79Å; D488-K649 PolarHBondContact OD1-NZ 3.27Å; D488-K649 IonicContact OD2-NZ 3.46Å; D488-K649 PolarHBondContact OD2-NZ 3.12Å
489	N	59.2	Low	61.7	Low	83 Å²	83	94.1 Å²	94.1	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-56.7	-29.6	172.8	-79.4	20.8	0	0	0	113	P485 L491 I493	P485-N489 WeakPolarHBondContact CG-OD1 3.2Å; P485-N489 PolarHBondContact O-N 2.76Å; N489-L491 VanDerWaalsContact C-N 3.31Å; N489-L491 PolarHBondContact O-N 3.05Å; N489-I493 WeakPolarHBondContact O-CB 3.32Å; N489-I493 WeakPolarHBondContact O-CD1 3.19Å; N489-I493 WeakPolarHBondContact O-CG1 3.42Å; N489-I493 PolarHBondContact O-N 2.94Å
490	S	74.3	Confident	64.6	Low	64 Å²	64	91.6 Å²	91.6	45%	0.448	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-36.7	178.7	-165.3	0	0	0	0	111.7	L487 D488 L494	L487-S490 WeakPolarHBondContact O-CB 3.38Å; L487-S490 PolarHBondContact O-N 2.96Å; D488-S490 PolarHBondContact O-N 2.67Å; D488-S490 VanDerWaalsContact O-N 3.11Å; S490-L494 WeakPolarHBondContact O-CG 3.49Å; S490-L494 PolarHBondContact O-N 2.97Å
491	L	80.8	Confident	67.9	Low	53 Å²	53	89 Å²	89	28%	0.277	48%	0.476	S	S	.	.	H	α-helix	trans	-71.5	-45.9	177.6	-164.7	72.3	0	0	0	111.1	D488 N489 I493 L494 K495 Y647 K649	D488-L491 WeakPolarHBondContact O-CB 3.41Å; D488-L491 PolarHBondContact O-N 2.98Å; N489-L491 VanDerWaalsContact C-N 3.31Å; N489-L491 PolarHBondContact O-N 3.05Å; L491-I493 PolarHBondContact O-N 2.86Å; L491-L494 PolarHBondContact O-N 2.88Å; L491-K495 WeakPolarHBondContact O-CB 3.5Å; L491-K495 PolarHBondContact O-N 3.48Å; L491-Y647 HydrophobicContact CD1-CD1 3.79Å; L491-Y647 HydrophobicContact CD1-CG 4.41Å; L491-K649 HydrophobicContact CD2-CG 4.2Å
492	D	82.3	Confident	71.1	Confident	45 Å²	45	83 Å²	83	24%	0.241	44%	0.435	C	S	.	.	H	α-helix	trans	-69.7	-30.4	-179.6	-68.7	-52.9	0	0	0	112.4	D488 N496 K649	D488-D492 PolarHBondContact O-N 2.89Å; D492-N496 WeakPolarHBondContact O-CB 3.35Å; D492-N496 PolarHBondContact O-N 3.25Å; D492-N496 PolarHBondContact O-OD1 3Å; D492-K649 IonicContact OD1-NZ 2.65Å; D492-K649 IonicContact OD2-NZ 3.55Å; D492-K649 PolarHBondContact OD2-NZ 2.96Å
493	I	86.4	Confident	74.1	Confident	92 Å²	92	76.5 Å²	76.5	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-62.8	-46.2	168.4	-73.4	164.2	0	0	0	111.2	N489 L491 N496 H497	N489-I493 WeakPolarHBondContact O-CB 3.32Å; N489-I493 WeakPolarHBondContact O-CD1 3.19Å; N489-I493 WeakPolarHBondContact O-CG1 3.42Å; N489-I493 PolarHBondContact O-N 2.94Å; L491-I493 PolarHBondContact O-N 2.86Å; I493-N496 PolarHBondContact O-N 3.44Å; I493-H497 PolarHBondContact O-CD2 3.3Å; I493-H497 PolarHBondContact O-N 3.08Å
494	L	87.8	Confident	77.1	Confident	68 Å²	68	72.3 Å²	72.3	36%	0.356	38%	0.38	S	S	.	.	H	α-helix	trans	-65.3	-40.3	177.8	-72.4	168.6	0	0	0	112.1	S490 L491 H497 V498 Y647	S490-L494 WeakPolarHBondContact O-CG 3.49Å; S490-L494 PolarHBondContact O-N 2.97Å; L491-L494 PolarHBondContact O-N 2.88Å; L494-H497 PolarHBondContact O-N 3.02Å; L494-V498 WeakPolarHBondContact O-CG2 3.41Å; L494-V498 PolarHBondContact O-N 3.33Å; L494-Y647 HydrophobicContact CB-CD1 4.18Å; L494-Y647 HydrophobicContact CB-CD2 3.83Å; L494-Y647 HydrophobicContact CB-CE1 4.32Å; L494-Y647 HydrophobicContact CB-CE2 4Å; L494-Y647 HydrophobicContact CB-CG 3.95Å; L494-Y647 HydrophobicContact CD1-CD1 4.3Å; L494-Y647 HydrophobicContact CD1-CE1 3.94Å
495	K	87.9	Confident	80.3	Confident	30 Å²	30	70.4 Å²	70.4	13%	0.13	37%	0.365	C	S	.	.	H	α-helix	trans	-56.7	-47.9	173.1	-172.3	-166.1	-179	-155.7	0	111	L491 V498 L499 E571 L644	L491-K495 WeakPolarHBondContact O-CB 3.5Å; L491-K495 PolarHBondContact O-N 3.48Å; K495-V498 PolarHBondContact O-N 3.29Å; K495-L499 PolarHBondContact O-N 2.69Å; K495-E571 IonicContact NZ-OE2 2.93Å; K495-L644 HydrophobicContact CG-CD1 3.74Å; K495-L644 WeakPolarHBondContact O-CD1 3.36Å
496	N	88.9	Confident	82.9	Confident	75 Å²	75	67 Å²	67	40%	0.401	34%	0.343	S	S	.	.	H	α-helix	trans	-66.6	-40.6	179.3	-69.5	-0.8	0	0	0	112	D492 I493 V498 L499 D500	D492-N496 WeakPolarHBondContact O-CB 3.35Å; D492-N496 PolarHBondContact O-N 3.25Å; D492-N496 PolarHBondContact O-OD1 3Å; I493-N496 PolarHBondContact O-N 3.44Å; N496-V498 VanDerWaalsContact C-N 3.3Å; N496-V498 PolarHBondContact O-N 2.98Å; N496-L499 CarbonylContact O-C 3.55Å; N496-L499 WeakPolarHBondContact O-CB 3.29Å; N496-L499 PolarHBondContact O-N 3.04Å; N496-D500 PolarHBondContact O-N 3.24Å
497	H	91.8	Very high	85.1	Confident	112 Å²	112	63 Å²	63	52%	0.519	32%	0.323	S	S	.	.	H	α-helix	trans	-60.6	-34	175	-73.2	-30	0	0	0	113.9	I493 L494 D500 E501	I493-H497 PolarHBondContact O-CD2 3.3Å; I493-H497 PolarHBondContact O-N 3.08Å; L494-H497 PolarHBondContact O-N 3.02Å; H497-D500 IonicContact ND1-OD2 3.78Å; H497-E501 PolarHBondContact O-N 3.06Å
498	V	92.9	Very high	87.6	Confident	13 Å²	13	57 Å²	57	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-72	-33.7	174.5	178.8	0	0	0	0	111.5	L494 K495 N496 L502 L640 E643 L644 Y647	L494-V498 WeakPolarHBondContact O-CG2 3.41Å; L494-V498 PolarHBondContact O-N 3.33Å; K495-V498 PolarHBondContact O-N 3.29Å; N496-V498 VanDerWaalsContact C-N 3.3Å; N496-V498 PolarHBondContact O-N 2.98Å; V498-L502 WeakPolarHBondContact O-CB 3.43Å; V498-L502 PolarHBondContact O-N 2.69Å; V498-L640 HydrophobicContact CG1-CD2 4.41Å; V498-L640 WeakPolarHBondContact CG1-O 3.21Å; V498-E643 HydrophobicContact CG1-CB 4.39Å; V498-E643 HydrophobicContact CG2-CB 4.38Å; V498-E643 HydrophobicContact CG2-CG 3.84Å; V498-L644 HydrophobicContact CB-CD1 4.26Å; V498-L644 HydrophobicContact CG1-CB 3.89Å; V498-L644 HydrophobicContact CG1-CD1 4.36Å; V498-Y647 HydrophobicContact CG2-CD2 4.09Å; V498-Y647 HydrophobicContact CG2-CE2 4.12Å
499	L	93.5	Very high	89.8	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-69	-43.7	173.4	179.7	59.3	0	0	0	111.9	K495 N496 E501 L502 I503 C566 P570 V573	K495-L499 PolarHBondContact O-N 2.69Å; N496-L499 CarbonylContact O-C 3.55Å; N496-L499 WeakPolarHBondContact O-CB 3.29Å; N496-L499 PolarHBondContact O-N 3.04Å; L499-E501 VanDerWaalsContact C-N 3.34Å; L499-E501 PolarHBondContact O-N 2.84Å; L499-L502 HydrophobicContact CD1-CD2 4.48Å; L499-L502 WeakPolarHBondContact O-CB 3.4Å; L499-L502 PolarHBondContact O-N 3.41Å; L499-I503 HydrophobicContact CD1-CD1 3.8Å; L499-I503 HydrophobicContact CD1-CG1 4.14Å; L499-I503 HydrophobicContact CG-CD1 3.92Å; L499-I503 WeakPolarHBondContact O-CG1 3Å; L499-I503 PolarHBondContact O-N 3.4Å; L499-C566 HydrophobicContact CD1-CB 4.49Å; L499-C566 WeakPolarHBondContact CD2-O 3.3Å; L499-P570 HydrophobicContact CD2-CB 3.94Å; L499-P570 HydrophobicContact CD2-CG 3.76Å; L499-V573 HydrophobicContact CD1-CG2 3.8Å
500	D	93.6	Very high	91.6	Very high	92 Å²	92	49.7 Å²	49.7	49%	0.492	26%	0.256	S	S	.	.	H	α-helix	trans	-57.2	-46.1	171.8	-72.6	-35.5	0	0	0	111	N496 H497 Q504	N496-D500 PolarHBondContact O-N 3.24Å; H497-D500 IonicContact ND1-OD2 3.78Å; D500-Q504 WeakPolarHBondContact O-CB 3.38Å; D500-Q504 PolarHBondContact O-N 3.25Å
501	E	96.1	Very high	92.5	Very high	94 Å²	94	53.4 Å²	53.4	44%	0.439	26%	0.261	S	S	.	.	H	α-helix	trans	-59.7	-48.7	174.4	-171.6	-175.5	165.3	0	0	110.4	H497 L499 I503 Q504 T505 L640	H497-E501 PolarHBondContact O-N 3.06Å; L499-E501 VanDerWaalsContact C-N 3.34Å; L499-E501 PolarHBondContact O-N 2.84Å; E501-I503 PolarHBondContact O-N 3.49Å; E501-Q504 PolarHBondContact O-N 2.76Å; E501-T505 HydrophobicContact CG-CG2 3.88Å; E501-T505 WeakPolarHBondContact O-CB 3.34Å; E501-T505 VanDerWaalsContact O-CG2 3.24Å; E501-T505 WeakPolarHBondContact O-CG2 3.37Å; E501-T505 PolarHBondContact O-N 3.27Å; E501-T505 PolarHBondContact O-OG1 3.33Å; E501-L640 HydrophobicContact CB-CD2 4.37Å; E501-L640 HydrophobicContact CG-CD2 4.09Å
502	L	96.1	Very high	93.2	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-56.4	-50.7	-179.6	174.4	61.8	0	0	0	112	V498 L499 T505 E506 L563 V573 F577 R633 Y637 L640	V498-L502 WeakPolarHBondContact O-CB 3.43Å; V498-L502 PolarHBondContact O-N 2.69Å; L499-L502 HydrophobicContact CD1-CD2 4.48Å; L499-L502 WeakPolarHBondContact O-CB 3.4Å; L499-L502 PolarHBondContact O-N 3.41Å; L502-T505 PolarHBondContact O-OG1 2.98Å; L502-E506 WeakPolarHBondContact O-CB 3.34Å; L502-E506 PolarHBondContact O-N 2.92Å; L502-L563 HydrophobicContact CD1-CD1 4.13Å; L502-L563 HydrophobicContact CD2-CD2 3.88Å; L502-L563 HydrophobicContact CG-CD1 4.12Å; L502-L563 HydrophobicContact CG-CD2 4.26Å; L502-V573 HydrophobicContact CD2-CG1 3.95Å; L502-F577 HydrophobicContact CD1-CZ 4.39Å; L502-F577 HydrophobicContact CD2-CE2 4.38Å; L502-R633 PolarHBondContact O-NH2 3.21Å; L502-Y637 HydrophobicContact CD1-CD1 4.07Å; L502-Y637 HydrophobicContact CD1-CE1 4.19Å; L502-L640 HydrophobicContact CB-CD1 4.37Å; L502-L640 HydrophobicContact CD1-CB 4.44Å; L502-L640 HydrophobicContact CD1-CD1 3.77Å
503	I	95.9	Very high	93.9	Very high	10 Å²	10	51.8 Å²	51.8	5%	0.051	25%	0.25	C	S	.	.	H	α-helix	trans	-69.5	-47	-179.1	-63.9	168.8	0	0	0	111.2	L499 E501 T505 E506 R507 L563 E564	L499-I503 HydrophobicContact CD1-CD1 3.8Å; L499-I503 HydrophobicContact CD1-CG1 4.14Å; L499-I503 HydrophobicContact CG-CD1 3.92Å; L499-I503 WeakPolarHBondContact O-CG1 3Å; L499-I503 PolarHBondContact O-N 3.4Å; E501-I503 PolarHBondContact O-N 3.49Å; I503-T505 PolarHBondContact O-N 2.81Å; I503-E506 VanDerWaalsContact O-CB 3.32Å; I503-E506 WeakPolarHBondContact O-CB 3.39Å; I503-E506 PolarHBondContact O-N 3.07Å; I503-E506 VanDerWaalsContact O-N 3.15Å; I503-R507 WeakPolarHBondContact O-CG 3.29Å; I503-R507 PolarHBondContact O-N 3.03Å; I503-L563 WeakPolarHBondContact CD1-O 3.44Å; I503-L563 HydrophobicContact CG1-CB 4.32Å; I503-E564 HydrophobicContact CG2-CG 3.97Å
504	Q	95.9	Very high	94.3	Very high	103 Å²	103	51.9 Å²	51.9	48%	0.481	25%	0.247	S	C	.	.	H	α-helix	trans	-71.1	-33.8	-176.3	-175.1	65.3	-14.3	0	0	112.2	D500 E501 E506 A508	D500-Q504 WeakPolarHBondContact O-CB 3.38Å; D500-Q504 PolarHBondContact O-N 3.25Å; E501-Q504 PolarHBondContact O-N 2.76Å; Q504-E506 VanDerWaalsContact C-N 3.33Å; Q504-A508 WeakPolarHBondContact O-CB 3.32Å; Q504-A508 PolarHBondContact O-N 3.47Å
505	T	97.3	Very high	94.6	Very high	45 Å²	45	50.8 Å²	50.8	28%	0.276	24%	0.244	S	C	.	.	H	α-helix	trans	-73.9	-23.6	171.4	60.2	0	0	0	0	112.6	E501 L502 I503 Y509 R633	E501-T505 HydrophobicContact CG-CG2 3.88Å; E501-T505 WeakPolarHBondContact O-CB 3.34Å; E501-T505 VanDerWaalsContact O-CG2 3.24Å; E501-T505 WeakPolarHBondContact O-CG2 3.37Å; E501-T505 PolarHBondContact O-N 3.27Å; E501-T505 PolarHBondContact O-OG1 3.33Å; L502-T505 PolarHBondContact O-OG1 2.98Å; I503-T505 PolarHBondContact O-N 2.81Å; T505-Y509 VanDerWaalsContact O-CB 3.26Å; T505-Y509 WeakPolarHBondContact O-CB 3.32Å; T505-Y509 PolarHBondContact O-N 2.98Å; T505-R633 PolarHBondContact OG1-NH1 2.88Å
506	E	97.8	Very high	95	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-67.3	-52.8	168.5	-169.8	63.8	-164.4	0	0	110.8	L502 I503 Q504 A508 Y509 V510 H555 M560 L563 R633 Y637	L502-E506 WeakPolarHBondContact O-CB 3.34Å; L502-E506 PolarHBondContact O-N 2.92Å; I503-E506 VanDerWaalsContact O-CB 3.32Å; I503-E506 WeakPolarHBondContact O-CB 3.39Å; I503-E506 PolarHBondContact O-N 3.07Å; I503-E506 VanDerWaalsContact O-N 3.15Å; Q504-E506 VanDerWaalsContact C-N 3.33Å; E506-A508 PolarHBondContact O-N 3.23Å; E506-Y509 WeakPolarHBondContact O-CB 3.39Å; E506-Y509 PolarHBondContact O-N 3.3Å; E506-V510 HydrophobicContact CG-CG2 4.48Å; E506-V510 WeakPolarHBondContact O-CG2 3.37Å; E506-V510 PolarHBondContact O-N 3.07Å; E506-H555 IonicContact OE1-CE1 2.71Å; E506-H555 IonicContact OE1-CG 3.1Å; E506-H555 IonicContact OE1-ND1 3.32Å; E506-H555 PolarHBondContact OE1-ND1 3.03Å; E506-M560 HydrophobicContact CG-CB 4.13Å; E506-M560 HydrophobicContact CG-CG 4.25Å; E506-L563 HydrophobicContact CB-CD1 4.19Å; E506-L563 HydrophobicContact CG-CD1 4.02Å; E506-R633 IonicContact OE2-CZ 3.81Å; E506-R633 IonicContact OE2-NE 3.85Å; E506-R633 PolarHBondContact OE2-NE 2.91Å; E506-R633 IonicContact OE2-NH2 2.8Å; E506-R633 PolarHBondContact OE2-NH2 3.24Å; E506-Y637 PolarHBondContact OE2-OH 3.3Å
507	R	94.8	Very high	95.3	Very high	96 Å²	96	46.7 Å²	46.7	36%	0.362	22%	0.223	S	C	.	.	H	α-helix	trans	-56	-37.4	174.7	-69.3	171	174.5	154.9	-1.1	111.9	I503 R511 M560 E564	I503-R507 WeakPolarHBondContact O-CG 3.29Å; I503-R507 PolarHBondContact O-N 3.03Å; R507-R511 WeakPolarHBondContact O-CB 3.43Å; R507-R511 WeakPolarHBondContact O-CG 3.23Å; R507-R511 PolarHBondContact O-N 2.84Å; R507-R511 PolarHBondContact O-NE 3.03Å; R507-M560 HydrophobicContact CG-CG 4.43Å; R507-M560 HydrophobicContact CG-SD 4.07Å; R507-E564 IonicContact CZ-OE1 3.18Å; R507-E564 IonicContact NE-OE1 2.76Å; R507-E564 PolarHBondContact NE-OE1 3.05Å; R507-E564 IonicContact NH2-OE1 2.75Å; R507-E564 PolarHBondContact NH2-OE1 3.49Å
508	A	94.6	Very high	95.3	Very high	33 Å²	33	46.1 Å²	46.1	27%	0.273	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-52.4	172.8	0	0	0	0	0	111.3	Q504 E506 V510 R511 E512	Q504-A508 WeakPolarHBondContact O-CB 3.32Å; Q504-A508 PolarHBondContact O-N 3.47Å; E506-A508 PolarHBondContact O-N 3.23Å; A508-V510 PolarHBondContact O-N 3.4Å; A508-R511 PolarHBondContact O-N 2.81Å; A508-E512 WeakPolarHBondContact O-CG 3.31Å; A508-E512 PolarHBondContact O-N 3.37Å
509	Y	98.3	Very high	95.2	Very high	8 Å²	8	45.9 Å²	45.9	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-56.3	-49.3	-179.7	176.4	-119.8	0	0	0	113	T505 E506 R511 E512 L513 I551 H555 Y587 K629 P630 R633	T505-Y509 VanDerWaalsContact O-CB 3.26Å; T505-Y509 WeakPolarHBondContact O-CB 3.32Å; T505-Y509 PolarHBondContact O-N 2.98Å; E506-Y509 WeakPolarHBondContact O-CB 3.39Å; E506-Y509 PolarHBondContact O-N 3.3Å; Y509-R511 PolarHBondContact O-N 3.25Å; Y509-E512 PolarHBondContact O-N 2.86Å; Y509-L513 HydrophobicContact CD2-CD2 4.44Å; Y509-L513 HydrophobicContact CD2-CG 4.29Å; Y509-L513 HydrophobicContact CE1-CD1 3.96Å; Y509-L513 HydrophobicContact CE2-CD1 4.05Å; Y509-L513 HydrophobicContact CE2-CD2 3.81Å; Y509-L513 HydrophobicContact CE2-CG 3.91Å; Y509-L513 WeakPolarHBondContact O-CG 3.37Å; Y509-L513 PolarHBondContact O-N 2.86Å; Y509-I551 VanDerWaalsContact OH-CG2 3.25Å; Y509-I551 WeakPolarHBondContact OH-CG2 3.46Å; Y509-H555 AromaticContact CE1-CD2 3.89Å; Y509-H555 AromaticContact CE1-CG 3.96Å; Y509-Y587 WeakPolarHBondContact CE1-OH 3.47Å; Y509-Y587 PolarHBondContact OH-OH 2.65Å; Y509-K629 HydrophobicContact CD2-CB 4.25Å; Y509-K629 HydrophobicContact CE2-CB 4.02Å; Y509-P630 WeakPolarHBondContact OH-CA 3.39Å; Y509-R633 HydrophobicContact CD1-CB 4.24Å; Y509-R633 HydrophobicContact CD1-CG 3.65Å; Y509-R633 HydrophobicContact CD2-CB 3.95Å; Y509-R633 HydrophobicContact CD2-CG 4.18Å; Y509-R633 HydrophobicContact CE1-CB 4Å; Y509-R633 HydrophobicContact CE1-CG 3.69Å; Y509-R633 HydrophobicContact CE2-CB 3.71Å; Y509-R633 HydrophobicContact CE2-CG 4.22Å; Y509-R633 HydrophobicContact CG-CB 4.2Å; Y509-R633 HydrophobicContact CG-CG 3.9Å
510	V	97.1	Very high	95.3	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-47.2	177.7	171.5	0	0	0	0	111.5	E506 A508 E512 L513 F514 Y552 H555 N556 M560	E506-V510 HydrophobicContact CG-CG2 4.48Å; E506-V510 WeakPolarHBondContact O-CG2 3.37Å; E506-V510 PolarHBondContact O-N 3.07Å; A508-V510 PolarHBondContact O-N 3.4Å; V510-E512 PolarHBondContact O-N 3.33Å; V510-L513 PolarHBondContact O-N 2.77Å; V510-F514 PolarHBondContact O-N 2.68Å; V510-Y552 HydrophobicContact CG1-CD2 4.28Å; V510-Y552 HydrophobicContact CG1-CE2 3.83Å; V510-H555 HydrophobicContact CG2-CB 3.9Å; V510-N556 HydrophobicContact CG1-CB 3.84Å; V510-N556 VanDerWaalsContact CG1-OD1 3.27Å; V510-N556 WeakPolarHBondContact CG1-OD1 3.49Å; V510-M560 HydrophobicContact CB-SD 4.3Å; V510-M560 HydrophobicContact CG1-SD 4.29Å; V510-M560 HydrophobicContact CG2-CB 4.44Å; V510-M560 HydrophobicContact CG2-SD 4.2Å
511	R	93.8	Very high	95.4	Very high	142 Å²	142	43.4 Å²	43.4	54%	0.536	21%	0.207	S	C	.	.	H	α-helix	trans	-64	-39	177.2	-73.6	177.5	-68	-176.3	-1.6	112.5	R507 A508 Y509 F514 T515	R507-R511 WeakPolarHBondContact O-CB 3.43Å; R507-R511 WeakPolarHBondContact O-CG 3.23Å; R507-R511 PolarHBondContact O-N 2.84Å; R507-R511 PolarHBondContact O-NE 3.03Å; A508-R511 PolarHBondContact O-N 2.81Å; Y509-R511 PolarHBondContact O-N 3.25Å; R511-F514 PolarHBondContact O-N 2.91Å; R511-T515 PolarHBondContact O-N 3.29Å
512	E	94.7	Very high	95.3	Very high	64 Å²	64	41.8 Å²	41.8	30%	0.299	21%	0.206	S	C	.	.	H	α-helix	trans	-71.9	-30.1	178.5	-70.4	-178.1	125.1	0	0	113.2	A508 Y509 V510 T515 V516 K629	A508-E512 WeakPolarHBondContact O-CG 3.31Å; A508-E512 PolarHBondContact O-N 3.37Å; Y509-E512 PolarHBondContact O-N 2.86Å; V510-E512 PolarHBondContact O-N 3.33Å; E512-T515 PolarHBondContact O-OG1 3.37Å; E512-V516 VanDerWaalsContact O-CG2 3.23Å; E512-V516 WeakPolarHBondContact O-CG2 3.5Å; E512-V516 PolarHBondContact O-N 3.31Å; E512-K629 HydrophobicContact CB-CD 3.83Å; E512-K629 HydrophobicContact CG-CD 4.49Å; E512-K629 VanDerWaalsContact OE1-CE 3.25Å; E512-K629 WeakPolarHBondContact OE1-CE 3.35Å; E512-K629 IonicContact OE1-NZ 2.77Å; E512-K629 PolarHBondContact OE1-NZ 3.15Å; E512-K629 WeakPolarHBondContact OE2-CD 3.34Å; E512-K629 VanDerWaalsContact OE2-CE 3.29Å; E512-K629 WeakPolarHBondContact OE2-CE 3.34Å; E512-K629 IonicContact OE2-NZ 3.81Å; E512-K629 PolarHBondContact OE2-NZ 3.23Å
513	L	96.9	Very high	95.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.5	-43.9	167.9	-65.6	-167.4	0	0	0	110.9	Y509 V510 T515 V516 L517 M548 I551 Y552 P630	Y509-L513 HydrophobicContact CD2-CD2 4.44Å; Y509-L513 HydrophobicContact CD2-CG 4.29Å; Y509-L513 HydrophobicContact CE1-CD1 3.96Å; Y509-L513 HydrophobicContact CE2-CD1 4.05Å; Y509-L513 HydrophobicContact CE2-CD2 3.81Å; Y509-L513 HydrophobicContact CE2-CG 3.91Å; Y509-L513 WeakPolarHBondContact O-CG 3.37Å; Y509-L513 PolarHBondContact O-N 2.86Å; V510-L513 PolarHBondContact O-N 2.77Å; L513-T515 PolarHBondContact O-N 3.04Å; L513-V516 PolarHBondContact O-N 3.09Å; L513-V516 VanDerWaalsContact O-N 3.16Å; L513-L517 VanDerWaalsContact O-CG 3.31Å; L513-L517 WeakPolarHBondContact O-CG 3.39Å; L513-L517 PolarHBondContact O-N 2.86Å; L513-M548 HydrophobicContact CD2-CE 3.85Å; L513-M548 HydrophobicContact CD2-CG 3.98Å; L513-M548 HydrophobicContact CD2-SD 4Å; L513-I551 HydrophobicContact CD1-CG2 3.89Å; L513-Y552 HydrophobicContact CB-CD2 3.97Å; L513-Y552 HydrophobicContact CB-CG 4.41Å; L513-P630 HydrophobicContact CD2-CG 4.19Å
514	F	94.9	Very high	95.2	Very high	95 Å²	95	42.9 Å²	42.9	42%	0.417	21%	0.211	S	C	.	.	H	α-helix	trans	-58.6	-45.3	179	-178	-105.5	0	0	0	112.7	V510 R511 V516 L517 L518 Y552	V510-F514 PolarHBondContact O-N 2.68Å; R511-F514 PolarHBondContact O-N 2.91Å; F514-V516 VanDerWaalsContact C-N 3.27Å; F514-V516 PolarHBondContact O-N 3.23Å; F514-L517 PolarHBondContact O-N 3.42Å; F514-L518 HydrophobicContact CE1-CD2 3.92Å; F514-L518 HydrophobicContact CZ-CD2 3.84Å; F514-L518 WeakPolarHBondContact O-CB 3.4Å; F514-L518 PolarHBondContact O-N 3.42Å; F514-Y552 HydrophobicContact CB-CD2 4.35Å; F514-Y552 HydrophobicContact CB-CE2 3.72Å; F514-Y552 HydrophobicContact CD2-CE1 4.2Å; F514-Y552 HydrophobicContact CD2-CE2 4.18Å; F514-Y552 AromaticContact CD2-CZ 3.67Å; F514-Y552 WeakPolarHBondContact CD2-OH 3.42Å; F514-Y552 HydrophobicContact CG-CE2 4.39Å
515	T	93.4	Very high	95	Very high	45 Å²	45	42.1 Å²	42.1	28%	0.276	21%	0.21	S	C	.	.	H	α-helix	trans	-66.1	-28.1	178	60.1	0	0	0	0	113	R511 E512 L513 G519	R511-T515 PolarHBondContact O-N 3.29Å; E512-T515 PolarHBondContact O-OG1 3.37Å; L513-T515 PolarHBondContact O-N 3.04Å; T515-G519 VanDerWaalsContact O-CA 3.24Å; T515-G519 WeakPolarHBondContact O-CA 3.41Å; T515-G519 PolarHBondContact O-N 3.27Å
516	V	96.9	Very high	94.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-72.4	-46.8	172.8	175.3	0	0	0	0	111.7	E512 L513 F514 Y520 R521 F545 M548 L623 Y626	E512-V516 VanDerWaalsContact O-CG2 3.23Å; E512-V516 WeakPolarHBondContact O-CG2 3.5Å; E512-V516 PolarHBondContact O-N 3.31Å; L513-V516 PolarHBondContact O-N 3.09Å; L513-V516 VanDerWaalsContact O-N 3.16Å; F514-V516 VanDerWaalsContact C-N 3.27Å; F514-V516 PolarHBondContact O-N 3.23Å; V516-Y520 PolarHBondContact O-N 2.93Å; V516-R521 PolarHBondContact O-N 3.37Å; V516-R521 VanDerWaalsContact O-N 3.09Å; V516-F545 HydrophobicContact CG1-CD1 3.82Å; V516-F545 HydrophobicContact CG1-CE1 3.6Å; V516-M548 HydrophobicContact CB-SD 4Å; V516-M548 HydrophobicContact CG1-SD 3.55Å; V516-M548 VanDerWaalsContact CG1-SD 3.55Å; V516-L623 HydrophobicContact CG1-CD1 3.74Å; V516-L623 HydrophobicContact CG2-CD1 4.4Å; V516-Y626 VanDerWaalsContact CG2-CB 3.4Å; V516-Y626 HydrophobicContact CG2-CD1 3.94Å; V516-Y626 HydrophobicContact CG2-CG 3.88Å
517	L	95.4	Very high	94.5	Very high	18 Å²	18	46 Å²	46	9%	0.094	24%	0.235	C	C	.	.	I	π-helix	trans	-64.8	-49.7	-177.2	-69.7	171	0	0	0	111	L513 F514 R521 S522 M548 A549 Y552	L513-L517 VanDerWaalsContact O-CG 3.31Å; L513-L517 WeakPolarHBondContact O-CG 3.39Å; L513-L517 PolarHBondContact O-N 2.86Å; F514-L517 PolarHBondContact O-N 3.42Å; L517-R521 HydrophobicContact CD2-CB 4.48Å; L517-R521 WeakPolarHBondContact O-CB 3.29Å; L517-R521 PolarHBondContact O-N 2.87Å; L517-S522 PolarHBondContact O-N 3.14Å; L517-S522 PolarHBondContact O-OG 3.08Å; L517-M548 HydrophobicContact CD1-CG 4.45Å; L517-M548 HydrophobicContact CD2-CB 4.06Å; L517-M548 HydrophobicContact CD2-CG 3.91Å; L517-M548 HydrophobicContact CD2-SD 4.37Å; L517-M548 HydrophobicContact CG-CG 4.19Å; L517-M548 HydrophobicContact CG-SD 4.48Å; L517-A549 HydrophobicContact CD2-CB 4.19Å; L517-Y552 HydrophobicContact CD1-CD1 3.73Å; L517-Y552 HydrophobicContact CD1-CD2 4.44Å; L517-Y552 HydrophobicContact CD1-CG 3.58Å
518	L	92	Very high	94.4	Very high	100 Å²	100	49.2 Å²	49.2	52%	0.524	25%	0.253	S	S	.	.	I	π-helix	trans	-71	-48.6	176.7	-177.8	61.5	0	0	0	111.8	F514	F514-L518 HydrophobicContact CE1-CD2 3.92Å; F514-L518 HydrophobicContact CZ-CD2 3.84Å; F514-L518 WeakPolarHBondContact O-CB 3.4Å; F514-L518 PolarHBondContact O-N 3.42Å
519	G	90.9	Very high	94.3	Very high	9 Å²	9	47.8 Å²	47.8	9%	0.093	24%	0.241	C	C	.	.	I	π-helix	trans	-86.5	-10.2	-166.3	0	0	0	0	0	116.6	T515 C613	T515-G519 VanDerWaalsContact O-CA 3.24Å; T515-G519 WeakPolarHBondContact O-CA 3.41Å; T515-G519 PolarHBondContact O-N 3.27Å; G519-C613 WeakPolarHBondContact O-CB 3.41Å
520	Y	95.9	Very high	94	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	25%	0.254	C	S	.	.	I	π-helix	trans	-131.6	-49.4	170.7	-62.4	-96.9	0	0	0	112.2	V516 E523 M524 F610 C613 Q614 L617 H619 L623	V516-Y520 PolarHBondContact O-N 2.93Å; Y520-E523 PolarHBondContact O-N 3.07Å; Y520-M524 PolarHBondContact O-N 3.37Å; Y520-F610 HydrophobicContact CD1-CD1 4.05Å; Y520-F610 HydrophobicContact CE1-CD1 4.48Å; Y520-C613 HydrophobicContact CD1-CB 3.29Å; Y520-C613 HydrophobicContact CE1-CB 3.42Å; Y520-C613 VanDerWaalsContact CE1-CB 3.42Å; Y520-C613 HydrophobicContact CG-CB 4.04Å; Y520-Q614 WeakPolarHBondContact OH-CA 3.32Å; Y520-Q614 WeakPolarHBondContact OH-CB 3.49Å; Y520-L617 HydrophobicContact CD2-CD1 3.62Å; Y520-L617 HydrophobicContact CE2-CD1 3.25Å; Y520-H619 AromaticContact CE2-ND1 3.71Å; Y520-L623 HydrophobicContact CD1-CB 4.44Å; Y520-L623 HydrophobicContact CD1-CD1 4.34Å; Y520-L623 HydrophobicContact CD1-CD2 3.94Å; Y520-L623 HydrophobicContact CD1-CG 4.46Å; Y520-L623 HydrophobicContact CD2-CD1 3.87Å; Y520-L623 HydrophobicContact CE1-CB 4.07Å; Y520-L623 HydrophobicContact CE1-CD2 4.4Å; Y520-L623 HydrophobicContact CE2-CD1 4.06Å; Y520-L623 HydrophobicContact CG-CD1 3.99Å; Y520-L623 HydrophobicContact CG-CD2 4.16Å
521	R	95.6	Very high	93.7	Very high	43 Å²	43	58.2 Å²	58.2	16%	0.162	29%	0.294	C	S	.	.	I	π-helix	trans	-67.4	-41.6	-173.9	-177.7	177.4	162.5	79.5	2.9	112.3	V516 L517 K541 D542 F545	V516-R521 PolarHBondContact O-N 3.37Å; V516-R521 VanDerWaalsContact O-N 3.09Å; L517-R521 HydrophobicContact CD2-CB 4.48Å; L517-R521 WeakPolarHBondContact O-CB 3.29Å; L517-R521 PolarHBondContact O-N 2.87Å; R521-K541 HydrophobicContact CG-CD 4.49Å; R521-K541 HydrophobicContact CG-CG 4.09Å; R521-K541 PolarHBondContact NH1-O 2.92Å; R521-K541 VanDerWaalsContact O-CE 3.25Å; R521-K541 WeakPolarHBondContact O-CE 3.33Å; R521-D542 IonicContact CZ-OD1 2.58Å; R521-D542 IonicContact NH1-OD1 3.37Å; R521-D542 PolarHBondContact NH1-OD1 2.6Å; R521-D542 IonicContact NH2-OD1 3.12Å; R521-D542 PolarHBondContact NH2-OD1 2.86Å; R521-F545 HydrophobicContact CB-CD1 4.09Å; R521-F545 HydrophobicContact CB-CD2 3.68Å; R521-F545 HydrophobicContact CB-CE1 4.02Å; R521-F545 HydrophobicContact CB-CE2 3.61Å; R521-F545 HydrophobicContact CB-CG 3.95Å; R521-F545 HydrophobicContact CB-CZ 3.8Å; R521-F545 HydrophobicContact CG-CD2 3.6Å; R521-F545 HydrophobicContact CG-CE2 3.94Å; R521-F545 HydrophobicContact CG-CG 4.01Å
522	S	93.6	Very high	93.7	Very high	60 Å²	60	54.5 Å²	54.5	42%	0.42	29%	0.285	S	S	.	.	I	π-helix	trans	-76.2	-31.6	174.2	-58.7	0	0	0	0	112.8	L517 M524 D525 N526	L517-S522 PolarHBondContact O-N 3.14Å; L517-S522 PolarHBondContact O-OG 3.08Å; S522-M524 PolarHBondContact O-N 3.38Å; S522-D525 WeakPolarHBondContact O-CB 3.31Å; S522-D525 PolarHBondContact O-N 3.23Å; S522-N526 PolarHBondContact O-N 3.27Å
523	E	94.8	Very high	93.5	Very high	33 Å²	33	51.8 Å²	51.8	15%	0.154	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-62.9	-23	175.4	-76.8	-76.3	83.9	0	0	112.9	Y520 D525 N526 M529 F609 K616	Y520-E523 PolarHBondContact O-N 3.07Å; E523-D525 PolarHBondContact O-N 3.28Å; E523-N526 WeakPolarHBondContact O-CB 3.43Å; E523-N526 PolarHBondContact O-N 2.9Å; E523-N526 WeakPolarHBondContact OE1-CB 3.44Å; E523-N526 PolarHBondContact OE1-ND2 3.25Å; E523-M529 WeakPolarHBondContact O-CB 3.4Å; E523-F609 HydrophobicContact CB-CE2 4.06Å; E523-F609 HydrophobicContact CB-CZ 3.98Å; E523-F609 WeakPolarHBondContact O-CE2 3.26Å; E523-K616 IonicContact OE2-NZ 3.67Å; E523-K616 PolarHBondContact OE2-NZ 3.15Å
524	M	94.5	Very high	93.3	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-64	-22.8	170.6	-69.9	-175.1	72	0	0	113.2	Y520 S522 M533 L537 K541 L544 F545 F609	Y520-M524 PolarHBondContact O-N 3.37Å; S522-M524 PolarHBondContact O-N 3.38Å; M524-M533 HydrophobicContact CB-CE 4.45Å; M524-M533 HydrophobicContact CB-SD 4.12Å; M524-M533 HydrophobicContact CE-SD 3.66Å; M524-M533 HydrophobicContact CG-SD 3.95Å; M524-M533 VanDerWaalsContact O-CE 3.23Å; M524-M533 WeakPolarHBondContact O-CE 3.45Å; M524-L537 HydrophobicContact CE-CD1 4.39Å; M524-L537 HydrophobicContact CE-CG 4.07Å; M524-L537 VanDerWaalsContact CE-O 3.28Å; M524-L537 WeakPolarHBondContact CE-O 3.32Å; M524-K541 HydrophobicContact CE-CB 3.9Å; M524-K541 HydrophobicContact SD-CB 3.95Å; M524-K541 HydrophobicContact SD-CG 4.01Å; M524-L544 HydrophobicContact SD-CD2 4.41Å; M524-F545 HydrophobicContact SD-CE2 3.73Å; M524-F609 HydrophobicContact CB-CZ 4.21Å; M524-F609 HydrophobicContact CG-CE1 3.62Å; M524-F609 HydrophobicContact CG-CE2 4.27Å; M524-F609 HydrophobicContact CG-CZ 3.4Å; M524-F609 VanDerWaalsContact CG-CZ 3.4Å
525	D	92.6	Very high	92.8	Very high	86 Å²	86	54 Å²	54	46%	0.46	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-93.4	-13	176.4	-48.2	-39.3	0	0	0	112.5	S522 E523 P527 F530 K541	S522-D525 WeakPolarHBondContact O-CB 3.31Å; S522-D525 PolarHBondContact O-N 3.23Å; E523-D525 PolarHBondContact O-N 3.28Å; D525-P527 VanDerWaalsContact O-CD 3.3Å; D525-P527 WeakPolarHBondContact O-CD 3.45Å; D525-F530 WeakPolarHBondContact O-CE1 3.35Å; D525-F530 WeakPolarHBondContact O-CZ 3.44Å; D525-K541 IonicContact OD1-NZ 2.72Å; D525-K541 PolarHBondContact OD1-NZ 2.99Å; D525-K541 IonicContact OD2-NZ 3.14Å; D525-K541 PolarHBondContact OD2-NZ 2.42Å
526	N	91.8	Very high	92.5	Very high	38 Å²	38	57.8 Å²	57.8	20%	0.203	31%	0.314	C	S	.	.			trans	-70.8	116.7	-177.9	180	-9.4	0	0	0	111	S522 E523 Q528 M529 F530	S522-N526 PolarHBondContact O-N 3.27Å; E523-N526 WeakPolarHBondContact O-CB 3.43Å; E523-N526 PolarHBondContact O-N 2.9Å; E523-N526 WeakPolarHBondContact OE1-CB 3.44Å; E523-N526 PolarHBondContact OE1-ND2 3.25Å; N526-Q528 PolarHBondContact O-N 3.16Å; N526-Q528 VanDerWaalsContact O-N 3.08Å; N526-Q528 WeakPolarHBondContact OD1-CB 3.29Å; N526-Q528 PolarHBondContact OD1-N 2.68Å; N526-M529 HydrophobicContact CB-CB 4.41Å; N526-M529 HydrophobicContact CB-CG 4.05Å; N526-M529 WeakPolarHBondContact O-CB 3.49Å; N526-M529 PolarHBondContact O-N 2.72Å; N526-F530 WeakPolarHBondContact O-CD1 3.29Å; N526-F530 WeakPolarHBondContact O-CE1 3.13Å
527	P	92.6	Very high	92.3	Very high	91 Å²	91	57.8 Å²	57.8	59%	0.591	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-55.8	-30.3	-178.6	-27.6	36.9	0	0	0	114.6	D525 M529 F530	D525-P527 VanDerWaalsContact O-CD 3.3Å; D525-P527 WeakPolarHBondContact O-CD 3.45Å; P527-M529 PolarHBondContact O-N 3.35Å; P527-F530 HydrophobicContact CB-CD2 4.4Å; P527-F530 HydrophobicContact CB-CE2 4.19Å; P527-F530 HydrophobicContact CB-CZ 4.36Å; P527-F530 HydrophobicContact CG-CE2 4.38Å; P527-F530 HydrophobicContact CG-CZ 4.24Å; P527-F530 WeakPolarHBondContact O-CB 3.49Å; P527-F530 WeakPolarHBondContact O-CG 3.25Å; P527-F530 PolarHBondContact O-N 3.22Å
528	Q	92	Very high	91.8	Very high	162 Å²	162	60.4 Å²	60.4	76%	0.757	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-68.6	-16	178.5	-59	-179.7	-4.8	0	0	113.4	N526	N526-Q528 PolarHBondContact O-N 3.16Å; N526-Q528 VanDerWaalsContact O-N 3.08Å; N526-Q528 WeakPolarHBondContact OD1-CB 3.29Å; N526-Q528 PolarHBondContact OD1-N 2.68Å
529	M	91.9	Very high	91.5	Very high	4 Å²	4	62.4 Å²	62.4	2%	0.02	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-99	-2.1	-179.3	-63.5	-65.3	-77.3	0	0	112.6	E523 N526 P527 D531 L532 F609 E612 C613 K616	E523-M529 WeakPolarHBondContact O-CB 3.4Å; N526-M529 HydrophobicContact CB-CB 4.41Å; N526-M529 HydrophobicContact CB-CG 4.05Å; N526-M529 WeakPolarHBondContact O-CB 3.49Å; N526-M529 PolarHBondContact O-N 2.72Å; P527-M529 PolarHBondContact O-N 3.35Å; M529-D531 PolarHBondContact O-N 2.95Å; M529-L532 HydrophobicContact CE-CD1 4.34Å; M529-L532 PolarHBondContact O-N 2.95Å; M529-L532 HydrophobicContact SD-CD1 4.18Å; M529-F609 HydrophobicContact CB-CD2 4Å; M529-F609 HydrophobicContact CB-CE2 3.91Å; M529-F609 HydrophobicContact CE-CD2 3.75Å; M529-F609 HydrophobicContact CE-CE2 3.8Å; M529-F609 HydrophobicContact CG-CE2 4.41Å; M529-E612 HydrophobicContact CE-CB 4.2Å; M529-E612 HydrophobicContact CE-CG 3.82Å; M529-E612 HydrophobicContact SD-CG 4.14Å; M529-C613 VanDerWaalsContact CE-SG 3.5Å; M529-K616 PolarHBondContact SD-NZ 3.1Å
530	F	91.8	Very high	91.6	Very high	70 Å²	70	65.8 Å²	65.8	31%	0.307	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-68.5	-36	-170	-74.2	6.3	0	0	0	113.3	D525 N526 P527 L532 M533 R538	D525-F530 WeakPolarHBondContact O-CE1 3.35Å; D525-F530 WeakPolarHBondContact O-CZ 3.44Å; N526-F530 WeakPolarHBondContact O-CD1 3.29Å; N526-F530 WeakPolarHBondContact O-CE1 3.13Å; P527-F530 HydrophobicContact CB-CD2 4.4Å; P527-F530 HydrophobicContact CB-CE2 4.19Å; P527-F530 HydrophobicContact CB-CZ 4.36Å; P527-F530 HydrophobicContact CG-CE2 4.38Å; P527-F530 HydrophobicContact CG-CZ 4.24Å; P527-F530 WeakPolarHBondContact O-CB 3.49Å; P527-F530 WeakPolarHBondContact O-CG 3.25Å; P527-F530 PolarHBondContact O-N 3.22Å; F530-L532 PolarHBondContact O-N 3.18Å; F530-M533 HydrophobicContact CD1-CE 4.37Å; F530-M533 PolarHBondContact O-N 3.16Å; F530-R538 VanDerWaalsContact CB-NH2 3.31Å; F530-R538 VanDerWaalsContact CE2-NH1 3.32Å
531	D	92.5	Very high	91.5	Very high	160 Å²	160	67.5 Å²	67.5	86%	0.856	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-70.1	-19.3	178.9	-57.7	-36.7	0	0	0	112.8	M529	M529-D531 PolarHBondContact O-N 2.95Å
532	L	92.1	Very high	91.4	Very high	64 Å²	64	70.1 Å²	70.1	34%	0.335	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-89.8	-10.6	178.1	-54.1	-178.8	0	0	0	113	M529 F530 A608 F609 E612	M529-L532 HydrophobicContact CE-CD1 4.34Å; M529-L532 PolarHBondContact O-N 2.95Å; M529-L532 HydrophobicContact SD-CD1 4.18Å; F530-L532 PolarHBondContact O-N 3.18Å; L532-A608 HydrophobicContact CB-CB 4.23Å; L532-A608 HydrophobicContact CD2-CB 4.15Å; L532-F609 HydrophobicContact CB-CB 4.21Å; L532-F609 WeakPolarHBondContact O-CB 3.26Å; L532-F609 PolarHBondContact O-N 2.95Å; L532-F609 VanDerWaalsContact O-N 3.1Å; L532-E612 HydrophobicContact CD1-CB 3.95Å; L532-E612 HydrophobicContact CD1-CG 3.91Å
533	M	92.4	Very high	91.6	Very high	6 Å²	6	69.8 Å²	69.8	3%	0.03	37%	0.366	C	S	.	.	S	Bend	trans	-116.2	119.4	-169.4	-178.1	175.1	53.1	0	0	112.1	M524 F530 L537 R538 F609	M524-M533 HydrophobicContact CB-CE 4.45Å; M524-M533 HydrophobicContact CB-SD 4.12Å; M524-M533 HydrophobicContact CE-SD 3.66Å; M524-M533 HydrophobicContact CG-SD 3.95Å; M524-M533 VanDerWaalsContact O-CE 3.23Å; M524-M533 WeakPolarHBondContact O-CE 3.45Å; F530-M533 HydrophobicContact CD1-CE 4.37Å; F530-M533 PolarHBondContact O-N 3.16Å; M533-L537 HydrophobicContact CG-CB 4.31Å; M533-L537 HydrophobicContact CG-CD2 4.11Å; M533-L537 HydrophobicContact CG-CG 4.29Å; M533-L537 HydrophobicContact SD-CG 4.47Å; M533-R538 HydrophobicContact CE-CB 3.81Å; M533-R538 HydrophobicContact CE-CG 3.94Å; M533-R538 HydrophobicContact SD-CB 4.26Å; M533-F609 HydrophobicContact CB-CB 4.03Å; M533-F609 HydrophobicContact CB-CD2 4.07Å; M533-F609 HydrophobicContact CB-CG 4.11Å; M533-F609 HydrophobicContact CG-CG 4.4Å
534	P	90.9	Very high	91.7	Very high	42 Å²	42	68.2 Å²	68.2	27%	0.273	36%	0.358	S	S	.	.			trans	-54.6	134.3	174.4	-27.3	35.4	0	0	0	112.6	L536 L537 R538 Y604 C607	P534-L536 PolarHBondContact O-N 3.49Å; P534-L536 VanDerWaalsContact O-N 3.09Å; P534-L537 HydrophobicContact CB-CB 4.36Å; P534-L537 WeakPolarHBondContact O-CB 3.42Å; P534-L537 PolarHBondContact O-N 3.2Å; P534-R538 PolarHBondContact O-N 2.96Å; P534-Y604 HydrophobicContact CB-CD1 4.47Å; P534-Y604 HydrophobicContact CB-CE1 4.19Å; P534-Y604 HydrophobicContact CG-CD1 4.22Å; P534-Y604 HydrophobicContact CG-CE1 4.4Å; P534-C607 HydrophobicContact CG-CB 4.25Å
535	P	85.8	Confident	91.8	Very high	101 Å²	101	68.1 Å²	68.1	66%	0.656	36%	0.358	S	S	*	.	H	α-helix	trans	-56	-31.7	-179.6	-29.2	35.8	0	0	0	114.3	L537 R538	P535-L537 VanDerWaalsContact C-N 3.27Å; P535-L537 PolarHBondContact O-N 2.95Å; P535-R538 WeakPolarHBondContact O-CB 3.45Å
536	L	87.1	Confident	92.1	Very high	123 Å²	123	64.6 Å²	64.6	64%	0.644	34%	0.342	S	S	*	.	H	α-helix	trans	-74.5	-9.5	176.7	-63.7	177.5	0	0	0	114.6	P534 K540 Y604	P534-L536 PolarHBondContact O-N 3.49Å; P534-L536 VanDerWaalsContact O-N 3.09Å; L536-K540 VanDerWaalsContact O-CD 3.32Å; L536-K540 WeakPolarHBondContact O-CD 3.49Å; L536-K540 VanDerWaalsContact O-CE 3.27Å; L536-K540 WeakPolarHBondContact O-CE 3.35Å; L536-K540 WeakPolarHBondContact O-CG 3.45Å; L536-Y604 WeakPolarHBondContact CB-OH 3.42Å
537	L	91.3	Very high	92.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-92.5	-38.9	173.3	175.2	60	0	0	0	111.4	M524 M533 P534 P535 N539 K540 L544 I600 Y604 F610	M524-L537 HydrophobicContact CE-CD1 4.39Å; M524-L537 HydrophobicContact CE-CG 4.07Å; M524-L537 VanDerWaalsContact CE-O 3.28Å; M524-L537 WeakPolarHBondContact CE-O 3.32Å; M533-L537 HydrophobicContact CG-CB 4.31Å; M533-L537 HydrophobicContact CG-CD2 4.11Å; M533-L537 HydrophobicContact CG-CG 4.29Å; M533-L537 HydrophobicContact SD-CG 4.47Å; P534-L537 HydrophobicContact CB-CB 4.36Å; P534-L537 WeakPolarHBondContact O-CB 3.42Å; P534-L537 PolarHBondContact O-N 3.2Å; P535-L537 VanDerWaalsContact C-N 3.27Å; P535-L537 PolarHBondContact O-N 2.95Å; L537-N539 VanDerWaalsContact C-N 3.32Å; L537-N539 PolarHBondContact O-N 2.87Å; L537-K540 WeakPolarHBondContact O-CA 3.35Å; L537-K540 WeakPolarHBondContact O-CB 3.47Å; L537-K540 PolarHBondContact O-N 3.32Å; L537-L544 HydrophobicContact CD1-CD2 4.47Å; L537-I600 HydrophobicContact CD1-CG2 3.74Å; L537-Y604 HydrophobicContact CB-CD1 4.41Å; L537-Y604 HydrophobicContact CB-CD2 4.33Å; L537-Y604 HydrophobicContact CB-CE1 4.46Å; L537-Y604 HydrophobicContact CB-CE2 4.39Å; L537-Y604 HydrophobicContact CB-CG 4.34Å; L537-Y604 HydrophobicContact CD1-CD2 3.83Å; L537-Y604 HydrophobicContact CD1-CE2 4.4Å; L537-Y604 HydrophobicContact CD1-CG 4.2Å; L537-Y604 HydrophobicContact CD2-CG 4.26Å; L537-F610 HydrophobicContact CD1-CZ 4.25Å; L537-F610 HydrophobicContact CD2-CE2 3.76Å; L537-F610 HydrophobicContact CD2-CZ 3.76Å
538	R	85.6	Confident	92.6	Very high	74 Å²	74	59.1 Å²	59.1	28%	0.279	31%	0.308	S	S	.	.	H	α-helix	trans	-44.3	-54.4	176.7	-177.2	-174.7	-60.5	-80.8	-2.4	112.3	F530 M533 P534 P535 K540 K541	F530-R538 VanDerWaalsContact CB-NH2 3.31Å; F530-R538 VanDerWaalsContact CE2-NH1 3.32Å; M533-R538 HydrophobicContact CE-CB 3.81Å; M533-R538 HydrophobicContact CE-CG 3.94Å; M533-R538 HydrophobicContact SD-CB 4.26Å; P534-R538 PolarHBondContact O-N 2.96Å; P535-R538 WeakPolarHBondContact O-CB 3.45Å; R538-K540 PolarHBondContact O-N 2.86Å; R538-K541 PolarHBondContact O-N 2.95Å
539	N	86.5	Confident	92.8	Very high	142 Å²	142	52.6 Å²	52.6	76%	0.759	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	12.6	-177.4	-60.1	7.2	0	0	0	113.7	L537	L537-N539 VanDerWaalsContact C-N 3.32Å; L537-N539 PolarHBondContact O-N 2.87Å
540	K	93.1	Very high	93.1	Very high	80 Å²	80	56.1 Å²	56.1	35%	0.348	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	5.6	-179.4	-59.8	-169.5	-179.6	-172.6	0	114	L536 L537 R538 D542 V543 L544 I600	L536-K540 VanDerWaalsContact O-CD 3.32Å; L536-K540 WeakPolarHBondContact O-CD 3.49Å; L536-K540 VanDerWaalsContact O-CE 3.27Å; L536-K540 WeakPolarHBondContact O-CE 3.35Å; L536-K540 WeakPolarHBondContact O-CG 3.45Å; L537-K540 WeakPolarHBondContact O-CA 3.35Å; L537-K540 WeakPolarHBondContact O-CB 3.47Å; L537-K540 PolarHBondContact O-N 3.32Å; R538-K540 PolarHBondContact O-N 2.86Å; K540-D542 VanDerWaalsContact C-N 3.29Å; K540-D542 PolarHBondContact O-N 2.8Å; K540-V543 PolarHBondContact O-N 2.95Å; K540-L544 PolarHBondContact O-N 3.09Å; K540-I600 HydrophobicContact CB-CD1 4.04Å; K540-I600 HydrophobicContact CD-CD1 4.23Å; K540-I600 HydrophobicContact CD-CG1 4.11Å
541	K	92.9	Very high	93.5	Very high	37 Å²	37	52.8 Å²	52.8	16%	0.161	28%	0.284	C	S	.	.	H	α-helix	trans	-40.9	-51.5	174.2	-178.7	-172.6	175.3	-176.5	0	113.2	R521 M524 D525 R538 V543 L544 F545	R521-K541 HydrophobicContact CG-CD 4.49Å; R521-K541 HydrophobicContact CG-CG 4.09Å; R521-K541 PolarHBondContact NH1-O 2.92Å; R521-K541 VanDerWaalsContact O-CE 3.25Å; R521-K541 WeakPolarHBondContact O-CE 3.33Å; M524-K541 HydrophobicContact CE-CB 3.9Å; M524-K541 HydrophobicContact SD-CB 3.95Å; M524-K541 HydrophobicContact SD-CG 4.01Å; D525-K541 IonicContact OD1-NZ 2.72Å; D525-K541 PolarHBondContact OD1-NZ 2.99Å; D525-K541 IonicContact OD2-NZ 3.14Å; D525-K541 PolarHBondContact OD2-NZ 2.42Å; R538-K541 PolarHBondContact O-N 2.95Å; K541-V543 VanDerWaalsContact C-N 3.35Å; K541-V543 PolarHBondContact O-N 2.97Å; K541-L544 PolarHBondContact O-N 3.09Å; K541-F545 HydrophobicContact CG-CD2 4.39Å; K541-F545 VanDerWaalsContact O-CD2 3.29Å; K541-F545 WeakPolarHBondContact O-CD2 3.2Å; K541-F545 PolarHBondContact O-N 2.87Å
542	D	94.3	Very high	93.7	Very high	98 Å²	98	47 Å²	47	52%	0.524	25%	0.25	S	S	.	.	H	α-helix	trans	-73.3	-25	-176.9	-58.3	-55.8	0	0	0	114.1	R521 K540 G546	R521-D542 IonicContact CZ-OD1 2.58Å; R521-D542 IonicContact NH1-OD1 3.37Å; R521-D542 PolarHBondContact NH1-OD1 2.6Å; R521-D542 IonicContact NH2-OD1 3.12Å; R521-D542 PolarHBondContact NH2-OD1 2.86Å; K540-D542 VanDerWaalsContact C-N 3.29Å; K540-D542 PolarHBondContact O-N 2.8Å; D542-G546 WeakPolarHBondContact O-CA 3.48Å; D542-G546 PolarHBondContact O-N 3.49Å
543	V	96.3	Very high	94	Very high	52 Å²	52	48.9 Å²	48.9	32%	0.315	26%	0.257	S	S	.	.	H	α-helix	trans	-82.9	-28.1	173.4	-169	0	0	0	0	110.8	K540 K541 N593 R596 S597 I600	K540-V543 PolarHBondContact O-N 2.95Å; K541-V543 VanDerWaalsContact C-N 3.35Å; K541-V543 PolarHBondContact O-N 2.97Å; V543-N593 PolarHBondContact O-ND2 3.18Å; V543-R596 HydrophobicContact CG1-CB 3.57Å; V543-S597 VanDerWaalsContact O-CA 3.29Å; V543-S597 WeakPolarHBondContact O-CA 3.46Å; V543-S597 VanDerWaalsContact O-CB 3.32Å; V543-S597 WeakPolarHBondContact O-CB 3.32Å; V543-S597 PolarHBondContact O-N 3.13Å; V543-I600 HydrophobicContact CB-CD1 3.52Å; V543-I600 HydrophobicContact CG1-CD1 3.44Å; V543-I600 VanDerWaalsContact CG1-CD1 3.44Å
544	L	97.1	Very high	94.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71.1	-49.2	175.8	-179.6	61.6	0	0	0	112.3	M524 L537 K540 K541 S597 I600 F610 L623 L627	M524-L544 HydrophobicContact SD-CD2 4.41Å; L537-L544 HydrophobicContact CD1-CD2 4.47Å; K540-L544 PolarHBondContact O-N 3.09Å; K541-L544 PolarHBondContact O-N 3.09Å; L544-S597 VanDerWaalsContact O-CB 3.23Å; L544-S597 WeakPolarHBondContact O-CB 3.44Å; L544-S597 PolarHBondContact O-OG 3.23Å; L544-I600 HydrophobicContact CB-CG2 4.42Å; L544-I600 HydrophobicContact CD1-CB 4.42Å; L544-I600 HydrophobicContact CD1-CG2 4.11Å; L544-F610 HydrophobicContact CD2-CE1 3.87Å; L544-F610 HydrophobicContact CD2-CZ 3.6Å; L544-L623 HydrophobicContact CD2-CD2 4.42Å; L544-L627 HydrophobicContact CD1-CD1 3.9Å; L544-L627 HydrophobicContact CG-CD1 4.42Å
545	F	97.9	Very high	94.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-95	-10.6	-178.6	-60.4	-81.8	0	0	0	114	V516 R521 M524 K541 N547 M548 Y590 L623 L627	V516-F545 HydrophobicContact CG1-CD1 3.82Å; V516-F545 HydrophobicContact CG1-CE1 3.6Å; R521-F545 HydrophobicContact CB-CD1 4.09Å; R521-F545 HydrophobicContact CB-CD2 3.68Å; R521-F545 HydrophobicContact CB-CE1 4.02Å; R521-F545 HydrophobicContact CB-CE2 3.61Å; R521-F545 HydrophobicContact CB-CG 3.95Å; R521-F545 HydrophobicContact CB-CZ 3.8Å; R521-F545 HydrophobicContact CG-CD2 3.6Å; R521-F545 HydrophobicContact CG-CE2 3.94Å; R521-F545 HydrophobicContact CG-CG 4.01Å; M524-F545 HydrophobicContact SD-CE2 3.73Å; K541-F545 HydrophobicContact CG-CD2 4.39Å; K541-F545 VanDerWaalsContact O-CD2 3.29Å; K541-F545 WeakPolarHBondContact O-CD2 3.2Å; K541-F545 PolarHBondContact O-N 2.87Å; F545-N547 PolarHBondContact O-N 3.16Å; F545-M548 HydrophobicContact CB-CB 4.5Å; F545-M548 VanDerWaalsContact O-CB 3.27Å; F545-M548 WeakPolarHBondContact O-CB 3.23Å; F545-M548 PolarHBondContact O-N 3.45Å; F545-M548 VanDerWaalsContact O-N 3.16Å; F545-Y590 WeakPolarHBondContact O-CE2 3.22Å; F545-L623 HydrophobicContact CE1-CD1 4.03Å; F545-L623 HydrophobicContact CE1-CD2 4.05Å; F545-L623 HydrophobicContact CZ-CD2 4.05Å; F545-L627 HydrophobicContact CD1-CD2 3.73Å; F545-L627 HydrophobicContact CE1-CD2 4.25Å
546	G	97.4	Very high	95.1	Very high	13 Å²	13	44.9 Å²	44.9	13%	0.134	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	-140.6	-172.9	0	0	0	0	0	111.7	D542 M548 N593	D542-G546 WeakPolarHBondContact O-CA 3.48Å; D542-G546 PolarHBondContact O-N 3.49Å; G546-M548 VanDerWaalsContact C-N 3.32Å; G546-M548 PolarHBondContact O-N 3.2Å; G546-N593 VanDerWaalsContact CA-ND2 3.27Å; G546-N593 WeakPolarHBondContact CA-ND2 3.4Å; G546-N593 PolarHBondContact N-ND2 3.2Å
547	N	98.1	Very high	95.3	Very high	14 Å²	14	44 Å²	44	8%	0.075	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	33.9	173.9	65.5	-43.7	0	0	0	113.7	F545 A549 E550 I551 M586 K589 Y590	F545-N547 PolarHBondContact O-N 3.16Å; N547-A549 PolarHBondContact O-N 3.2Å; N547-A549 VanDerWaalsContact O-N 3.12Å; N547-E550 HydrophobicContact CB-CB 4.13Å; N547-E550 WeakPolarHBondContact CB-OE2 3.47Å; N547-E550 PolarHBondContact ND2-OE2 3.44Å; N547-E550 WeakPolarHBondContact O-CB 3.19Å; N547-E550 PolarHBondContact O-N 3.12Å; N547-I551 PolarHBondContact O-N 2.89Å; N547-M586 PolarHBondContact ND2-O 3.08Å; N547-K589 HydrophobicContact CB-CD 4.15Å; N547-K589 HydrophobicContact CB-CG 4.3Å; N547-Y590 WeakPolarHBondContact OD1-CA 3.39Å; N547-Y590 VanDerWaalsContact OD1-CB 3.24Å; N547-Y590 WeakPolarHBondContact OD1-CB 3.48Å; N547-Y590 PolarHBondContact OD1-N 2.84Å; N547-Y590 VanDerWaalsContact OD1-N 3.11Å
548	M	98.4	Very high	95.5	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-56.2	-28.3	176.9	-176.8	171.9	-82.9	0	0	113.5	L513 V516 L517 F545 G546 Y552 Y590 L627 P630	L513-M548 HydrophobicContact CD2-CE 3.85Å; L513-M548 HydrophobicContact CD2-CG 3.98Å; L513-M548 HydrophobicContact CD2-SD 4Å; V516-M548 HydrophobicContact CB-SD 4Å; V516-M548 HydrophobicContact CG1-SD 3.55Å; V516-M548 VanDerWaalsContact CG1-SD 3.55Å; L517-M548 HydrophobicContact CD1-CG 4.45Å; L517-M548 HydrophobicContact CD2-CB 4.06Å; L517-M548 HydrophobicContact CD2-CG 3.91Å; L517-M548 HydrophobicContact CD2-SD 4.37Å; L517-M548 HydrophobicContact CG-CG 4.19Å; L517-M548 HydrophobicContact CG-SD 4.48Å; F545-M548 HydrophobicContact CB-CB 4.5Å; F545-M548 VanDerWaalsContact O-CB 3.27Å; F545-M548 WeakPolarHBondContact O-CB 3.23Å; F545-M548 PolarHBondContact O-N 3.45Å; F545-M548 VanDerWaalsContact O-N 3.16Å; G546-M548 VanDerWaalsContact C-N 3.32Å; G546-M548 PolarHBondContact O-N 3.2Å; M548-Y552 WeakPolarHBondContact O-CB 3.44Å; M548-Y552 PolarHBondContact O-N 2.95Å; M548-Y590 HydrophobicContact CB-CE2 4.09Å; M548-Y590 HydrophobicContact CE-CE2 4.3Å; M548-Y590 WeakPolarHBondContact CE-OH 3.3Å; M548-L627 HydrophobicContact CE-CD2 4.04Å; M548-P630 HydrophobicContact CE-CG 3.87Å
549	A	96.6	Very high	96	Very high	25 Å²	25	43.5 Å²	43.5	21%	0.207	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-49.2	175.7	0	0	0	0	0	112.5	L517 N547 I551 Y552 E553	L517-A549 HydrophobicContact CD2-CB 4.19Å; N547-A549 PolarHBondContact O-N 3.2Å; N547-A549 VanDerWaalsContact O-N 3.12Å; A549-I551 VanDerWaalsContact C-N 3.27Å; A549-I551 PolarHBondContact O-N 2.76Å; A549-Y552 PolarHBondContact O-N 3.19Å; A549-Y552 VanDerWaalsContact O-N 3.12Å; A549-E553 WeakPolarHBondContact O-CB 3.29Å; A549-E553 WeakPolarHBondContact O-CG 3.44Å; A549-E553 PolarHBondContact O-N 3.45Å
550	E	98.2	Very high	96.4	Very high	77 Å²	77	38.6 Å²	38.6	36%	0.36	20%	0.199	S	C	.	.	H	α-helix	trans	-55.8	-42.7	174.8	-176.5	179.9	-128.1	0	0	111.3	N547 E553 F554 M586 K589	N547-E550 HydrophobicContact CB-CB 4.13Å; N547-E550 WeakPolarHBondContact CB-OE2 3.47Å; N547-E550 PolarHBondContact ND2-OE2 3.44Å; N547-E550 WeakPolarHBondContact O-CB 3.19Å; N547-E550 PolarHBondContact O-N 3.12Å; E550-E553 PolarHBondContact O-N 3.19Å; E550-F554 PolarHBondContact O-N 2.89Å; E550-F554 VanDerWaalsContact O-N 3.12Å; E550-M586 HydrophobicContact CG-CB 4.45Å; E550-M586 HydrophobicContact CG-SD 4.46Å; E550-K589 IonicContact OE1-NZ 3.28Å; E550-K589 PolarHBondContact OE1-NZ 2.94Å; E550-K589 WeakPolarHBondContact OE2-CD 3.21Å; E550-K589 WeakPolarHBondContact OE2-CE 3.49Å; E550-K589 IonicContact OE2-NZ 2.66Å; E550-K589 PolarHBondContact OE2-NZ 2.74Å
551	I	98.5	Very high	96.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-48.5	175	-65.7	178.1	0	0	0	111.4	Y509 L513 N547 A549 E553 H555 M586 Y587 Y590 P630	Y509-I551 VanDerWaalsContact OH-CG2 3.25Å; Y509-I551 WeakPolarHBondContact OH-CG2 3.46Å; L513-I551 HydrophobicContact CD1-CG2 3.89Å; N547-I551 PolarHBondContact O-N 2.89Å; A549-I551 VanDerWaalsContact C-N 3.27Å; A549-I551 PolarHBondContact O-N 2.76Å; I551-E553 VanDerWaalsContact C-N 3.34Å; I551-E553 PolarHBondContact O-N 3.48Å; I551-H555 WeakPolarHBondContact O-CB 3.19Å; I551-H555 PolarHBondContact O-CD2 3.47Å; I551-H555 PolarHBondContact O-N 3.33Å; I551-M586 HydrophobicContact CB-CE 4.18Å; I551-M586 HydrophobicContact CB-SD 4.29Å; I551-M586 HydrophobicContact CG1-CE 3.99Å; I551-M586 HydrophobicContact CG1-CG 3.92Å; I551-M586 HydrophobicContact CG1-SD 3.79Å; I551-M586 HydrophobicContact CG2-CE 4.14Å; I551-Y587 HydrophobicContact CD1-CD1 4.08Å; I551-Y587 HydrophobicContact CD1-CE1 4.17Å; I551-Y587 HydrophobicContact CD1-CG 4.41Å; I551-Y587 HydrophobicContact CG2-CE1 4.24Å; I551-Y587 HydrophobicContact CG2-CE2 4.39Å; I551-Y590 HydrophobicContact CD1-CD2 3.89Å; I551-Y590 HydrophobicContact CD1-CG 3.88Å; I551-P630 HydrophobicContact CD1-CB 4.23Å
552	Y	98.3	Very high	96.3	Very high	39 Å²	39	40.1 Å²	40.1	15%	0.153	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-43.8	176.8	166.7	-103.9	0	0	0	112.1	V510 L513 F514 L517 M548 A549 H555 N556	V510-Y552 HydrophobicContact CG1-CD2 4.28Å; V510-Y552 HydrophobicContact CG1-CE2 3.83Å; L513-Y552 HydrophobicContact CB-CD2 3.97Å; L513-Y552 HydrophobicContact CB-CG 4.41Å; F514-Y552 HydrophobicContact CB-CD2 4.35Å; F514-Y552 HydrophobicContact CB-CE2 3.72Å; F514-Y552 HydrophobicContact CD2-CE1 4.2Å; F514-Y552 HydrophobicContact CD2-CE2 4.18Å; F514-Y552 AromaticContact CD2-CZ 3.67Å; F514-Y552 WeakPolarHBondContact CD2-OH 3.42Å; F514-Y552 HydrophobicContact CG-CE2 4.39Å; L517-Y552 HydrophobicContact CD1-CD1 3.73Å; L517-Y552 HydrophobicContact CD1-CD2 4.44Å; L517-Y552 HydrophobicContact CD1-CG 3.58Å; M548-Y552 WeakPolarHBondContact O-CB 3.44Å; M548-Y552 PolarHBondContact O-N 2.95Å; A549-Y552 PolarHBondContact O-N 3.19Å; A549-Y552 VanDerWaalsContact O-N 3.12Å; Y552-H555 PolarHBondContact O-N 3.13Å; Y552-N556 HydrophobicContact CD2-CB 4.16Å; Y552-N556 HydrophobicContact CE1-CB 4.35Å; Y552-N556 HydrophobicContact CE2-CB 3.72Å; Y552-N556 WeakPolarHBondContact O-CB 3.42Å; Y552-N556 PolarHBondContact O-N 2.84Å; Y552-N556 PolarHBondContact OH-OD1 2.93Å
553	E	96.8	Very high	96.2	Very high	104 Å²	104	35.4 Å²	35.4	49%	0.486	19%	0.185	S	C	.	.	H	α-helix	trans	-63.7	-45.9	-178.4	-74.7	162.5	-151.9	0	0	111.9	A549 E550 I551 N557	A549-E553 WeakPolarHBondContact O-CB 3.29Å; A549-E553 WeakPolarHBondContact O-CG 3.44Å; A549-E553 PolarHBondContact O-N 3.45Å; E550-E553 PolarHBondContact O-N 3.19Å; I551-E553 VanDerWaalsContact C-N 3.34Å; I551-E553 PolarHBondContact O-N 3.48Å; E553-N557 WeakPolarHBondContact O-CB 3.36Å; E553-N557 PolarHBondContact O-N 3.2Å; E553-N557 PolarHBondContact O-ND2 2.96Å
554	F	98	Very high	96.1	Very high	15 Å²	15	35.9 Å²	35.9	7%	0.066	18%	0.183	C	C	.	.	H	α-helix	trans	-60.4	-48.2	172.9	166.8	-95.2	0	0	0	112	E550 I558 F559 R580 D583 F584 M586	E550-F554 PolarHBondContact O-N 2.89Å; E550-F554 VanDerWaalsContact O-N 3.12Å; F554-I558 HydrophobicContact CD2-CB 4.35Å; F554-I558 HydrophobicContact CD2-CD1 4.21Å; F554-I558 HydrophobicContact CE2-CG2 4.42Å; F554-I558 WeakPolarHBondContact O-CB 3.47Å; F554-I558 PolarHBondContact O-N 3.1Å; F554-F559 HydrophobicContact CD1-CB 4.14Å; F554-F559 HydrophobicContact CE1-CB 3.58Å; F554-F559 HydrophobicContact CE1-CD2 4.17Å; F554-F559 AromaticContact CE1-CG 3.84Å; F554-F559 HydrophobicContact CE1-CG 3.84Å; F554-F559 HydrophobicContact CZ-CB 3.81Å; F554-F559 AromaticContact CZ-CD2 3.88Å; F554-F559 HydrophobicContact CZ-CD2 3.88Å; F554-F559 AromaticContact CZ-CG 4Å; F554-F559 HydrophobicContact CZ-CG 4Å; F554-F559 PolarHBondContact O-N 3.29Å; F554-R580 HydrophobicContact CE2-CB 4.12Å; F554-R580 HydrophobicContact CE2-CG 4.32Å; F554-R580 HydrophobicContact CZ-CB 3.87Å; F554-R580 HydrophobicContact CZ-CG 4.28Å; F554-D583 HydrophobicContact CD2-CB 3.62Å; F554-D583 HydrophobicContact CE2-CB 3.27Å; F554-D583 WeakPolarHBondContact CE2-OD2 3.19Å; F554-D583 HydrophobicContact CG-CB 4.5Å; F554-D583 HydrophobicContact CZ-CB 3.88Å; F554-F584 HydrophobicContact CE1-CD1 4.42Å; F554-F584 HydrophobicContact CE1-CE1 4.1Å; F554-F584 HydrophobicContact CE1-CZ 4.21Å; F554-F584 HydrophobicContact CZ-CE2 4.44Å; F554-F584 HydrophobicContact CZ-CZ 4.41Å; F554-M586 HydrophobicContact CB-CE 3.82Å; F554-M586 HydrophobicContact CB-SD 3.99Å; F554-M586 HydrophobicContact CD1-CE 3.33Å; F554-M586 HydrophobicContact CD1-SD 4.48Å; F554-M586 HydrophobicContact CE1-CE 4.08Å; F554-M586 HydrophobicContact CG-CE 3.76Å; F554-M586 HydrophobicContact CG-SD 4.35Å
555	H	98.2	Very high	95.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.202	C	C	.	.	I	π-helix	trans	-67.8	-42	-176	-81.5	-73.7	0	0	0	112.3	E506 Y509 V510 I551 Y552 F559 M560 F584 Y587 Y637	E506-H555 IonicContact OE1-CE1 2.71Å; E506-H555 IonicContact OE1-CG 3.1Å; E506-H555 IonicContact OE1-ND1 3.32Å; E506-H555 PolarHBondContact OE1-ND1 3.03Å; Y509-H555 AromaticContact CE1-CD2 3.89Å; Y509-H555 AromaticContact CE1-CG 3.96Å; V510-H555 HydrophobicContact CG2-CB 3.9Å; I551-H555 WeakPolarHBondContact O-CB 3.19Å; I551-H555 PolarHBondContact O-CD2 3.47Å; I551-H555 PolarHBondContact O-N 3.33Å; Y552-H555 PolarHBondContact O-N 3.13Å; H555-F559 AromaticContact CE1-CD1 3.69Å; H555-F559 AromaticContact ND1-CD1 3.58Å; H555-M560 WeakPolarHBondContact O-CB 3.28Å; H555-M560 PolarHBondContact O-N 2.58Å; H555-F584 AromaticContact CE1-CE1 3.81Å; H555-Y587 PolarHBondContact CD2-OH 3.15Å; H555-Y587 AromaticContact NE2-CE2 3.47Å; H555-Y587 WeakPolarHBondContact NE2-CE2 3.29Å; H555-Y587 AromaticContact NE2-CZ 3.55Å; H555-Y587 PolarHBondContact NE2-OH 3.08Å; H555-Y637 PolarHBondContact CE1-OH 3.46Å
556	N	96.4	Very high	95.4	Very high	50 Å²	50	39.5 Å²	39.5	27%	0.267	20%	0.203	S	C	.	.	I	π-helix	trans	-71.9	-44.2	179.2	-172	87	0	0	0	113	V510 Y552	V510-N556 HydrophobicContact CG1-CB 3.84Å; V510-N556 VanDerWaalsContact CG1-OD1 3.27Å; V510-N556 WeakPolarHBondContact CG1-OD1 3.49Å; Y552-N556 HydrophobicContact CD2-CB 4.16Å; Y552-N556 HydrophobicContact CE1-CB 4.35Å; Y552-N556 HydrophobicContact CE2-CB 3.72Å; Y552-N556 WeakPolarHBondContact O-CB 3.42Å; Y552-N556 PolarHBondContact O-N 2.84Å; Y552-N556 PolarHBondContact OH-OD1 2.93Å
557	N	92.9	Very high	94.9	Very high	105 Å²	105	41.8 Å²	41.8	56%	0.561	22%	0.217	S	C	*	.	I	π-helix	trans	-94.1	-18.2	-168.3	-54.3	-23.2	0	0	0	113.6	E553	E553-N557 WeakPolarHBondContact O-CB 3.36Å; E553-N557 PolarHBondContact O-N 3.2Å; E553-N557 PolarHBondContact O-ND2 2.96Å
558	I	94.1	Very high	94.1	Very high	63 Å²	63	48.4 Å²	48.4	32%	0.323	25%	0.252	S	S	.	.	I	π-helix	trans	-128.7	-61.1	-174.8	-53	178	0	0	0	110.9	F554 R562	F554-I558 HydrophobicContact CD2-CB 4.35Å; F554-I558 HydrophobicContact CD2-CD1 4.21Å; F554-I558 HydrophobicContact CE2-CG2 4.42Å; F554-I558 WeakPolarHBondContact O-CB 3.47Å; F554-I558 PolarHBondContact O-N 3.1Å; I558-R562 WeakPolarHBondContact O-CG 3.25Å; I558-R562 PolarHBondContact O-N 3.32Å
559	F	96.3	Very high	93.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-74.6	-40.4	-163.1	-162.9	-115.4	0	0	0	114.1	F554 H555 R562 L563 F577 R580 F584 Y637	F554-F559 HydrophobicContact CD1-CB 4.14Å; F554-F559 HydrophobicContact CE1-CB 3.58Å; F554-F559 HydrophobicContact CE1-CD2 4.17Å; F554-F559 AromaticContact CE1-CG 3.84Å; F554-F559 HydrophobicContact CE1-CG 3.84Å; F554-F559 HydrophobicContact CZ-CB 3.81Å; F554-F559 AromaticContact CZ-CD2 3.88Å; F554-F559 HydrophobicContact CZ-CD2 3.88Å; F554-F559 AromaticContact CZ-CG 4Å; F554-F559 HydrophobicContact CZ-CG 4Å; F554-F559 PolarHBondContact O-N 3.29Å; H555-F559 AromaticContact CE1-CD1 3.69Å; H555-F559 AromaticContact ND1-CD1 3.58Å; F559-R562 PolarHBondContact O-N 3.17Å; F559-L563 HydrophobicContact CD1-CD1 3.85Å; F559-L563 HydrophobicContact CD1-CG 4.27Å; F559-L563 HydrophobicContact CE1-CD1 3.39Å; F559-L563 HydrophobicContact CE1-CD2 4.41Å; F559-L563 HydrophobicContact CE1-CG 3.88Å; F559-L563 HydrophobicContact CZ-CD1 3.96Å; F559-L563 HydrophobicContact CZ-CD2 4.13Å; F559-L563 HydrophobicContact CZ-CG 3.99Å; F559-L563 PolarHBondContact O-N 3.45Å; F559-F577 HydrophobicContact CE1-CE1 4.27Å; F559-F577 HydrophobicContact CE1-CZ 4.12Å; F559-F577 AromaticContact CZ-CD1 3.97Å; F559-F577 HydrophobicContact CZ-CD1 3.97Å; F559-F577 HydrophobicContact CZ-CD2 4.12Å; F559-F577 AromaticContact CZ-CE1 3.65Å; F559-F577 HydrophobicContact CZ-CE1 3.65Å; F559-F577 AromaticContact CZ-CE2 3.82Å; F559-F577 HydrophobicContact CZ-CE2 3.82Å; F559-F577 HydrophobicContact CZ-CG 4.21Å; F559-F577 AromaticContact CZ-CZ 3.58Å; F559-F577 HydrophobicContact CZ-CZ 3.58Å; F559-R580 HydrophobicContact CD2-CG 4.35Å; F559-F584 HydrophobicContact CD1-CZ 4.3Å; F559-F584 HydrophobicContact CD2-CZ 4.18Å; F559-F584 AromaticContact CE1-CZ 3.86Å; F559-F584 HydrophobicContact CE1-CZ 3.86Å; F559-F584 HydrophobicContact CE2-CE2 4.02Å; F559-F584 AromaticContact CE2-CZ 3.76Å; F559-F584 HydrophobicContact CE2-CZ 3.76Å; F559-F584 HydrophobicContact CG-CZ 4.45Å; F559-F584 HydrophobicContact CZ-CE2 4.21Å; F559-F584 AromaticContact CZ-CZ 3.6Å; F559-F584 HydrophobicContact CZ-CZ 3.6Å; F559-Y637 HydrophobicContact CE1-CE1 4.03Å
560	M	94.4	Very high	92.9	Very high	39 Å²	39	48.9 Å²	48.9	19%	0.192	26%	0.255	C	S	.	.	H	α-helix	trans	-59	-50.4	178.8	-177.2	179.4	71.5	0	0	111.6	E506 R507 V510 H555 R562 L563 E564	E506-M560 HydrophobicContact CG-CB 4.13Å; E506-M560 HydrophobicContact CG-CG 4.25Å; R507-M560 HydrophobicContact CG-CG 4.43Å; R507-M560 HydrophobicContact CG-SD 4.07Å; V510-M560 HydrophobicContact CB-SD 4.3Å; V510-M560 HydrophobicContact CG1-SD 4.29Å; V510-M560 HydrophobicContact CG2-CB 4.44Å; V510-M560 HydrophobicContact CG2-SD 4.2Å; H555-M560 WeakPolarHBondContact O-CB 3.28Å; H555-M560 PolarHBondContact O-N 2.58Å; M560-R562 VanDerWaalsContact C-N 3.3Å; M560-R562 PolarHBondContact O-N 3Å; M560-L563 PolarHBondContact O-N 3.28Å; M560-L563 VanDerWaalsContact O-N 3.16Å; M560-E564 WeakPolarHBondContact O-CG 3.42Å; M560-E564 PolarHBondContact O-N 3.16Å
561	S	91.6	Very high	92.2	Very high	57 Å²	57	49.6 Å²	49.6	40%	0.399	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-38.4	177.2	166.1	0	0	0	0	112.2	E564 D565	S561-E564 PolarHBondContact O-N 2.98Å; S561-D565 VanDerWaalsContact O-CG 3.31Å; S561-D565 PolarHBondContact O-N 3.25Å
562	R	92.3	Very high	91.7	Very high	91 Å²	91	54.8 Å²	54.8	34%	0.343	28%	0.278	S	S	.	.	H	α-helix	trans	-72	-27.2	178.1	-69.2	-69	177.5	120	-8.8	113.7	I558 F559 M560 C566 C576 E579	I558-R562 WeakPolarHBondContact O-CG 3.25Å; I558-R562 PolarHBondContact O-N 3.32Å; F559-R562 PolarHBondContact O-N 3.17Å; M560-R562 VanDerWaalsContact C-N 3.3Å; M560-R562 PolarHBondContact O-N 3Å; R562-C566 PolarHBondContact O-SG 2.97Å; R562-C576 VanDerWaalsContact CB-SG 3.58Å; R562-E579 IonicContact NH1-OE1 3.21Å; R562-E579 IonicContact NH1-OE2 3.89Å; R562-E579 PolarHBondContact NH1-OE2 3.03Å
563	L	93.3	Very high	91.5	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-75.6	-36	168.2	-75.6	-178.4	0	0	0	112.2	L502 I503 E506 F559 M560 C566 F577	L502-L563 HydrophobicContact CD1-CD1 4.13Å; L502-L563 HydrophobicContact CD2-CD2 3.88Å; L502-L563 HydrophobicContact CG-CD1 4.12Å; L502-L563 HydrophobicContact CG-CD2 4.26Å; I503-L563 WeakPolarHBondContact CD1-O 3.44Å; I503-L563 HydrophobicContact CG1-CB 4.32Å; E506-L563 HydrophobicContact CB-CD1 4.19Å; E506-L563 HydrophobicContact CG-CD1 4.02Å; F559-L563 HydrophobicContact CD1-CD1 3.85Å; F559-L563 HydrophobicContact CD1-CG 4.27Å; F559-L563 HydrophobicContact CE1-CD1 3.39Å; F559-L563 HydrophobicContact CE1-CD2 4.41Å; F559-L563 HydrophobicContact CE1-CG 3.88Å; F559-L563 HydrophobicContact CZ-CD1 3.96Å; F559-L563 HydrophobicContact CZ-CD2 4.13Å; F559-L563 HydrophobicContact CZ-CG 3.99Å; F559-L563 PolarHBondContact O-N 3.45Å; M560-L563 PolarHBondContact O-N 3.28Å; M560-L563 VanDerWaalsContact O-N 3.16Å; L563-C566 WeakPolarHBondContact O-CB 3.25Å; L563-C566 PolarHBondContact O-N 2.95Å; L563-C566 VanDerWaalsContact O-N 3.08Å; L563-F577 HydrophobicContact CD2-CE2 4.12Å
564	E	92.8	Very high	91.4	Very high	61 Å²	61	48 Å²	48	29%	0.285	25%	0.248	S	C	.	.	H	α-helix	trans	-64.3	-40.2	173.9	-69.6	174.8	134.5	0	0	111.4	I503 R507 M560 S561 C566 S567	I503-E564 HydrophobicContact CG2-CG 3.97Å; R507-E564 IonicContact CZ-OE1 3.18Å; R507-E564 IonicContact NE-OE1 2.76Å; R507-E564 PolarHBondContact NE-OE1 3.05Å; R507-E564 IonicContact NH2-OE1 2.75Å; R507-E564 PolarHBondContact NH2-OE1 3.49Å; M560-E564 WeakPolarHBondContact O-CG 3.42Å; M560-E564 PolarHBondContact O-N 3.16Å; S561-E564 PolarHBondContact O-N 2.98Å; E564-C566 PolarHBondContact O-N 2.79Å; E564-S567 VanDerWaalsContact O-CB 3.23Å; E564-S567 WeakPolarHBondContact O-CB 3.24Å; E564-S567 PolarHBondContact O-N 2.97Å
565	D	90.3	Very high	91.3	Very high	75 Å²	75	49.5 Å²	49.5	40%	0.401	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-18	170	-75.7	-10.3	0	0	0	113.9	S561 R572	S561-D565 VanDerWaalsContact O-CG 3.31Å; S561-D565 PolarHBondContact O-N 3.25Å; D565-R572 PolarHBondContact O-NH1 2.87Å
566	C	90.3	Very high	91.1	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.007	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-7.9	178.7	-63.3	0	0	0	0	113.6	L499 R562 L563 E564 D568 A569 V573	L499-C566 HydrophobicContact CD1-CB 4.49Å; L499-C566 WeakPolarHBondContact CD2-O 3.3Å; R562-C566 PolarHBondContact O-SG 2.97Å; L563-C566 WeakPolarHBondContact O-CB 3.25Å; L563-C566 PolarHBondContact O-N 2.95Å; L563-C566 VanDerWaalsContact O-N 3.08Å; E564-C566 PolarHBondContact O-N 2.79Å; C566-D568 VanDerWaalsContact C-N 3.28Å; C566-D568 PolarHBondContact O-N 3.48Å; C566-A569 CarbonylContact O-C 3.58Å; C566-A569 VanDerWaalsContact O-C 3.24Å; C566-A569 PolarHBondContact O-N 2.76Å; C566-A569 VanDerWaalsContact O-N 3.09Å; C566-V573 HydrophobicContact CB-CG2 3.76Å
567	S	87.7	Confident	91.1	Very high	61 Å²	61	47.6 Å²	47.6	43%	0.427	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46	-50	-179.1	175.2	0	0	0	0	112.8	E564	E564-S567 VanDerWaalsContact O-CB 3.23Å; E564-S567 WeakPolarHBondContact O-CB 3.24Å; E564-S567 PolarHBondContact O-N 2.97Å
568	D	82	Confident	91.3	Very high	154 Å²	154	44.6 Å²	44.6	82%	0.824	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-1.4	-173	-50.3	-31.3	0	0	0	112.9	C566	C566-D568 VanDerWaalsContact C-N 3.28Å; C566-D568 PolarHBondContact O-N 3.48Å
569	A	84.6	Confident	91.4	Very high	20 Å²	20	46.6 Å²	46.6	17%	0.165	24%	0.241	C	C	.	.			trans	-148.9	72.1	-173.8	0	0	0	0	0	111.4	C566 E571 R572	C566-A569 CarbonylContact O-C 3.58Å; C566-A569 VanDerWaalsContact O-C 3.24Å; C566-A569 PolarHBondContact O-N 2.76Å; C566-A569 VanDerWaalsContact O-N 3.09Å; A569-E571 VanDerWaalsContact CA-OE1 3.25Å; A569-E571 WeakPolarHBondContact CA-OE1 3.43Å; A569-E571 WeakPolarHBondContact CB-OE1 3.41Å; A569-E571 PolarHBondContact O-N 2.84Å; A569-E571 VanDerWaalsContact O-N 3.13Å; A569-R572 HydrophobicContact CB-CG 4.01Å; A569-R572 VanDerWaalsContact O-CB 3.3Å; A569-R572 WeakPolarHBondContact O-CB 3.21Å; A569-R572 PolarHBondContact O-N 2.76Å
570	P	84.1	Confident	91.2	Very high	14 Å²	14	49.3 Å²	49.3	9%	0.091	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61.5	-26.3	-168.1	-24.2	33.9	0	0	0	114.9	L499 R572 V573	L499-P570 HydrophobicContact CD2-CB 3.94Å; L499-P570 HydrophobicContact CD2-CG 3.76Å; P570-R572 PolarHBondContact O-N 2.81Å; P570-V573 VanDerWaalsContact O-CB 3.3Å; P570-V573 WeakPolarHBondContact O-CB 3.3Å; P570-V573 WeakPolarHBondContact O-CG2 3.46Å; P570-V573 PolarHBondContact O-N 2.78Å
571	E	82.9	Confident	91.2	Very high	93 Å²	93	51.9 Å²	51.9	44%	0.435	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-59.2	-21.3	172.7	52.2	-71.7	157.7	0	0	113.6	K495 A569 V573 P575	K495-E571 IonicContact NZ-OE2 2.93Å; A569-E571 VanDerWaalsContact CA-OE1 3.25Å; A569-E571 WeakPolarHBondContact CA-OE1 3.43Å; A569-E571 WeakPolarHBondContact CB-OE1 3.41Å; A569-E571 PolarHBondContact O-N 2.84Å; A569-E571 VanDerWaalsContact O-N 3.13Å; E571-V573 VanDerWaalsContact C-N 3.25Å; E571-V573 PolarHBondContact O-N 2.92Å; E571-P575 VanDerWaalsContact O-CD 3.31Å; E571-P575 WeakPolarHBondContact O-CD 3.38Å
572	R	89.4	Confident	91.3	Very high	109 Å²	109	54.3 Å²	54.3	41%	0.411	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-72.6	-13.4	173.5	-63.6	-179.2	63.8	-149.6	-4.2	113.7	D565 A569 P570 G574 P575 C576	D565-R572 PolarHBondContact O-NH1 2.87Å; A569-R572 HydrophobicContact CB-CG 4.01Å; A569-R572 VanDerWaalsContact O-CB 3.3Å; A569-R572 WeakPolarHBondContact O-CB 3.21Å; A569-R572 PolarHBondContact O-N 2.76Å; P570-R572 PolarHBondContact O-N 2.81Å; R572-G574 VanDerWaalsContact C-N 3.34Å; R572-G574 PolarHBondContact O-N 2.92Å; R572-P575 WeakPolarHBondContact O-CD 3.48Å; R572-C576 WeakPolarHBondContact O-CB 3.48Å; R572-C576 PolarHBondContact O-N 2.93Å
573	V	94.2	Very high	91.4	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-42.5	177.9	175.2	0	0	0	0	111.3	L499 L502 C566 P570 E571 C576 F577 L641 L644 L657	L499-V573 HydrophobicContact CD1-CG2 3.8Å; L502-V573 HydrophobicContact CD2-CG1 3.95Å; C566-V573 HydrophobicContact CB-CG2 3.76Å; P570-V573 VanDerWaalsContact O-CB 3.3Å; P570-V573 WeakPolarHBondContact O-CB 3.3Å; P570-V573 WeakPolarHBondContact O-CG2 3.46Å; P570-V573 PolarHBondContact O-N 2.78Å; E571-V573 VanDerWaalsContact C-N 3.25Å; E571-V573 PolarHBondContact O-N 2.92Å; V573-C576 WeakPolarHBondContact O-CB 3.14Å; V573-C576 PolarHBondContact O-N 3.18Å; V573-F577 HydrophobicContact CG1-CD2 4.06Å; V573-F577 HydrophobicContact CG1-CE2 3.95Å; V573-F577 WeakPolarHBondContact O-CD2 3.46Å; V573-F577 PolarHBondContact O-N 2.99Å; V573-L641 HydrophobicContact CG1-CD2 3.82Å; V573-L644 HydrophobicContact CB-CD2 4.07Å; V573-L644 HydrophobicContact CG1-CD2 3.97Å; V573-L644 HydrophobicContact CG2-CD2 4.14Å; V573-L657 HydrophobicContact CG1-CD1 4.3Å
574	G	94.5	Very high	91.6	Very high	1 Å²	1	53 Å²	53	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-56	-59.3	176.4	0	0	0	0	0	112.5	R572 C576 F577 L578	R572-G574 VanDerWaalsContact C-N 3.34Å; R572-G574 PolarHBondContact O-N 2.92Å; G574-C576 VanDerWaalsContact C-N 3.31Å; G574-C576 PolarHBondContact O-N 3.2Å; G574-F577 PolarHBondContact O-N 3.21Å; G574-L578 WeakPolarHBondContact O-CG 3.25Å; G574-L578 PolarHBondContact O-N 3.26Å; G574-L578 VanDerWaalsContact O-N 3.14Å
575	P	94.6	Very high	91.6	Very high	45 Å²	45	54 Å²	54	29%	0.292	27%	0.274	S	S	.	.	H	α-helix	trans	-52.3	-41.1	171.8	-29.4	36.8	0	0	0	114.6	E571 R572 F577 L578 E579 K656	E571-P575 VanDerWaalsContact O-CD 3.31Å; E571-P575 WeakPolarHBondContact O-CD 3.38Å; R572-P575 WeakPolarHBondContact O-CD 3.48Å; P575-F577 VanDerWaalsContact C-N 3.3Å; P575-F577 PolarHBondContact O-N 2.78Å; P575-L578 PolarHBondContact O-N 3.28Å; P575-L578 VanDerWaalsContact O-N 3.11Å; P575-E579 PolarHBondContact O-N 3.03Å; P575-K656 HydrophobicContact CG-CB 4.23Å; P575-K656 HydrophobicContact CG-CG 4.44Å
576	C	94.8	Very high	91.9	Very high	7 Å²	7	51.4 Å²	51.4	5%	0.047	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-37.4	179.7	-178.1	0	0	0	0	113.3	R562 R572 V573 G574 R580	R562-C576 VanDerWaalsContact CB-SG 3.58Å; R572-C576 WeakPolarHBondContact O-CB 3.48Å; R572-C576 PolarHBondContact O-N 2.93Å; V573-C576 WeakPolarHBondContact O-CB 3.14Å; V573-C576 PolarHBondContact O-N 3.18Å; G574-C576 VanDerWaalsContact C-N 3.31Å; G574-C576 PolarHBondContact O-N 3.2Å; C576-R580 WeakPolarHBondContact O-CG 3.22Å
577	F	97.1	Very high	92.2	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-77	-40.4	173.1	-82.5	-95.2	0	0	0	112.1	L502 F559 L563 V573 G574 P575 E579 R580 K581 F584 Y637 L641 A660 M664	L502-F577 HydrophobicContact CD1-CZ 4.39Å; L502-F577 HydrophobicContact CD2-CE2 4.38Å; F559-F577 HydrophobicContact CE1-CE1 4.27Å; F559-F577 HydrophobicContact CE1-CZ 4.12Å; F559-F577 AromaticContact CZ-CD1 3.97Å; F559-F577 HydrophobicContact CZ-CD1 3.97Å; F559-F577 HydrophobicContact CZ-CD2 4.12Å; F559-F577 AromaticContact CZ-CE1 3.65Å; F559-F577 HydrophobicContact CZ-CE1 3.65Å; F559-F577 AromaticContact CZ-CE2 3.82Å; F559-F577 HydrophobicContact CZ-CE2 3.82Å; F559-F577 HydrophobicContact CZ-CG 4.21Å; F559-F577 AromaticContact CZ-CZ 3.58Å; F559-F577 HydrophobicContact CZ-CZ 3.58Å; L563-F577 HydrophobicContact CD2-CE2 4.12Å; V573-F577 HydrophobicContact CG1-CD2 4.06Å; V573-F577 HydrophobicContact CG1-CE2 3.95Å; V573-F577 WeakPolarHBondContact O-CD2 3.46Å; V573-F577 PolarHBondContact O-N 2.99Å; G574-F577 PolarHBondContact O-N 3.21Å; P575-F577 VanDerWaalsContact C-N 3.3Å; P575-F577 PolarHBondContact O-N 2.78Å; F577-E579 PolarHBondContact O-N 2.99Å; F577-R580 CarbonylContact O-C 3.57Å; F577-R580 PolarHBondContact O-N 3.13Å; F577-R580 VanDerWaalsContact O-N 3.09Å; F577-K581 PolarHBondContact O-N 2.84Å; F577-F584 AromaticContact CD1-CE2 3.85Å; F577-F584 HydrophobicContact CD1-CE2 3.85Å; F577-F584 AromaticContact CD1-CZ 3.97Å; F577-F584 HydrophobicContact CD1-CZ 3.97Å; F577-F584 HydrophobicContact CE1-CE2 4.33Å; F577-F584 AromaticContact CE1-CZ 3.97Å; F577-F584 HydrophobicContact CE1-CZ 3.97Å; F577-Y637 AromaticContact CE1-CD1 3.67Å; F577-Y637 HydrophobicContact CE1-CD1 3.67Å; F577-Y637 HydrophobicContact CE1-CD2 4.2Å; F577-Y637 HydrophobicContact CE1-CE1 4.23Å; F577-Y637 AromaticContact CE1-CG 3.65Å; F577-Y637 HydrophobicContact CE1-CG 3.65Å; F577-Y637 AromaticContact CZ-CD1 3.49Å; F577-Y637 HydrophobicContact CZ-CD1 3.49Å; F577-Y637 VanDerWaalsContact CZ-CD1 3.49Å; F577-Y637 HydrophobicContact CZ-CE1 4.02Å; F577-Y637 AromaticContact CZ-CG 3.95Å; F577-Y637 HydrophobicContact CZ-CG 3.95Å; F577-L641 HydrophobicContact CD1-CD1 4.15Å; F577-L641 HydrophobicContact CD2-CD1 4.39Å; F577-L641 HydrophobicContact CD2-CD2 3.79Å; F577-L641 HydrophobicContact CE1-CD1 4.16Å; F577-L641 HydrophobicContact CE2-CD1 4.39Å; F577-L641 HydrophobicContact CE2-CD2 3.73Å; F577-L641 HydrophobicContact CE2-CG 4.31Å; F577-L641 HydrophobicContact CG-CD1 4.27Å; F577-L641 HydrophobicContact CG-CD2 4.41Å; F577-L641 HydrophobicContact CZ-CD1 4.26Å; F577-L641 HydrophobicContact CZ-CD2 4.29Å; F577-L641 HydrophobicContact CZ-CG 4.4Å; F577-A660 HydrophobicContact CB-CB 3.86Å; F577-M664 HydrophobicContact CD1-CE 4.25Å; F577-M664 HydrophobicContact CD1-CG 3.96Å; F577-M664 HydrophobicContact CD1-SD 3.88Å; F577-M664 HydrophobicContact CE1-CE 4.19Å; F577-M664 HydrophobicContact CE1-CG 4.4Å; F577-M664 HydrophobicContact CE1-SD 4.4Å
578	L	96.1	Very high	92.5	Very high	42 Å²	42	49.3 Å²	49.3	22%	0.22	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-36.5	-177.7	-68.4	169.1	0	0	0	113.2	G574 P575 R580 K656 E659 A660	G574-L578 WeakPolarHBondContact O-CG 3.25Å; G574-L578 PolarHBondContact O-N 3.26Å; G574-L578 VanDerWaalsContact O-N 3.14Å; P575-L578 PolarHBondContact O-N 3.28Å; P575-L578 VanDerWaalsContact O-N 3.11Å; L578-R580 PolarHBondContact O-N 2.85Å; L578-K656 HydrophobicContact CD1-CB 4.32Å; L578-K656 HydrophobicContact CD1-CD 3.83Å; L578-E659 HydrophobicContact CD1-CB 3.91Å; L578-E659 HydrophobicContact CD2-CB 4.09Å; L578-A660 HydrophobicContact CG-CB 4.24Å
579	E	95.3	Very high	93.1	Very high	104 Å²	104	47.1 Å²	47.1	49%	0.486	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.2	171.5	-82.2	-174.2	-147.7	0	0	113.4	R562 P575 F577	R562-E579 IonicContact NH1-OE1 3.21Å; R562-E579 IonicContact NH1-OE2 3.89Å; R562-E579 PolarHBondContact NH1-OE2 3.03Å; P575-E579 PolarHBondContact O-N 3.03Å; F577-E579 PolarHBondContact O-N 2.99Å
580	R	93.9	Very high	93.6	Very high	58 Å²	58	46.2 Å²	46.2	22%	0.219	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.4	7.7	-168	-53.1	-62.3	156.5	-168.8	-11.2	114.1	F554 F559 C576 F577 L578 D582 D583 F584	F554-R580 HydrophobicContact CE2-CB 4.12Å; F554-R580 HydrophobicContact CE2-CG 4.32Å; F554-R580 HydrophobicContact CZ-CB 3.87Å; F554-R580 HydrophobicContact CZ-CG 4.28Å; F559-R580 HydrophobicContact CD2-CG 4.35Å; C576-R580 WeakPolarHBondContact O-CG 3.22Å; F577-R580 CarbonylContact O-C 3.57Å; F577-R580 PolarHBondContact O-N 3.13Å; F577-R580 VanDerWaalsContact O-N 3.09Å; L578-R580 PolarHBondContact O-N 2.85Å; R580-D582 PolarHBondContact O-N 3.4Å; R580-D583 WeakPolarHBondContact CD-OD2 3.35Å; R580-D583 IonicContact NH1-OD2 2.71Å; R580-D583 WeakPolarHBondContact O-CB 3.38Å; R580-D583 PolarHBondContact O-N 3.07Å; R580-D583 VanDerWaalsContact O-N 3.08Å; R580-F584 HydrophobicContact CB-CD2 4.4Å; R580-F584 HydrophobicContact CB-CE2 4.18Å; R580-F584 WeakPolarHBondContact O-CD2 3.24Å; R580-F584 PolarHBondContact O-N 3.37Å
581	K	93.2	Very high	94.1	Very high	92 Å²	92	46.2 Å²	46.2	40%	0.4	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-32	-176.8	75	-175.4	-172.7	177.6	0	113.6	F577	F577-K581 PolarHBondContact O-N 2.84Å
582	D	93.2	Very high	94.5	Very high	108 Å²	108	44.5 Å²	44.5	58%	0.578	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-32	-175.8	-60.4	-49.3	0	0	0	111.5	R580 F584 Q585	R580-D582 PolarHBondContact O-N 3.4Å; D582-F584 VanDerWaalsContact C-N 3.28Å; D582-F584 PolarHBondContact O-N 3.08Å; D582-Q585 WeakPolarHBondContact O-CB 3.12Å; D582-Q585 VanDerWaalsContact O-CG 3.23Å; D582-Q585 WeakPolarHBondContact O-CG 3.41Å; D582-Q585 PolarHBondContact O-N 2.93Å
583	D	95.8	Very high	94.7	Very high	65 Å²	65	40 Å²	40	35%	0.348	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-59.1	-41.5	170.7	-61.9	-55.7	0	0	0	110.6	F554 R580 Q585 M586	F554-D583 HydrophobicContact CD2-CB 3.62Å; F554-D583 HydrophobicContact CE2-CB 3.27Å; F554-D583 WeakPolarHBondContact CE2-OD2 3.19Å; F554-D583 HydrophobicContact CG-CB 4.5Å; F554-D583 HydrophobicContact CZ-CB 3.88Å; R580-D583 WeakPolarHBondContact CD-OD2 3.35Å; R580-D583 IonicContact NH1-OD2 2.71Å; R580-D583 WeakPolarHBondContact O-CB 3.38Å; R580-D583 PolarHBondContact O-N 3.07Å; R580-D583 VanDerWaalsContact O-N 3.08Å; D583-Q585 PolarHBondContact O-N 3.02Å; D583-M586 VanDerWaalsContact O-CG 3.25Å; D583-M586 WeakPolarHBondContact O-CG 3.4Å; D583-M586 PolarHBondContact O-N 2.78Å
584	F	96.5	Very high	94.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-59.7	-13.8	178.1	-77.9	-70.3	0	0	0	114.8	F554 H555 F559 F577 R580 D582 M586 Y587 I634 Y637 M664 L667	F554-F584 HydrophobicContact CE1-CD1 4.42Å; F554-F584 HydrophobicContact CE1-CE1 4.1Å; F554-F584 HydrophobicContact CE1-CZ 4.21Å; F554-F584 HydrophobicContact CZ-CE2 4.44Å; F554-F584 HydrophobicContact CZ-CZ 4.41Å; H555-F584 AromaticContact CE1-CE1 3.81Å; F559-F584 HydrophobicContact CD1-CZ 4.3Å; F559-F584 HydrophobicContact CD2-CZ 4.18Å; F559-F584 AromaticContact CE1-CZ 3.86Å; F559-F584 HydrophobicContact CE1-CZ 3.86Å; F559-F584 HydrophobicContact CE2-CE2 4.02Å; F559-F584 AromaticContact CE2-CZ 3.76Å; F559-F584 HydrophobicContact CE2-CZ 3.76Å; F559-F584 HydrophobicContact CG-CZ 4.45Å; F559-F584 HydrophobicContact CZ-CE2 4.21Å; F559-F584 AromaticContact CZ-CZ 3.6Å; F559-F584 HydrophobicContact CZ-CZ 3.6Å; F577-F584 AromaticContact CD1-CE2 3.85Å; F577-F584 HydrophobicContact CD1-CE2 3.85Å; F577-F584 AromaticContact CD1-CZ 3.97Å; F577-F584 HydrophobicContact CD1-CZ 3.97Å; F577-F584 HydrophobicContact CE1-CE2 4.33Å; F577-F584 AromaticContact CE1-CZ 3.97Å; F577-F584 HydrophobicContact CE1-CZ 3.97Å; R580-F584 HydrophobicContact CB-CD2 4.4Å; R580-F584 HydrophobicContact CB-CE2 4.18Å; R580-F584 WeakPolarHBondContact O-CD2 3.24Å; R580-F584 PolarHBondContact O-N 3.37Å; D582-F584 VanDerWaalsContact C-N 3.28Å; D582-F584 PolarHBondContact O-N 3.08Å; F584-M586 PolarHBondContact O-N 2.76Å; F584-M586 VanDerWaalsContact O-N 3.13Å; F584-Y587 HydrophobicContact CD1-CD2 4.09Å; F584-Y587 AromaticContact CD1-CE2 3.82Å; F584-Y587 HydrophobicContact CD1-CE2 3.82Å; F584-Y587 HydrophobicContact CE1-CE2 4.33Å; F584-Y587 WeakPolarHBondContact O-CD2 3.25Å; F584-Y587 PolarHBondContact O-N 3.14Å; F584-Y587 VanDerWaalsContact O-N 3.1Å; F584-I634 HydrophobicContact CD1-CD1 3.85Å; F584-I634 HydrophobicContact CE1-CD1 4.38Å; F584-Y637 HydrophobicContact CE1-CD2 4.27Å; F584-Y637 AromaticContact CE1-CE2 3.74Å; F584-Y637 HydrophobicContact CE1-CE2 3.74Å; F584-Y637 HydrophobicContact CZ-CE2 4.35Å; F584-M664 HydrophobicContact CD1-CE 4.2Å; F584-M664 HydrophobicContact CD2-CE 4.41Å; F584-M664 HydrophobicContact CD2-SD 4.18Å; F584-M664 HydrophobicContact CE1-CE 4.21Å; F584-M664 HydrophobicContact CE2-CE 4.44Å; F584-M664 HydrophobicContact CE2-SD 4.34Å; F584-M664 HydrophobicContact CG-CE 4.32Å; F584-M664 HydrophobicContact CZ-CE 4.33Å; F584-L667 HydrophobicContact CB-CD2 3.57Å; F584-L667 HydrophobicContact CG-CD2 4.34Å
585	Q	93.5	Very high	94.5	Very high	81 Å²	81	41.8 Å²	41.8	38%	0.379	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-62.1	-19.6	175.7	-59.9	-63.1	-26.5	0	0	112.7	D582 D583 Y587 A588	D582-Q585 WeakPolarHBondContact O-CB 3.12Å; D582-Q585 VanDerWaalsContact O-CG 3.23Å; D582-Q585 WeakPolarHBondContact O-CG 3.41Å; D582-Q585 PolarHBondContact O-N 2.93Å; D583-Q585 PolarHBondContact O-N 3.02Å; Q585-Y587 PolarHBondContact O-N 2.85Å; Q585-Y587 VanDerWaalsContact O-N 3.07Å; Q585-A588 VanDerWaalsContact O-CB 3.3Å; Q585-A588 WeakPolarHBondContact O-CB 3.33Å; Q585-A588 PolarHBondContact O-N 3.04Å
586	M	95.9	Very high	94.3	Very high	20 Å²	20	46.1 Å²	46.1	10%	0.099	22%	0.219	C	C	.	.	H	α-helix	trans	-54.7	-23.9	171.3	68.4	-178.6	179.3	0	0	113.9	N547 E550 I551 F554 D583 F584 A588 K589 Y590	N547-M586 PolarHBondContact ND2-O 3.08Å; E550-M586 HydrophobicContact CG-CB 4.45Å; E550-M586 HydrophobicContact CG-SD 4.46Å; I551-M586 HydrophobicContact CB-CE 4.18Å; I551-M586 HydrophobicContact CB-SD 4.29Å; I551-M586 HydrophobicContact CG1-CE 3.99Å; I551-M586 HydrophobicContact CG1-CG 3.92Å; I551-M586 HydrophobicContact CG1-SD 3.79Å; I551-M586 HydrophobicContact CG2-CE 4.14Å; F554-M586 HydrophobicContact CB-CE 3.82Å; F554-M586 HydrophobicContact CB-SD 3.99Å; F554-M586 HydrophobicContact CD1-CE 3.33Å; F554-M586 HydrophobicContact CD1-SD 4.48Å; F554-M586 HydrophobicContact CE1-CE 4.08Å; F554-M586 HydrophobicContact CG-CE 3.76Å; F554-M586 HydrophobicContact CG-SD 4.35Å; D583-M586 VanDerWaalsContact O-CG 3.25Å; D583-M586 WeakPolarHBondContact O-CG 3.4Å; D583-M586 PolarHBondContact O-N 2.78Å; F584-M586 PolarHBondContact O-N 2.76Å; F584-M586 VanDerWaalsContact O-N 3.13Å; M586-A588 VanDerWaalsContact C-N 3.29Å; M586-A588 PolarHBondContact O-N 3.4Å; M586-K589 WeakPolarHBondContact O-CB 3.21Å; M586-K589 PolarHBondContact O-N 3.34Å; M586-Y590 PolarHBondContact O-N 3.38Å
587	Y	97.2	Very high	94.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-24.8	174.9	-79.3	-89.5	0	0	0	113	Y509 I551 H555 F584 Q585 Y590 C591 P630 I634	Y509-Y587 WeakPolarHBondContact CE1-OH 3.47Å; Y509-Y587 PolarHBondContact OH-OH 2.65Å; I551-Y587 HydrophobicContact CD1-CD1 4.08Å; I551-Y587 HydrophobicContact CD1-CE1 4.17Å; I551-Y587 HydrophobicContact CD1-CG 4.41Å; I551-Y587 HydrophobicContact CG2-CE1 4.24Å; I551-Y587 HydrophobicContact CG2-CE2 4.39Å; H555-Y587 PolarHBondContact CD2-OH 3.15Å; H555-Y587 AromaticContact NE2-CE2 3.47Å; H555-Y587 WeakPolarHBondContact NE2-CE2 3.29Å; H555-Y587 AromaticContact NE2-CZ 3.55Å; H555-Y587 PolarHBondContact NE2-OH 3.08Å; F584-Y587 HydrophobicContact CD1-CD2 4.09Å; F584-Y587 AromaticContact CD1-CE2 3.82Å; F584-Y587 HydrophobicContact CD1-CE2 3.82Å; F584-Y587 HydrophobicContact CE1-CE2 4.33Å; F584-Y587 WeakPolarHBondContact O-CD2 3.25Å; F584-Y587 PolarHBondContact O-N 3.14Å; F584-Y587 VanDerWaalsContact O-N 3.1Å; Q585-Y587 PolarHBondContact O-N 2.85Å; Q585-Y587 VanDerWaalsContact O-N 3.07Å; Y587-Y590 PolarHBondContact O-N 3.15Å; Y587-C591 WeakPolarHBondContact O-CB 3.34Å; Y587-C591 PolarHBondContact O-N 3.45Å; Y587-C591 PolarHBondContact O-SG 2.96Å; Y587-C591 VanDerWaalsContact O-SG 3.38Å; Y587-P630 HydrophobicContact CD1-CB 4.19Å; Y587-P630 HydrophobicContact CE1-CB 3.79Å; Y587-P630 VanDerWaalsContact CE1-O 3.26Å; Y587-P630 WeakPolarHBondContact CE1-O 3.43Å; Y587-I634 HydrophobicContact CD1-CB 3.66Å; Y587-I634 HydrophobicContact CD1-CD1 4.33Å; Y587-I634 HydrophobicContact CD1-CG1 4.03Å; Y587-I634 HydrophobicContact CD1-CG2 3.99Å; Y587-I634 HydrophobicContact CD2-CD1 3.67Å; Y587-I634 HydrophobicContact CD2-CG1 4.16Å; Y587-I634 HydrophobicContact CE1-CB 3.81Å; Y587-I634 HydrophobicContact CE1-CD1 4.49Å; Y587-I634 HydrophobicContact CE1-CG1 4.46Å; Y587-I634 HydrophobicContact CE1-CG2 4.42Å; Y587-I634 HydrophobicContact CE2-CD1 3.87Å; Y587-I634 HydrophobicContact CG-CB 4.02Å; Y587-I634 HydrophobicContact CG-CD1 3.89Å; Y587-I634 HydrophobicContact CG-CG1 3.84Å
588	A	92.7	Very high	94.1	Very high	18 Å²	18	46.6 Å²	46.6	15%	0.149	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-48.4	174.2	0	0	0	0	0	111	Q585 M586 Y590 C591 Q592 V671	Q585-A588 VanDerWaalsContact O-CB 3.3Å; Q585-A588 WeakPolarHBondContact O-CB 3.33Å; Q585-A588 PolarHBondContact O-N 3.04Å; M586-A588 VanDerWaalsContact C-N 3.29Å; M586-A588 PolarHBondContact O-N 3.4Å; A588-Y590 VanDerWaalsContact C-N 3.28Å; A588-Y590 PolarHBondContact O-N 3.35Å; A588-C591 PolarHBondContact O-N 3.37Å; A588-Q592 WeakPolarHBondContact O-CB 3.47Å; A588-Q592 VanDerWaalsContact O-CG 3.25Å; A588-Q592 WeakPolarHBondContact O-CG 3.25Å; A588-Q592 PolarHBondContact O-N 2.81Å; A588-V671 HydrophobicContact CB-CG2 4.02Å
589	K	94.6	Very high	93.8	Very high	108 Å²	108	50.4 Å²	50.4	47%	0.47	24%	0.24	S	C	.	.	H	α-helix	trans	-57.2	-38.4	175	-179.9	178.9	172	-167.6	0	111.8	N547 E550 M586 N593	N547-K589 HydrophobicContact CB-CD 4.15Å; N547-K589 HydrophobicContact CB-CG 4.3Å; E550-K589 IonicContact OE1-NZ 3.28Å; E550-K589 PolarHBondContact OE1-NZ 2.94Å; E550-K589 WeakPolarHBondContact OE2-CD 3.21Å; E550-K589 WeakPolarHBondContact OE2-CE 3.49Å; E550-K589 IonicContact OE2-NZ 2.66Å; E550-K589 PolarHBondContact OE2-NZ 2.74Å; M586-K589 WeakPolarHBondContact O-CB 3.21Å; M586-K589 PolarHBondContact O-N 3.34Å; K589-N593 WeakPolarHBondContact O-CB 3.44Å; K589-N593 PolarHBondContact O-N 2.62Å
590	Y	96.8	Very high	93.7	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-51.2	175.3	-167.8	-90.1	0	0	0	112.5	F545 N547 M548 I551 M586 Y587 A588 Q592 N593 K594 L627 P630 V631	F545-Y590 WeakPolarHBondContact O-CE2 3.22Å; N547-Y590 WeakPolarHBondContact OD1-CA 3.39Å; N547-Y590 VanDerWaalsContact OD1-CB 3.24Å; N547-Y590 WeakPolarHBondContact OD1-CB 3.48Å; N547-Y590 PolarHBondContact OD1-N 2.84Å; N547-Y590 VanDerWaalsContact OD1-N 3.11Å; M548-Y590 HydrophobicContact CB-CE2 4.09Å; M548-Y590 HydrophobicContact CE-CE2 4.3Å; M548-Y590 WeakPolarHBondContact CE-OH 3.3Å; I551-Y590 HydrophobicContact CD1-CD2 3.89Å; I551-Y590 HydrophobicContact CD1-CG 3.88Å; M586-Y590 PolarHBondContact O-N 3.38Å; Y587-Y590 PolarHBondContact O-N 3.15Å; A588-Y590 VanDerWaalsContact C-N 3.28Å; A588-Y590 PolarHBondContact O-N 3.35Å; Y590-Q592 PolarHBondContact O-N 3.07Å; Y590-N593 CarbonylContact O-C 3.54Å; Y590-N593 WeakPolarHBondContact O-CA 3.39Å; Y590-N593 PolarHBondContact O-N 2.98Å; Y590-K594 HydrophobicContact CE1-CD 4.38Å; Y590-K594 PolarHBondContact O-N 3.34Å; Y590-L627 PolarHBondContact OH-O 2.97Å; Y590-P630 HydrophobicContact CD1-CB 3.76Å; Y590-P630 HydrophobicContact CD1-CG 4.2Å; Y590-P630 HydrophobicContact CD2-CG 4.46Å; Y590-P630 HydrophobicContact CE1-CB 3.75Å; Y590-P630 HydrophobicContact CE1-CG 3.76Å; Y590-P630 HydrophobicContact CE2-CG 4.05Å; Y590-P630 HydrophobicContact CG-CB 4.18Å; Y590-V631 HydrophobicContact CD1-CG2 4.26Å; Y590-V631 HydrophobicContact CE1-CG2 4.18Å
591	C	94.6	Very high	93.7	Very high	13 Å²	13	44.9 Å²	44.9	9%	0.088	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-44.1	-179.1	-72.3	0	0	0	0	111.6	Y587 A588 N593 K594 P595 V671 M675	Y587-C591 WeakPolarHBondContact O-CB 3.34Å; Y587-C591 PolarHBondContact O-N 3.45Å; Y587-C591 PolarHBondContact O-SG 2.96Å; Y587-C591 VanDerWaalsContact O-SG 3.38Å; A588-C591 PolarHBondContact O-N 3.37Å; C591-N593 PolarHBondContact O-N 3.46Å; C591-N593 VanDerWaalsContact O-N 3.16Å; C591-K594 PolarHBondContact O-N 3.49Å; C591-K594 VanDerWaalsContact O-N 3.12Å; C591-P595 WeakPolarHBondContact O-CD 3.47Å; C591-V671 HydrophobicContact CB-CG1 3.63Å; C591-M675 HydrophobicContact CB-SD 3.86Å; C591-M675 VanDerWaalsContact O-CE 3.28Å; C591-M675 WeakPolarHBondContact O-CE 3.39Å; C591-M675 VanDerWaalsContact O-SD 3.34Å
592	Q	91.1	Very high	93.6	Very high	58 Å²	58	44.7 Å²	44.7	27%	0.271	21%	0.213	S	C	.	.	H	α-helix	trans	-59.7	-24	173.7	-72.5	172.3	5.4	0	0	113.2	A588 Y590 R596 S674 M675 T678	A588-Q592 WeakPolarHBondContact O-CB 3.47Å; A588-Q592 VanDerWaalsContact O-CG 3.25Å; A588-Q592 WeakPolarHBondContact O-CG 3.25Å; A588-Q592 PolarHBondContact O-N 2.81Å; Y590-Q592 PolarHBondContact O-N 3.07Å; Q592-R596 PolarHBondContact O-NE 2.87Å; Q592-R596 PolarHBondContact O-NH2 3.37Å; Q592-S674 PolarHBondContact NE2-OG 3.11Å; Q592-M675 VanDerWaalsContact CA-SD 3.55Å; Q592-M675 HydrophobicContact CB-SD 4.45Å; Q592-M675 HydrophobicContact CG-SD 4.19Å; Q592-M675 PolarHBondContact N-SD 3.3Å; Q592-M675 VanDerWaalsContact N-SD 3.36Å; Q592-T678 HydrophobicContact CG-CG2 4.31Å
593	N	94.3	Very high	93.4	Very high	13 Å²	13	46.7 Å²	46.7	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-91.1	-27.5	176	-174	68.7	0	0	0	113.4	V543 G546 K589 Y590 C591 P595 R596 S597	V543-N593 PolarHBondContact O-ND2 3.18Å; G546-N593 VanDerWaalsContact CA-ND2 3.27Å; G546-N593 WeakPolarHBondContact CA-ND2 3.4Å; G546-N593 PolarHBondContact N-ND2 3.2Å; K589-N593 WeakPolarHBondContact O-CB 3.44Å; K589-N593 PolarHBondContact O-N 2.62Å; Y590-N593 CarbonylContact O-C 3.54Å; Y590-N593 WeakPolarHBondContact O-CA 3.39Å; Y590-N593 PolarHBondContact O-N 2.98Å; C591-N593 PolarHBondContact O-N 3.46Å; C591-N593 VanDerWaalsContact O-N 3.16Å; N593-P595 VanDerWaalsContact C-CD 3.42Å; N593-P595 VanDerWaalsContact C-N 3.33Å; N593-P595 VanDerWaalsContact O-N 3.14Å; N593-R596 WeakPolarHBondContact O-CA 3.48Å; N593-R596 WeakPolarHBondContact O-CB 3.31Å; N593-R596 PolarHBondContact O-N 3.18Å; N593-S597 PolarHBondContact O-N 2.91Å
594	K	93.8	Very high	93.3	Very high	12 Å²	12	44.7 Å²	44.7	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-53.3	-35.2	-175.8	-175	65.9	-166.3	82.3	0	114.9	Y590 C591 S597 E598	Y590-K594 HydrophobicContact CE1-CD 4.38Å; Y590-K594 PolarHBondContact O-N 3.34Å; C591-K594 PolarHBondContact O-N 3.49Å; C591-K594 VanDerWaalsContact O-N 3.12Å; K594-S597 WeakPolarHBondContact O-CB 3.42Å; K594-E598 IonicContact NZ-OE2 3.48Å; K594-E598 PolarHBondContact NZ-OE2 3.41Å; K594-E598 VanDerWaalsContact O-CB 3.25Å; K594-E598 WeakPolarHBondContact O-CB 3.41Å; K594-E598 PolarHBondContact O-N 3.2Å
595	P	90.1	Very high	93.1	Very high	28 Å²	28	45.8 Å²	45.8	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-36.1	172.1	-23.8	32.9	0	0	0	114.3	C591 N593 E598 L599 M675 Y748	C591-P595 WeakPolarHBondContact O-CD 3.47Å; N593-P595 VanDerWaalsContact C-CD 3.42Å; N593-P595 VanDerWaalsContact C-N 3.33Å; N593-P595 VanDerWaalsContact O-N 3.14Å; P595-E598 WeakPolarHBondContact O-CB 3.49Å; P595-L599 PolarHBondContact O-N 3.33Å; P595-L599 VanDerWaalsContact O-N 3.16Å; P595-M675 HydrophobicContact CG-CE 3.65Å; P595-Y748 HydrophobicContact CB-CD1 3.93Å; P595-Y748 HydrophobicContact CB-CD2 3.84Å; P595-Y748 HydrophobicContact CB-CE1 3.87Å; P595-Y748 HydrophobicContact CB-CE2 3.75Å; P595-Y748 HydrophobicContact CB-CG 3.94Å; P595-Y748 HydrophobicContact CG-CD1 3.77Å; P595-Y748 HydrophobicContact CG-CE1 3.68Å; P595-Y748 HydrophobicContact CG-CE2 4.47Å; P595-Y748 HydrophobicContact CG-CG 4.25Å
596	R	91	Very high	93	Very high	135 Å²	135	48.6 Å²	48.6	51%	0.509	23%	0.225	S	C	.	.	H	α-helix	trans	-76.7	-40.3	179.3	-65.9	173.3	-84.5	162.5	-6.3	110.9	V543 Q592 N593 L599 I600	V543-R596 HydrophobicContact CG1-CB 3.57Å; Q592-R596 PolarHBondContact O-NE 2.87Å; Q592-R596 PolarHBondContact O-NH2 3.37Å; N593-R596 WeakPolarHBondContact O-CA 3.48Å; N593-R596 WeakPolarHBondContact O-CB 3.31Å; N593-R596 PolarHBondContact O-N 3.18Å; R596-L599 PolarHBondContact O-N 2.68Å; R596-I600 WeakPolarHBondContact O-CD1 3.4Å; R596-I600 WeakPolarHBondContact O-CG1 3.46Å; R596-I600 PolarHBondContact O-N 2.9Å
597	S	95.1	Very high	92.9	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-54.6	-48.3	167.4	166.7	0	0	0	0	112.1	V543 L544 N593 K594 L599 I600 W601	V543-S597 VanDerWaalsContact O-CA 3.29Å; V543-S597 WeakPolarHBondContact O-CA 3.46Å; V543-S597 VanDerWaalsContact O-CB 3.32Å; V543-S597 WeakPolarHBondContact O-CB 3.32Å; V543-S597 PolarHBondContact O-N 3.13Å; L544-S597 VanDerWaalsContact O-CB 3.23Å; L544-S597 WeakPolarHBondContact O-CB 3.44Å; L544-S597 PolarHBondContact O-OG 3.23Å; N593-S597 PolarHBondContact O-N 2.91Å; K594-S597 WeakPolarHBondContact O-CB 3.42Å; S597-L599 PolarHBondContact O-N 2.92Å; S597-I600 PolarHBondContact O-N 3.43Å; S597-W601 PolarHBondContact O-N 3.35Å
598	E	91.8	Very high	92.8	Very high	20 Å²	20	50.6 Å²	50.6	9%	0.093	24%	0.243	C	C	.	.	H	α-helix	trans	-58.5	-44.4	177.5	-178.7	81.2	-179.7	0	0	112.8	K594 P595 I600 W601 R602 R747 Y748	K594-E598 IonicContact NZ-OE2 3.48Å; K594-E598 PolarHBondContact NZ-OE2 3.41Å; K594-E598 VanDerWaalsContact O-CB 3.25Å; K594-E598 WeakPolarHBondContact O-CB 3.41Å; K594-E598 PolarHBondContact O-N 3.2Å; P595-E598 WeakPolarHBondContact O-CB 3.49Å; E598-I600 VanDerWaalsContact C-N 3.3Å; E598-I600 PolarHBondContact O-N 3.33Å; E598-W601 PolarHBondContact O-N 3.13Å; E598-R602 PolarHBondContact O-N 3.08Å; E598-R602 IonicContact OE1-CZ 3.78Å; E598-R602 IonicContact OE1-NE 2.7Å; E598-R602 PolarHBondContact OE1-NE 2.89Å; E598-R602 IonicContact OE1-NH2 3.63Å; E598-R602 PolarHBondContact OE1-NH2 3.23Å; E598-R747 IonicContact OE1-NH1 2.78Å; E598-R747 PolarHBondContact OE1-NH1 2.89Å; E598-Y748 HydrophobicContact CB-CE2 4.27Å; E598-Y748 WeakPolarHBondContact CB-OH 3.45Å; E598-Y748 HydrophobicContact CG-CE2 4.09Å; E598-Y748 WeakPolarHBondContact CG-OH 3.35Å
599	L	89.8	Confident	93	Very high	123 Å²	123	49.8 Å²	49.8	64%	0.644	24%	0.236	S	C	*	.	H	α-helix	trans	-65.1	-34.1	178.2	-177.7	62.3	0	0	0	112.3	P595 R596 S597 K603	P595-L599 PolarHBondContact O-N 3.33Å; P595-L599 VanDerWaalsContact O-N 3.16Å; R596-L599 PolarHBondContact O-N 2.68Å; S597-L599 PolarHBondContact O-N 2.92Å; L599-K603 PolarHBondContact O-N 2.75Å
600	I	92.9	Very high	93.1	Very high	14 Å²	14	44.8 Å²	44.8	7%	0.072	21%	0.214	C	C	.	.	H	α-helix	trans	-69.5	-45.8	172.9	-64.8	159.5	0	0	0	109.9	L537 K540 V543 L544 R596 S597 E598 R602 K603 Y604	L537-I600 HydrophobicContact CD1-CG2 3.74Å; K540-I600 HydrophobicContact CB-CD1 4.04Å; K540-I600 HydrophobicContact CD-CD1 4.23Å; K540-I600 HydrophobicContact CD-CG1 4.11Å; V543-I600 HydrophobicContact CB-CD1 3.52Å; V543-I600 HydrophobicContact CG1-CD1 3.44Å; V543-I600 VanDerWaalsContact CG1-CD1 3.44Å; L544-I600 HydrophobicContact CB-CG2 4.42Å; L544-I600 HydrophobicContact CD1-CB 4.42Å; L544-I600 HydrophobicContact CD1-CG2 4.11Å; R596-I600 WeakPolarHBondContact O-CD1 3.4Å; R596-I600 WeakPolarHBondContact O-CG1 3.46Å; R596-I600 PolarHBondContact O-N 2.9Å; S597-I600 PolarHBondContact O-N 3.43Å; E598-I600 VanDerWaalsContact C-N 3.3Å; E598-I600 PolarHBondContact O-N 3.33Å; I600-R602 PolarHBondContact O-N 2.88Å; I600-K603 PolarHBondContact O-N 3.09Å; I600-K603 VanDerWaalsContact O-N 3.15Å; I600-Y604 HydrophobicContact CG2-CD2 3.89Å; I600-Y604 HydrophobicContact CG2-CE2 4.36Å; I600-Y604 VanDerWaalsContact O-CD2 3.28Å; I600-Y604 WeakPolarHBondContact O-CD2 3.29Å; I600-Y604 PolarHBondContact O-N 2.9Å
601	W	94	Very high	93.1	Very high	31 Å²	31	49.4 Å²	49.4	12%	0.117	24%	0.236	C	C	.	.	H	α-helix	trans	-56.4	-51.4	178.6	180	-107.4	0	0	0	111.8	S597 E598 K603 Y604 S605 F610 L623 D624	S597-W601 PolarHBondContact O-N 3.35Å; E598-W601 PolarHBondContact O-N 3.13Å; W601-K603 PolarHBondContact O-N 3.41Å; W601-K603 VanDerWaalsContact O-N 3.11Å; W601-Y604 CarbonylContact O-C 3.56Å; W601-Y604 PolarHBondContact O-N 2.85Å; W601-S605 VanDerWaalsContact CE2-CB 3.47Å; W601-S605 WeakPolarHBondContact O-CB 3.5Å; W601-S605 PolarHBondContact O-N 2.99Å; W601-F610 HydrophobicContact CE3-CD2 4.27Å; W601-F610 HydrophobicContact CE3-CE2 4.1Å; W601-F610 HydrophobicContact CE3-CZ 4.39Å; W601-F610 HydrophobicContact CH2-CB 4.36Å; W601-F610 HydrophobicContact CH2-CD2 4.28Å; W601-F610 HydrophobicContact CH2-CG 4.3Å; W601-F610 HydrophobicContact CZ3-CB 4.26Å; W601-F610 HydrophobicContact CZ3-CD1 4.07Å; W601-F610 AromaticContact CZ3-CD2 3.55Å; W601-F610 HydrophobicContact CZ3-CD2 3.55Å; W601-F610 HydrophobicContact CZ3-CE1 4.3Å; W601-F610 AromaticContact CZ3-CE2 3.8Å; W601-F610 HydrophobicContact CZ3-CE2 3.8Å; W601-F610 AromaticContact CZ3-CG 3.71Å; W601-F610 HydrophobicContact CZ3-CG 3.71Å; W601-F610 HydrophobicContact CZ3-CZ 4.18Å; W601-L623 HydrophobicContact CE3-CB 4.41Å; W601-L623 HydrophobicContact CE3-CD2 4.46Å; W601-L623 HydrophobicContact CH2-CB 3.82Å; W601-L623 HydrophobicContact CZ3-CB 3.7Å; W601-L623 HydrophobicContact CZ3-CD2 4.07Å; W601-L623 HydrophobicContact CZ3-CG 4.3Å; W601-D624 HydrophobicContact CD2-CB 4.19Å; W601-D624 HydrophobicContact CG-CB 4.15Å; W601-D624 HydrophobicContact CZ2-CB 4.39Å
602	R	90	Very high	93.1	Very high	89 Å²	89	50.9 Å²	50.9	34%	0.336	24%	0.242	S	C	.	.	H	α-helix	trans	-58.4	-27.8	178.8	-67.8	-177	-159.2	156.2	12.3	114.2	E598 I600	E598-R602 PolarHBondContact O-N 3.08Å; E598-R602 IonicContact OE1-CZ 3.78Å; E598-R602 IonicContact OE1-NE 2.7Å; E598-R602 PolarHBondContact OE1-NE 2.89Å; E598-R602 IonicContact OE1-NH2 3.63Å; E598-R602 PolarHBondContact OE1-NH2 3.23Å; I600-R602 PolarHBondContact O-N 2.88Å
603	K	90.8	Very high	93.3	Very high	150 Å²	150	48.1 Å²	48.1	65%	0.652	23%	0.229	S	C	*	.	H	α-helix	trans	-83.4	-18.4	178.7	-176	159.6	-178.7	154.1	0	113.5	L599 I600 W601	L599-K603 PolarHBondContact O-N 2.75Å; I600-K603 PolarHBondContact O-N 3.09Å; I600-K603 VanDerWaalsContact O-N 3.15Å; W601-K603 PolarHBondContact O-N 3.41Å; W601-K603 VanDerWaalsContact O-N 3.11Å
604	Y	93.4	Very high	93.4	Very high	22 Å²	22	50.3 Å²	50.3	9%	0.086	24%	0.239	C	C	.	.	H	α-helix	trans	-137.6	3.2	-168.9	-60	-67.7	0	0	0	115.6	P534 L536 L537 I600 W601 E606 C607 F610	P534-Y604 HydrophobicContact CB-CD1 4.47Å; P534-Y604 HydrophobicContact CB-CE1 4.19Å; P534-Y604 HydrophobicContact CG-CD1 4.22Å; P534-Y604 HydrophobicContact CG-CE1 4.4Å; L536-Y604 WeakPolarHBondContact CB-OH 3.42Å; L537-Y604 HydrophobicContact CB-CD1 4.41Å; L537-Y604 HydrophobicContact CB-CD2 4.33Å; L537-Y604 HydrophobicContact CB-CE1 4.46Å; L537-Y604 HydrophobicContact CB-CE2 4.39Å; L537-Y604 HydrophobicContact CB-CG 4.34Å; L537-Y604 HydrophobicContact CD1-CD2 3.83Å; L537-Y604 HydrophobicContact CD1-CE2 4.4Å; L537-Y604 HydrophobicContact CD1-CG 4.2Å; L537-Y604 HydrophobicContact CD2-CG 4.26Å; I600-Y604 HydrophobicContact CG2-CD2 3.89Å; I600-Y604 HydrophobicContact CG2-CE2 4.36Å; I600-Y604 VanDerWaalsContact O-CD2 3.28Å; I600-Y604 WeakPolarHBondContact O-CD2 3.29Å; I600-Y604 PolarHBondContact O-N 2.9Å; W601-Y604 CarbonylContact O-C 3.56Å; W601-Y604 PolarHBondContact O-N 2.85Å; Y604-E606 PolarHBondContact O-N 2.8Å; Y604-E606 VanDerWaalsContact O-N 3.17Å; Y604-C607 WeakPolarHBondContact O-CB 3.45Å; Y604-C607 PolarHBondContact O-N 3.06Å; Y604-C607 PolarHBondContact O-SG 2.89Å; Y604-F610 VanDerWaalsContact O-CD2 3.24Å; Y604-F610 WeakPolarHBondContact O-CD2 3.49Å; Y604-F610 WeakPolarHBondContact O-CE2 3.5Å
605	S	91.9	Very high	93.5	Very high	23 Å²	23	57.4 Å²	57.4	16%	0.161	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-41.9	-177.1	57.5	0	0	0	0	113	W601 C607	W601-S605 VanDerWaalsContact CE2-CB 3.47Å; W601-S605 WeakPolarHBondContact O-CB 3.5Å; W601-S605 PolarHBondContact O-N 2.99Å; S605-C607 VanDerWaalsContact C-N 3.28Å; S605-C607 PolarHBondContact O-N 2.58Å
606	E	91.1	Very high	93.7	Very high	141 Å²	141	60 Å²	60	66%	0.659	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	7.1	-177.5	-48.7	-41.3	119.7	0	0	114.4	Y604 Q611	Y604-E606 PolarHBondContact O-N 2.8Å; Y604-E606 VanDerWaalsContact O-N 3.17Å; E606-Q611 PolarHBondContact O-NE2 2.9Å
607	C	93.4	Very high	93.8	Very high	19 Å²	19	56.1 Å²	56.1	13%	0.128	26%	0.263	C	S	.	.	S	Bend	trans	-74.4	141.6	176.9	77.6	0	0	0	0	111.8	P534 Y604 S605 F609 F610	P534-C607 HydrophobicContact CG-CB 4.25Å; Y604-C607 WeakPolarHBondContact O-CB 3.45Å; Y604-C607 PolarHBondContact O-N 3.06Å; Y604-C607 PolarHBondContact O-SG 2.89Å; S605-C607 VanDerWaalsContact C-N 3.28Å; S605-C607 PolarHBondContact O-N 2.58Å; C607-F609 PolarHBondContact O-N 2.87Å; C607-F610 PolarHBondContact O-N 3.36Å; C607-F610 WeakPolarHBondContact SG-CD2 3.49Å
608	A	95.9	Very high	93.8	Very high	43 Å²	43	64.9 Å²	64.9	36%	0.355	30%	0.301	S	S	.	.	H	α-helix	trans	-54.8	-31	-173.6	0	0	0	0	0	113.4	L532 F610 Q611 E612	L532-A608 HydrophobicContact CB-CB 4.23Å; L532-A608 HydrophobicContact CD2-CB 4.15Å; A608-F610 PolarHBondContact O-N 3.13Å; A608-Q611 PolarHBondContact O-N 2.92Å; A608-E612 WeakPolarHBondContact O-CB 3.38Å; A608-E612 PolarHBondContact O-N 3.42Å
609	F	96.8	Very high	93.8	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-51.6	-52	173.3	174.7	-97.6	0	0	0	113.2	E523 M524 M529 L532 M533 C607 E612 C613	E523-F609 HydrophobicContact CB-CE2 4.06Å; E523-F609 HydrophobicContact CB-CZ 3.98Å; E523-F609 WeakPolarHBondContact O-CE2 3.26Å; M524-F609 HydrophobicContact CB-CZ 4.21Å; M524-F609 HydrophobicContact CG-CE1 3.62Å; M524-F609 HydrophobicContact CG-CE2 4.27Å; M524-F609 HydrophobicContact CG-CZ 3.4Å; M524-F609 VanDerWaalsContact CG-CZ 3.4Å; M529-F609 HydrophobicContact CB-CD2 4Å; M529-F609 HydrophobicContact CB-CE2 3.91Å; M529-F609 HydrophobicContact CE-CD2 3.75Å; M529-F609 HydrophobicContact CE-CE2 3.8Å; M529-F609 HydrophobicContact CG-CE2 4.41Å; L532-F609 HydrophobicContact CB-CB 4.21Å; L532-F609 WeakPolarHBondContact O-CB 3.26Å; L532-F609 PolarHBondContact O-N 2.95Å; L532-F609 VanDerWaalsContact O-N 3.1Å; M533-F609 HydrophobicContact CB-CB 4.03Å; M533-F609 HydrophobicContact CB-CD2 4.07Å; M533-F609 HydrophobicContact CB-CG 4.11Å; M533-F609 HydrophobicContact CG-CG 4.4Å; C607-F609 PolarHBondContact O-N 2.87Å; F609-E612 PolarHBondContact O-N 2.72Å; F609-C613 VanDerWaalsContact CZ-SG 3.56Å; F609-C613 PolarHBondContact O-N 2.95Å; F609-C613 PolarHBondContact O-SG 3.4Å
610	F	96.7	Very high	93.9	Very high	3 Å²	3	70.9 Å²	70.9	1%	0.013	32%	0.315	C	S	.	.	H	α-helix	trans	-71.7	-36.7	-177.5	-66	-53	0	0	0	112.2	Y520 L537 L544 W601 Y604 C607 A608 C613 Q614 L623	Y520-F610 HydrophobicContact CD1-CD1 4.05Å; Y520-F610 HydrophobicContact CE1-CD1 4.48Å; L537-F610 HydrophobicContact CD1-CZ 4.25Å; L537-F610 HydrophobicContact CD2-CE2 3.76Å; L537-F610 HydrophobicContact CD2-CZ 3.76Å; L544-F610 HydrophobicContact CD2-CE1 3.87Å; L544-F610 HydrophobicContact CD2-CZ 3.6Å; W601-F610 HydrophobicContact CE3-CD2 4.27Å; W601-F610 HydrophobicContact CE3-CE2 4.1Å; W601-F610 HydrophobicContact CE3-CZ 4.39Å; W601-F610 HydrophobicContact CH2-CB 4.36Å; W601-F610 HydrophobicContact CH2-CD2 4.28Å; W601-F610 HydrophobicContact CH2-CG 4.3Å; W601-F610 HydrophobicContact CZ3-CB 4.26Å; W601-F610 HydrophobicContact CZ3-CD1 4.07Å; W601-F610 AromaticContact CZ3-CD2 3.55Å; W601-F610 HydrophobicContact CZ3-CD2 3.55Å; W601-F610 HydrophobicContact CZ3-CE1 4.3Å; W601-F610 AromaticContact CZ3-CE2 3.8Å; W601-F610 HydrophobicContact CZ3-CE2 3.8Å; W601-F610 AromaticContact CZ3-CG 3.71Å; W601-F610 HydrophobicContact CZ3-CG 3.71Å; W601-F610 HydrophobicContact CZ3-CZ 4.18Å; Y604-F610 VanDerWaalsContact O-CD2 3.24Å; Y604-F610 WeakPolarHBondContact O-CD2 3.49Å; Y604-F610 WeakPolarHBondContact O-CE2 3.5Å; C607-F610 PolarHBondContact O-N 3.36Å; C607-F610 WeakPolarHBondContact SG-CD2 3.49Å; A608-F610 PolarHBondContact O-N 3.13Å; F610-C613 PolarHBondContact O-N 3.26Å; F610-Q614 VanDerWaalsContact O-CB 3.29Å; F610-Q614 WeakPolarHBondContact O-CB 3.3Å; F610-Q614 PolarHBondContact O-N 3Å; F610-L623 HydrophobicContact CD1-CD2 3.82Å; F610-L623 HydrophobicContact CE1-CD2 3.61Å; F610-L623 HydrophobicContact CZ-CD2 4.44Å
611	Q	95.7	Very high	93.9	Very high	100 Å²	100	74.6 Å²	74.6	47%	0.467	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-44.3	176.1	-63.7	176.4	-7.4	0	0	111	E606 A608 Q614 R615	E606-Q611 PolarHBondContact O-NE2 2.9Å; A608-Q611 PolarHBondContact O-N 2.92Å; Q611-Q614 PolarHBondContact O-N 3.1Å; Q611-R615 WeakPolarHBondContact O-CB 3.5Å; Q611-R615 PolarHBondContact O-N 3.35Å
612	E	96	Very high	93.8	Very high	44 Å²	44	74 Å²	74	21%	0.206	34%	0.338	C	S	.	.	H	α-helix	trans	-67.7	-43	176.6	175.1	56.4	-162.6	0	0	112.1	M529 L532 A608 F609 Q614 R615 K616	M529-E612 HydrophobicContact CE-CB 4.2Å; M529-E612 HydrophobicContact CE-CG 3.82Å; M529-E612 HydrophobicContact SD-CG 4.14Å; L532-E612 HydrophobicContact CD1-CB 3.95Å; L532-E612 HydrophobicContact CD1-CG 3.91Å; A608-E612 WeakPolarHBondContact O-CB 3.38Å; A608-E612 PolarHBondContact O-N 3.42Å; F609-E612 PolarHBondContact O-N 2.72Å; E612-Q614 PolarHBondContact O-N 2.87Å; E612-R615 VanDerWaalsContact CD-NH2 3.3Å; E612-R615 WeakPolarHBondContact O-CB 3.36Å; E612-R615 PolarHBondContact O-N 2.93Å; E612-R615 IonicContact OE1-CZ 3.25Å; E612-R615 IonicContact OE1-NE 3.76Å; E612-R615 IonicContact OE1-NH2 2.6Å; E612-R615 PolarHBondContact OE1-NH2 3.36Å; E612-R615 IonicContact OE2-CZ 2.9Å; E612-R615 IonicContact OE2-NE 3.38Å; E612-R615 PolarHBondContact OE2-NE 3.18Å; E612-R615 IonicContact OE2-NH2 2.72Å; E612-R615 PolarHBondContact OE2-NH2 2.97Å; E612-R615 VanDerWaalsContact OE2-NH2 3.1Å; E612-K616 WeakPolarHBondContact O-CG 3.35Å; E612-K616 PolarHBondContact O-N 3.11Å; E612-K616 WeakPolarHBondContact OE1-CE 3.39Å; E612-K616 WeakPolarHBondContact OE1-CG 3.46Å
613	C	95.8	Very high	94.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-46.7	173.4	-66.4	0	0	0	0	111.6	G519 Y520 M529 F609 F610 R615 K616 L617	G519-C613 WeakPolarHBondContact O-CB 3.41Å; Y520-C613 HydrophobicContact CD1-CB 3.29Å; Y520-C613 HydrophobicContact CE1-CB 3.42Å; Y520-C613 VanDerWaalsContact CE1-CB 3.42Å; Y520-C613 HydrophobicContact CG-CB 4.04Å; M529-C613 VanDerWaalsContact CE-SG 3.5Å; F609-C613 VanDerWaalsContact CZ-SG 3.56Å; F609-C613 PolarHBondContact O-N 2.95Å; F609-C613 PolarHBondContact O-SG 3.4Å; F610-C613 PolarHBondContact O-N 3.26Å; C613-R615 VanDerWaalsContact C-N 3.29Å; C613-R615 PolarHBondContact O-N 3.45Å; C613-K616 PolarHBondContact O-N 2.92Å; C613-L617 WeakPolarHBondContact O-CB 3.49Å; C613-L617 WeakPolarHBondContact O-CG 3.33Å; C613-L617 PolarHBondContact O-N 3.08Å
614	Q	96.1	Very high	94.3	Very high	59 Å²	59	64.9 Å²	64.9	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-38.8	177	-168.8	-178.4	-22.1	0	0	111.7	Y520 F610 Q611 E612 K618 H619 L621	Y520-Q614 WeakPolarHBondContact OH-CA 3.32Å; Y520-Q614 WeakPolarHBondContact OH-CB 3.49Å; F610-Q614 VanDerWaalsContact O-CB 3.29Å; F610-Q614 WeakPolarHBondContact O-CB 3.3Å; F610-Q614 PolarHBondContact O-N 3Å; Q611-Q614 PolarHBondContact O-N 3.1Å; E612-Q614 PolarHBondContact O-N 2.87Å; Q614-K618 WeakPolarHBondContact O-CA 3.49Å; Q614-K618 PolarHBondContact O-N 3.2Å; Q614-H619 HydrophobicContact CG-CB 3.8Å; Q614-H619 VanDerWaalsContact CG-O 3.28Å; Q614-H619 WeakPolarHBondContact CG-O 3.47Å; Q614-H619 PolarHBondContact NE2-O 2.9Å; Q614-H619 PolarHBondContact O-N 2.83Å; Q614-H619 VanDerWaalsContact O-N 3.08Å; Q614-L621 PolarHBondContact NE2-O 2.63Å
615	R	96	Very high	94.4	Very high	160 Å²	160	65.5 Å²	65.5	60%	0.604	31%	0.311	S	S	*	.	H	α-helix	trans	-66.2	-45.8	175.5	-168.6	-165.4	68.3	77.6	3.3	112.3	Q611 E612 C613 L617 K618	Q611-R615 WeakPolarHBondContact O-CB 3.5Å; Q611-R615 PolarHBondContact O-N 3.35Å; E612-R615 VanDerWaalsContact CD-NH2 3.3Å; E612-R615 WeakPolarHBondContact O-CB 3.36Å; E612-R615 PolarHBondContact O-N 2.93Å; E612-R615 IonicContact OE1-CZ 3.25Å; E612-R615 IonicContact OE1-NE 3.76Å; E612-R615 IonicContact OE1-NH2 2.6Å; E612-R615 PolarHBondContact OE1-NH2 3.36Å; E612-R615 IonicContact OE2-CZ 2.9Å; E612-R615 IonicContact OE2-NE 3.38Å; E612-R615 PolarHBondContact OE2-NE 3.18Å; E612-R615 IonicContact OE2-NH2 2.72Å; E612-R615 PolarHBondContact OE2-NH2 2.97Å; E612-R615 VanDerWaalsContact OE2-NH2 3.1Å; C613-R615 VanDerWaalsContact C-N 3.29Å; C613-R615 PolarHBondContact O-N 3.45Å; R615-L617 VanDerWaalsContact C-N 3.32Å; R615-L617 PolarHBondContact O-N 3.47Å; R615-K618 PolarHBondContact O-N 3.43Å
616	K	93.8	Very high	94.7	Very high	84 Å²	84	65.5 Å²	65.5	37%	0.365	31%	0.307	S	S	.	.	H	α-helix	trans	-57.3	-45.3	175.4	-72.5	-179.8	-173.5	-176.2	0	111.3	E523 M529 E612 C613	E523-K616 IonicContact OE2-NZ 3.67Å; E523-K616 PolarHBondContact OE2-NZ 3.15Å; M529-K616 PolarHBondContact SD-NZ 3.1Å; E612-K616 WeakPolarHBondContact O-CG 3.35Å; E612-K616 PolarHBondContact O-N 3.11Å; E612-K616 WeakPolarHBondContact OE1-CE 3.39Å; E612-K616 WeakPolarHBondContact OE1-CG 3.46Å; C613-K616 PolarHBondContact O-N 2.92Å
617	L	92.7	Very high	95	Very high	53 Å²	53	58.8 Å²	58.8	28%	0.277	28%	0.276	S	S	.	.	H	α-helix	trans	-80.3	-11.1	-179.2	-62.8	169.6	0	0	0	114.4	Y520 C613 R615 H619	Y520-L617 HydrophobicContact CD2-CD1 3.62Å; Y520-L617 HydrophobicContact CE2-CD1 3.25Å; C613-L617 WeakPolarHBondContact O-CB 3.49Å; C613-L617 WeakPolarHBondContact O-CG 3.33Å; C613-L617 PolarHBondContact O-N 3.08Å; R615-L617 VanDerWaalsContact C-N 3.32Å; R615-L617 PolarHBondContact O-N 3.47Å; L617-H619 HydrophobicContact CB-CB 4.44Å; L617-H619 PolarHBondContact O-N 3.33Å
618	K	94.7	Very high	95.1	Very high	184 Å²	184	61 Å²	61	80%	0.8	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	29.8	-173.3	-52.2	173.3	-174.4	171.5	0	113.1	Q614 R615	Q614-K618 WeakPolarHBondContact O-CA 3.49Å; Q614-K618 PolarHBondContact O-N 3.2Å; R615-K618 PolarHBondContact O-N 3.43Å
619	H	92.1	Very high	95.2	Very high	26 Å²	26	60.2 Å²	60.2	12%	0.12	28%	0.275	C	S	.	.			trans	-69.8	129.4	-178.8	-83.9	-169.7	0	0	0	111.1	Y520 Q614 L617 Y626	Y520-H619 AromaticContact CE2-ND1 3.71Å; Q614-H619 HydrophobicContact CG-CB 3.8Å; Q614-H619 VanDerWaalsContact CG-O 3.28Å; Q614-H619 WeakPolarHBondContact CG-O 3.47Å; Q614-H619 PolarHBondContact NE2-O 2.9Å; Q614-H619 PolarHBondContact O-N 2.83Å; Q614-H619 VanDerWaalsContact O-N 3.08Å; L617-H619 HydrophobicContact CB-CB 4.44Å; L617-H619 PolarHBondContact O-N 3.33Å; H619-Y626 HydrophobicContact CB-CE2 4.31Å; H619-Y626 AromaticContact CE1-CE1 3.63Å; H619-Y626 AromaticContact CE1-CZ 3.58Å; H619-Y626 AromaticContact CG-CZ 3.71Å; H619-Y626 VanDerWaalsContact CG-OH 3.32Å; H619-Y626 AromaticContact ND1-CE1 3.89Å; H619-Y626 AromaticContact ND1-CE2 3.5Å; H619-Y626 WeakPolarHBondContact ND1-CE2 3.46Å; H619-Y626 AromaticContact ND1-CZ 3.36Å; H619-Y626 PolarHBondContact ND1-OH 2.9Å
620	R	91.5	Very high	95.3	Very high	243 Å²	243	60.2 Å²	60.2	92%	0.917	28%	0.275	S	S	*	.	S	Bend	trans	-79.6	-19.7	179.7	-65.4	-173.5	-177.5	-176.1	1.7	113.9
621	L	92.7	Very high	95.3	Very high	92 Å²	92	62.2 Å²	62.2	48%	0.482	29%	0.287	S	S	.	.	S	Bend	trans	-113.6	156	-178.8	-57.5	176.8	0	0	0	110.2	Q614 Y626	Q614-L621 PolarHBondContact NE2-O 2.63Å; L621-Y626 HydrophobicContact CB-CE2 3.98Å
622	G	92.8	Very high	95.4	Very high	19 Å²	19	62 Å²	62	20%	0.196	29%	0.286	C	S	.	.			trans	-65.4	160.4	171.2	0	0	0	0	0	112.4	D624 S625 Y626	G622-D624 WeakPolarHBondContact CA-OD1 3.43Å; G622-D624 PolarHBondContact O-N 3.18Å; G622-S625 WeakPolarHBondContact O-CB 3.49Å; G622-S625 PolarHBondContact O-N 3.39Å; G622-S625 VanDerWaalsContact O-N 3.13Å; G622-Y626 WeakPolarHBondContact O-CD2 3.28Å
623	L	96.5	Very high	95.5	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-33.1	-178.2	170.6	61.2	0	0	0	112.4	V516 Y520 L544 F545 W601 F610 S625 Y626 L627	V516-L623 HydrophobicContact CG1-CD1 3.74Å; V516-L623 HydrophobicContact CG2-CD1 4.4Å; Y520-L623 HydrophobicContact CD1-CB 4.44Å; Y520-L623 HydrophobicContact CD1-CD1 4.34Å; Y520-L623 HydrophobicContact CD1-CD2 3.94Å; Y520-L623 HydrophobicContact CD1-CG 4.46Å; Y520-L623 HydrophobicContact CD2-CD1 3.87Å; Y520-L623 HydrophobicContact CE1-CB 4.07Å; Y520-L623 HydrophobicContact CE1-CD2 4.4Å; Y520-L623 HydrophobicContact CE2-CD1 4.06Å; Y520-L623 HydrophobicContact CG-CD1 3.99Å; Y520-L623 HydrophobicContact CG-CD2 4.16Å; L544-L623 HydrophobicContact CD2-CD2 4.42Å; F545-L623 HydrophobicContact CE1-CD1 4.03Å; F545-L623 HydrophobicContact CE1-CD2 4.05Å; F545-L623 HydrophobicContact CZ-CD2 4.05Å; W601-L623 HydrophobicContact CE3-CB 4.41Å; W601-L623 HydrophobicContact CE3-CD2 4.46Å; W601-L623 HydrophobicContact CH2-CB 3.82Å; W601-L623 HydrophobicContact CZ3-CB 3.7Å; W601-L623 HydrophobicContact CZ3-CD2 4.07Å; W601-L623 HydrophobicContact CZ3-CG 4.3Å; F610-L623 HydrophobicContact CD1-CD2 3.82Å; F610-L623 HydrophobicContact CE1-CD2 3.61Å; F610-L623 HydrophobicContact CZ-CD2 4.44Å; L623-S625 VanDerWaalsContact C-N 3.26Å; L623-S625 PolarHBondContact O-N 2.81Å; L623-Y626 CarbonylContact O-C 3.6Å; L623-Y626 WeakPolarHBondContact O-CA 3.21Å; L623-Y626 PolarHBondContact O-N 2.91Å; L623-L627 HydrophobicContact CD1-CD2 4.49Å; L623-L627 HydrophobicContact CD1-CG 4.13Å; L623-L627 HydrophobicContact CD2-CD1 4.36Å; L623-L627 HydrophobicContact CG-CD1 3.93Å; L623-L627 HydrophobicContact CG-CG 4.05Å; L623-L627 WeakPolarHBondContact O-CG 3.48Å; L623-L627 PolarHBondContact O-N 2.76Å
624	D	94.9	Very high	95.5	Very high	47 Å²	47	60.6 Å²	60.6	25%	0.251	28%	0.279	S	S	.	.	H	α-helix	trans	-52.6	-40.6	173.7	65.5	-39.6	0	0	0	113.8	W601 G622 Y626 L627 L628	W601-D624 HydrophobicContact CD2-CB 4.19Å; W601-D624 HydrophobicContact CG-CB 4.15Å; W601-D624 HydrophobicContact CZ2-CB 4.39Å; G622-D624 WeakPolarHBondContact CA-OD1 3.43Å; G622-D624 PolarHBondContact O-N 3.18Å; D624-Y626 PolarHBondContact O-N 3.45Å; D624-L627 CarbonylContact O-C 3.59Å; D624-L627 PolarHBondContact O-N 3.47Å; D624-L627 VanDerWaalsContact O-N 3.15Å; D624-L628 WeakPolarHBondContact O-CG 3.4Å; D624-L628 PolarHBondContact O-N 3.06Å
625	S	95.8	Very high	95.6	Very high	35 Å²	35	60.7 Å²	60.7	25%	0.245	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-27.2	177.6	-61.6	0	0	0	0	112	G622 L623	G622-S625 WeakPolarHBondContact O-CB 3.49Å; G622-S625 PolarHBondContact O-N 3.39Å; G622-S625 VanDerWaalsContact O-N 3.13Å; L623-S625 VanDerWaalsContact C-N 3.26Å; L623-S625 PolarHBondContact O-N 2.81Å
626	Y	96.9	Very high	95.6	Very high	22 Å²	22	57.9 Å²	57.9	9%	0.086	28%	0.276	C	S	.	.	H	α-helix	trans	-87	-34.5	172.4	-60	-102	0	0	0	112.3	V516 H619 L621 G622 L623 D624 L628 K629	V516-Y626 VanDerWaalsContact CG2-CB 3.4Å; V516-Y626 HydrophobicContact CG2-CD1 3.94Å; V516-Y626 HydrophobicContact CG2-CG 3.88Å; H619-Y626 HydrophobicContact CB-CE2 4.31Å; H619-Y626 AromaticContact CE1-CE1 3.63Å; H619-Y626 AromaticContact CE1-CZ 3.58Å; H619-Y626 AromaticContact CG-CZ 3.71Å; H619-Y626 VanDerWaalsContact CG-OH 3.32Å; H619-Y626 AromaticContact ND1-CE1 3.89Å; H619-Y626 AromaticContact ND1-CE2 3.5Å; H619-Y626 WeakPolarHBondContact ND1-CE2 3.46Å; H619-Y626 AromaticContact ND1-CZ 3.36Å; H619-Y626 PolarHBondContact ND1-OH 2.9Å; L621-Y626 HydrophobicContact CB-CE2 3.98Å; G622-Y626 WeakPolarHBondContact O-CD2 3.28Å; L623-Y626 CarbonylContact O-C 3.6Å; L623-Y626 WeakPolarHBondContact O-CA 3.21Å; L623-Y626 PolarHBondContact O-N 2.91Å; D624-Y626 PolarHBondContact O-N 3.45Å; Y626-L628 PolarHBondContact O-N 2.94Å; Y626-K629 HydrophobicContact CD1-CD 3.97Å; Y626-K629 HydrophobicContact CG-CD 4.41Å; Y626-K629 VanDerWaalsContact O-CB 3.27Å; Y626-K629 WeakPolarHBondContact O-CB 3.4Å; Y626-K629 WeakPolarHBondContact O-CG 3.37Å; Y626-K629 PolarHBondContact O-N 3.07Å
627	L	97.7	Very high	95.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-16	172.2	-66.4	173	0	0	0	113.2	L544 F545 M548 Y590 L623 D624	L544-L627 HydrophobicContact CD1-CD1 3.9Å; L544-L627 HydrophobicContact CG-CD1 4.42Å; F545-L627 HydrophobicContact CD1-CD2 3.73Å; F545-L627 HydrophobicContact CE1-CD2 4.25Å; M548-L627 HydrophobicContact CE-CD2 4.04Å; Y590-L627 PolarHBondContact OH-O 2.97Å; L623-L627 HydrophobicContact CD1-CD2 4.49Å; L623-L627 HydrophobicContact CD1-CG 4.13Å; L623-L627 HydrophobicContact CD2-CD1 4.36Å; L623-L627 HydrophobicContact CG-CD1 3.93Å; L623-L627 HydrophobicContact CG-CG 4.05Å; L623-L627 WeakPolarHBondContact O-CG 3.48Å; L623-L627 PolarHBondContact O-N 2.76Å; D624-L627 CarbonylContact O-C 3.59Å; D624-L627 PolarHBondContact O-N 3.47Å; D624-L627 VanDerWaalsContact O-N 3.15Å
628	L	96.8	Very high	96	Very high	65 Å²	65	53.1 Å²	53.1	34%	0.34	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-17.9	170.2	-77.5	163.8	0	0	0	113.7	D624 Y626 V631 Q632	D624-L628 WeakPolarHBondContact O-CG 3.4Å; D624-L628 PolarHBondContact O-N 3.06Å; Y626-L628 PolarHBondContact O-N 2.94Å; L628-V631 PolarHBondContact O-N 3.31Å; L628-V631 VanDerWaalsContact O-N 3.11Å; L628-Q632 WeakPolarHBondContact O-CG 3.27Å; L628-Q632 PolarHBondContact O-N 2.91Å
629	K	97.3	Very high	96.1	Very high	28 Å²	28	48.5 Å²	48.5	12%	0.122	24%	0.237	C	C	.	.	H	α-helix	trans	-58.7	-39.3	-172.5	-70.5	174.9	178	-68.9	0	114.7	Y509 E512 Y626 V631 Q632 R633	Y509-K629 HydrophobicContact CD2-CB 4.25Å; Y509-K629 HydrophobicContact CE2-CB 4.02Å; E512-K629 HydrophobicContact CB-CD 3.83Å; E512-K629 HydrophobicContact CG-CD 4.49Å; E512-K629 VanDerWaalsContact OE1-CE 3.25Å; E512-K629 WeakPolarHBondContact OE1-CE 3.35Å; E512-K629 IonicContact OE1-NZ 2.77Å; E512-K629 PolarHBondContact OE1-NZ 3.15Å; E512-K629 WeakPolarHBondContact OE2-CD 3.34Å; E512-K629 VanDerWaalsContact OE2-CE 3.29Å; E512-K629 WeakPolarHBondContact OE2-CE 3.34Å; E512-K629 IonicContact OE2-NZ 3.81Å; E512-K629 PolarHBondContact OE2-NZ 3.23Å; Y626-K629 HydrophobicContact CD1-CD 3.97Å; Y626-K629 HydrophobicContact CG-CD 4.41Å; Y626-K629 VanDerWaalsContact O-CB 3.27Å; Y626-K629 WeakPolarHBondContact O-CB 3.4Å; Y626-K629 WeakPolarHBondContact O-CG 3.37Å; Y626-K629 PolarHBondContact O-N 3.07Å; K629-V631 PolarHBondContact O-N 3.36Å; K629-Q632 PolarHBondContact O-N 3.26Å; K629-R633 WeakPolarHBondContact O-CB 3.4Å; K629-R633 PolarHBondContact O-N 2.78Å
630	P	98.4	Very high	96.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-41.8	175.2	-25.1	36.3	0	0	0	113.2	Y509 L513 M548 I551 Y587 Y590 Q632 R633 I634	Y509-P630 WeakPolarHBondContact OH-CA 3.39Å; L513-P630 HydrophobicContact CD2-CG 4.19Å; M548-P630 HydrophobicContact CE-CG 3.87Å; I551-P630 HydrophobicContact CD1-CB 4.23Å; Y587-P630 HydrophobicContact CD1-CB 4.19Å; Y587-P630 HydrophobicContact CE1-CB 3.79Å; Y587-P630 VanDerWaalsContact CE1-O 3.26Å; Y587-P630 WeakPolarHBondContact CE1-O 3.43Å; Y590-P630 HydrophobicContact CD1-CB 3.76Å; Y590-P630 HydrophobicContact CD1-CG 4.2Å; Y590-P630 HydrophobicContact CD2-CG 4.46Å; Y590-P630 HydrophobicContact CE1-CB 3.75Å; Y590-P630 HydrophobicContact CE1-CG 3.76Å; Y590-P630 HydrophobicContact CE2-CG 4.05Å; Y590-P630 HydrophobicContact CG-CB 4.18Å; P630-Q632 VanDerWaalsContact C-N 3.29Å; P630-Q632 PolarHBondContact O-N 3.25Å; P630-R633 PolarHBondContact O-N 2.96Å; P630-I634 WeakPolarHBondContact O-CG2 3.08Å; P630-I634 PolarHBondContact O-N 3.48Å; P630-I634 VanDerWaalsContact O-N 3.08Å
631	V	97.4	Very high	96.5	Very high	45 Å²	45	36.2 Å²	36.2	27%	0.273	19%	0.19	S	C	.	.	H	α-helix	trans	-65	-36.1	176.9	-170.4	0	0	0	0	110.9	Y590 L628 K629 T635	Y590-V631 HydrophobicContact CD1-CG2 4.26Å; Y590-V631 HydrophobicContact CE1-CG2 4.18Å; L628-V631 PolarHBondContact O-N 3.31Å; L628-V631 VanDerWaalsContact O-N 3.11Å; K629-V631 PolarHBondContact O-N 3.36Å; V631-T635 WeakPolarHBondContact O-CG2 3.43Å; V631-T635 PolarHBondContact O-N 3.47Å; V631-T635 PolarHBondContact O-OG1 3.36Å
632	Q	96.9	Very high	96.6	Very high	94 Å²	94	37.9 Å²	37.9	44%	0.439	19%	0.194	S	C	.	.	H	α-helix	trans	-70.6	-41.3	174.6	-67.1	168.5	-12.6	0	0	112.6	L628 K629 P630 T635 K636	L628-Q632 WeakPolarHBondContact O-CG 3.27Å; L628-Q632 PolarHBondContact O-N 2.91Å; K629-Q632 PolarHBondContact O-N 3.26Å; P630-Q632 VanDerWaalsContact C-N 3.29Å; P630-Q632 PolarHBondContact O-N 3.25Å; Q632-T635 PolarHBondContact O-OG1 3.48Å; Q632-T635 VanDerWaalsContact O-OG1 3.07Å; Q632-K636 WeakPolarHBondContact O-CB 3.48Å; Q632-K636 WeakPolarHBondContact O-CG 3.22Å; Q632-K636 PolarHBondContact O-N 3.06Å
633	R	98.2	Very high	96.7	Very high	14 Å²	14	40.1 Å²	40.1	5%	0.053	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-47.8	-178.3	-170.8	72	-177.7	154.1	-3.3	111.4	L502 T505 E506 Y509 K629 P630 T635 K636 Y637	L502-R633 PolarHBondContact O-NH2 3.21Å; T505-R633 PolarHBondContact OG1-NH1 2.88Å; E506-R633 IonicContact OE2-CZ 3.81Å; E506-R633 IonicContact OE2-NE 3.85Å; E506-R633 PolarHBondContact OE2-NE 2.91Å; E506-R633 IonicContact OE2-NH2 2.8Å; E506-R633 PolarHBondContact OE2-NH2 3.24Å; Y509-R633 HydrophobicContact CD1-CB 4.24Å; Y509-R633 HydrophobicContact CD1-CG 3.65Å; Y509-R633 HydrophobicContact CD2-CB 3.95Å; Y509-R633 HydrophobicContact CD2-CG 4.18Å; Y509-R633 HydrophobicContact CE1-CB 4Å; Y509-R633 HydrophobicContact CE1-CG 3.69Å; Y509-R633 HydrophobicContact CE2-CB 3.71Å; Y509-R633 HydrophobicContact CE2-CG 4.22Å; Y509-R633 HydrophobicContact CG-CB 4.2Å; Y509-R633 HydrophobicContact CG-CG 3.9Å; K629-R633 WeakPolarHBondContact O-CB 3.4Å; K629-R633 PolarHBondContact O-N 2.78Å; P630-R633 PolarHBondContact O-N 2.96Å; R633-T635 VanDerWaalsContact C-N 3.27Å; R633-T635 PolarHBondContact O-N 3.05Å; R633-K636 WeakPolarHBondContact O-CB 3.37Å; R633-K636 PolarHBondContact O-N 2.73Å; R633-Y637 HydrophobicContact CG-CE1 4.28Å; R633-Y637 HydrophobicContact CG-CE2 3.77Å; R633-Y637 VanDerWaalsContact CG-OH 3.27Å; R633-Y637 WeakPolarHBondContact CG-OH 3.43Å; R633-Y637 PolarHBondContact NE-OH 2.93Å; R633-Y637 VanDerWaalsContact NE-OH 3.13Å; R633-Y637 WeakPolarHBondContact O-CD2 3.19Å; R633-Y637 PolarHBondContact O-N 2.77Å
634	I	97.4	Very high	96.4	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-62.8	-34.8	-178	-160.8	60.4	0	0	0	112.4	F584 Y587 P630 Y637 M664 L667 L668	F584-I634 HydrophobicContact CD1-CD1 3.85Å; F584-I634 HydrophobicContact CE1-CD1 4.38Å; Y587-I634 HydrophobicContact CD1-CB 3.66Å; Y587-I634 HydrophobicContact CD1-CD1 4.33Å; Y587-I634 HydrophobicContact CD1-CG1 4.03Å; Y587-I634 HydrophobicContact CD1-CG2 3.99Å; Y587-I634 HydrophobicContact CD2-CD1 3.67Å; Y587-I634 HydrophobicContact CD2-CG1 4.16Å; Y587-I634 HydrophobicContact CE1-CB 3.81Å; Y587-I634 HydrophobicContact CE1-CD1 4.49Å; Y587-I634 HydrophobicContact CE1-CG1 4.46Å; Y587-I634 HydrophobicContact CE1-CG2 4.42Å; Y587-I634 HydrophobicContact CE2-CD1 3.87Å; Y587-I634 HydrophobicContact CG-CB 4.02Å; Y587-I634 HydrophobicContact CG-CD1 3.89Å; Y587-I634 HydrophobicContact CG-CG1 3.84Å; P630-I634 WeakPolarHBondContact O-CG2 3.08Å; P630-I634 PolarHBondContact O-N 3.48Å; P630-I634 VanDerWaalsContact O-N 3.08Å; I634-Y637 HydrophobicContact CD1-CD2 4.06Å; I634-Y637 HydrophobicContact CD1-CE2 4.28Å; I634-M664 HydrophobicContact CD1-CE 3.63Å; I634-L667 HydrophobicContact CD1-CD2 3.74Å; I634-L667 HydrophobicContact CG1-CD2 4.21Å; I634-L668 HydrophobicContact CB-CD2 4.42Å; I634-L668 HydrophobicContact CG1-CD2 4.05Å; I634-L668 HydrophobicContact CG2-CD2 3.95Å
635	T	96.5	Very high	96.3	Very high	61 Å²	61	39.8 Å²	39.8	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-76.8	-18.4	175.6	50.8	0	0	0	0	114	V631 Q632 R633 Q638 L668	V631-T635 WeakPolarHBondContact O-CG2 3.43Å; V631-T635 PolarHBondContact O-N 3.47Å; V631-T635 PolarHBondContact O-OG1 3.36Å; Q632-T635 PolarHBondContact O-OG1 3.48Å; Q632-T635 VanDerWaalsContact O-OG1 3.07Å; R633-T635 VanDerWaalsContact C-N 3.27Å; R633-T635 PolarHBondContact O-N 3.05Å; T635-Q638 PolarHBondContact O-NE2 2.64Å; T635-L668 HydrophobicContact CG2-CD2 3.73Å
636	K	97.2	Very high	96.1	Very high	100 Å²	100	44 Å²	44	44%	0.435	21%	0.211	S	C	.	.	H	α-helix	trans	-81.2	-32.3	177.7	-80.9	-84.1	175.6	174	0	113.9	Q632 R633 Q638 L639 L640	Q632-K636 WeakPolarHBondContact O-CB 3.48Å; Q632-K636 WeakPolarHBondContact O-CG 3.22Å; Q632-K636 PolarHBondContact O-N 3.06Å; R633-K636 WeakPolarHBondContact O-CB 3.37Å; R633-K636 PolarHBondContact O-N 2.73Å; K636-Q638 VanDerWaalsContact C-N 3.35Å; K636-Q638 PolarHBondContact O-N 2.67Å; K636-L639 HydrophobicContact CD-CD1 4.33Å; K636-L639 WeakPolarHBondContact O-CB 3.3Å; K636-L639 PolarHBondContact O-N 3.42Å; K636-L640 PolarHBondContact O-N 2.8Å; K636-L640 VanDerWaalsContact O-N 3.1Å
637	Y	98.2	Very high	95.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.8	-43.9	-177.2	-67.3	-55.4	0	0	0	113.3	L502 E506 H555 F559 F577 F584 R633 I634 L639 L640 L641 M664	L502-Y637 HydrophobicContact CD1-CD1 4.07Å; L502-Y637 HydrophobicContact CD1-CE1 4.19Å; E506-Y637 PolarHBondContact OE2-OH 3.3Å; H555-Y637 PolarHBondContact CE1-OH 3.46Å; F559-Y637 HydrophobicContact CE1-CE1 4.03Å; F577-Y637 AromaticContact CE1-CD1 3.67Å; F577-Y637 HydrophobicContact CE1-CD1 3.67Å; F577-Y637 HydrophobicContact CE1-CD2 4.2Å; F577-Y637 HydrophobicContact CE1-CE1 4.23Å; F577-Y637 AromaticContact CE1-CG 3.65Å; F577-Y637 HydrophobicContact CE1-CG 3.65Å; F577-Y637 AromaticContact CZ-CD1 3.49Å; F577-Y637 HydrophobicContact CZ-CD1 3.49Å; F577-Y637 VanDerWaalsContact CZ-CD1 3.49Å; F577-Y637 HydrophobicContact CZ-CE1 4.02Å; F577-Y637 AromaticContact CZ-CG 3.95Å; F577-Y637 HydrophobicContact CZ-CG 3.95Å; F584-Y637 HydrophobicContact CE1-CD2 4.27Å; F584-Y637 AromaticContact CE1-CE2 3.74Å; F584-Y637 HydrophobicContact CE1-CE2 3.74Å; F584-Y637 HydrophobicContact CZ-CE2 4.35Å; R633-Y637 HydrophobicContact CG-CE1 4.28Å; R633-Y637 HydrophobicContact CG-CE2 3.77Å; R633-Y637 VanDerWaalsContact CG-OH 3.27Å; R633-Y637 WeakPolarHBondContact CG-OH 3.43Å; R633-Y637 PolarHBondContact NE-OH 2.93Å; R633-Y637 VanDerWaalsContact NE-OH 3.13Å; R633-Y637 WeakPolarHBondContact O-CD2 3.19Å; R633-Y637 PolarHBondContact O-N 2.77Å; I634-Y637 HydrophobicContact CD1-CD2 4.06Å; I634-Y637 HydrophobicContact CD1-CE2 4.28Å; Y637-L639 VanDerWaalsContact C-N 3.26Å; Y637-L639 PolarHBondContact O-N 3.16Å; Y637-L640 PolarHBondContact O-N 2.71Å; Y637-L641 WeakPolarHBondContact O-CB 3.42Å; Y637-L641 VanDerWaalsContact O-CG 3.25Å; Y637-L641 WeakPolarHBondContact O-CG 3.44Å; Y637-L641 PolarHBondContact O-N 2.78Å; Y637-M664 HydrophobicContact CD2-CE 3.66Å; Y637-M664 HydrophobicContact CG-CE 4.15Å
638	Q	96.6	Very high	95.1	Very high	38 Å²	38	45.7 Å²	45.7	18%	0.178	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-26	176.8	61.1	76.9	28.8	0	0	113.7	T635 K636 K642 L661 M664 L665 L668	T635-Q638 PolarHBondContact O-NE2 2.64Å; K636-Q638 VanDerWaalsContact C-N 3.35Å; K636-Q638 PolarHBondContact O-N 2.67Å; Q638-K642 WeakPolarHBondContact O-CB 3.28Å; Q638-K642 PolarHBondContact O-N 2.9Å; Q638-K642 VanDerWaalsContact O-N 3.13Å; Q638-L661 HydrophobicContact CB-CD1 3.75Å; Q638-L661 WeakPolarHBondContact O-CD1 3.28Å; Q638-M664 HydrophobicContact CB-CB 4.48Å; Q638-L665 HydrophobicContact CB-CD2 3.9Å; Q638-L665 HydrophobicContact CB-CG 4.15Å; Q638-L665 HydrophobicContact CG-CD2 3.85Å; Q638-L668 HydrophobicContact CB-CD1 4.41Å; Q638-L668 HydrophobicContact CG-CD1 3.53Å
639	L	96.1	Very high	94.3	Very high	86 Å²	86	46.9 Å²	46.9	45%	0.45	22%	0.223	S	C	.	.	H	α-helix	trans	-71.6	-46.6	172	-60.5	-179.4	0	0	0	111	K636 Y637 K642 E643	K636-L639 HydrophobicContact CD-CD1 4.33Å; K636-L639 WeakPolarHBondContact O-CB 3.3Å; K636-L639 PolarHBondContact O-N 3.42Å; Y637-L639 VanDerWaalsContact C-N 3.26Å; Y637-L639 PolarHBondContact O-N 3.16Å; L639-K642 PolarHBondContact O-N 3.1Å; L639-E643 WeakPolarHBondContact O-CB 3.5Å; L639-E643 PolarHBondContact O-N 3.3Å
640	L	96.1	Very high	93.3	Very high	10 Å²	10	55.2 Å²	55.2	5%	0.052	26%	0.263	C	S	.	.	H	α-helix	trans	-64.9	-45.7	-179.8	-67.3	166.4	0	0	0	111.4	V498 E501 L502 K636 Y637 K642 E643 L644	V498-L640 HydrophobicContact CG1-CD2 4.41Å; V498-L640 WeakPolarHBondContact CG1-O 3.21Å; E501-L640 HydrophobicContact CB-CD2 4.37Å; E501-L640 HydrophobicContact CG-CD2 4.09Å; L502-L640 HydrophobicContact CB-CD1 4.37Å; L502-L640 HydrophobicContact CD1-CB 4.44Å; L502-L640 HydrophobicContact CD1-CD1 3.77Å; K636-L640 PolarHBondContact O-N 2.8Å; K636-L640 VanDerWaalsContact O-N 3.1Å; Y637-L640 PolarHBondContact O-N 2.71Å; L640-K642 VanDerWaalsContact C-N 3.33Å; L640-K642 PolarHBondContact O-N 3.46Å; L640-E643 PolarHBondContact O-N 2.98Å; L640-L644 VanDerWaalsContact O-CB 3.28Å; L640-L644 WeakPolarHBondContact O-CB 3.45Å; L640-L644 PolarHBondContact O-N 2.82Å
641	L	95.9	Very high	92.2	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-39.9	175.5	-68.1	168.1	0	0	0	111.8	V573 F577 Y637 L645 L657 A660 L661 M664	V573-L641 HydrophobicContact CG1-CD2 3.82Å; F577-L641 HydrophobicContact CD1-CD1 4.15Å; F577-L641 HydrophobicContact CD2-CD1 4.39Å; F577-L641 HydrophobicContact CD2-CD2 3.79Å; F577-L641 HydrophobicContact CE1-CD1 4.16Å; F577-L641 HydrophobicContact CE2-CD1 4.39Å; F577-L641 HydrophobicContact CE2-CD2 3.73Å; F577-L641 HydrophobicContact CE2-CG 4.31Å; F577-L641 HydrophobicContact CG-CD1 4.27Å; F577-L641 HydrophobicContact CG-CD2 4.41Å; F577-L641 HydrophobicContact CZ-CD1 4.26Å; F577-L641 HydrophobicContact CZ-CD2 4.29Å; F577-L641 HydrophobicContact CZ-CG 4.4Å; Y637-L641 WeakPolarHBondContact O-CB 3.42Å; Y637-L641 VanDerWaalsContact O-CG 3.25Å; Y637-L641 WeakPolarHBondContact O-CG 3.44Å; Y637-L641 PolarHBondContact O-N 2.78Å; L641-L645 WeakPolarHBondContact O-CB 3.47Å; L641-L645 PolarHBondContact O-N 2.92Å; L641-L657 HydrophobicContact CB-CD1 4.41Å; L641-L657 HydrophobicContact CD2-CD1 3.52Å; L641-A660 HydrophobicContact CD1-CB 4.44Å; L641-A660 HydrophobicContact CD2-CB 4.49Å; L641-L661 HydrophobicContact CB-CB 4.23Å; L641-L661 HydrophobicContact CB-CD1 4.19Å; L641-M664 HydrophobicContact CD1-CB 4.33Å; L641-M664 HydrophobicContact CD1-CG 3.78Å
642	K	95	Very high	90.8	Very high	128 Å²	128	62.6 Å²	62.6	56%	0.557	31%	0.306	S	S	*	.	H	α-helix	trans	-69.2	-40.3	177.6	-179.2	178	178.3	179.5	0	113	Q638 L639 L640 L645 K646 L661	Q638-K642 WeakPolarHBondContact O-CB 3.28Å; Q638-K642 PolarHBondContact O-N 2.9Å; Q638-K642 VanDerWaalsContact O-N 3.13Å; L639-K642 PolarHBondContact O-N 3.1Å; L640-K642 VanDerWaalsContact C-N 3.33Å; L640-K642 PolarHBondContact O-N 3.46Å; K642-L645 PolarHBondContact O-N 3.43Å; K642-K646 WeakPolarHBondContact O-CB 3.3Å; K642-K646 PolarHBondContact O-N 3.49Å; K642-L661 HydrophobicContact CB-CD1 4.05Å; K642-L661 HydrophobicContact CB-CD2 3.9Å; K642-L661 HydrophobicContact CG-CD2 4.29Å
643	E	93.9	Very high	90	Very high	65 Å²	65	59 Å²	59	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-73.6	-33	178	-166.7	69.8	-176	0	0	111.1	V498 L639 L640 K646 Y647	V498-E643 HydrophobicContact CG1-CB 4.39Å; V498-E643 HydrophobicContact CG2-CB 4.38Å; V498-E643 HydrophobicContact CG2-CG 3.84Å; L639-E643 WeakPolarHBondContact O-CB 3.5Å; L639-E643 PolarHBondContact O-N 3.3Å; L640-E643 PolarHBondContact O-N 2.98Å; E643-K646 WeakPolarHBondContact O-CB 3.5Å; E643-K646 IonicContact OE1-NZ 3.35Å; E643-K646 PolarHBondContact OE1-NZ 3.03Å; E643-K646 WeakPolarHBondContact OE2-CD 3.45Å; E643-K646 IonicContact OE2-NZ 2.82Å; E643-K646 PolarHBondContact OE2-NZ 2.76Å; E643-Y647 HydrophobicContact CG-CD2 4.49Å; E643-Y647 HydrophobicContact CG-CE2 3.81Å; E643-Y647 WeakPolarHBondContact O-CD2 3.5Å; E643-Y647 PolarHBondContact O-N 3.25Å; E643-Y647 WeakPolarHBondContact OE1-CE2 3.47Å; E643-Y647 PolarHBondContact OE1-OH 2.88Å
644	L	92.1	Very high	89.4	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-40.2	170.3	-170.8	66.5	0	0	0	111.6	K495 V498 V573 L640 K646 Y647 S648 L657	K495-L644 HydrophobicContact CG-CD1 3.74Å; K495-L644 WeakPolarHBondContact O-CD1 3.36Å; V498-L644 HydrophobicContact CB-CD1 4.26Å; V498-L644 HydrophobicContact CG1-CB 3.89Å; V498-L644 HydrophobicContact CG1-CD1 4.36Å; V573-L644 HydrophobicContact CB-CD2 4.07Å; V573-L644 HydrophobicContact CG1-CD2 3.97Å; V573-L644 HydrophobicContact CG2-CD2 4.14Å; L640-L644 VanDerWaalsContact O-CB 3.28Å; L640-L644 WeakPolarHBondContact O-CB 3.45Å; L640-L644 PolarHBondContact O-N 2.82Å; L644-K646 VanDerWaalsContact C-N 3.34Å; L644-K646 PolarHBondContact O-N 3.35Å; L644-Y647 CarbonylContact O-C 3.58Å; L644-Y647 PolarHBondContact O-N 2.7Å; L644-S648 PolarHBondContact O-N 3.05Å; L644-S648 PolarHBondContact O-OG 3.38Å; L644-L657 HydrophobicContact CB-CD2 4.17Å; L644-L657 HydrophobicContact CD2-CD1 4.05Å; L644-L657 HydrophobicContact CD2-CD2 4.02Å; L644-L657 HydrophobicContact CG-CD2 3.86Å
645	L	91.9	Very high	89	Confident	40 Å²	40	63.3 Å²	63.3	21%	0.209	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-40.2	177.1	-174.7	70.6	0	0	0	111.7	L641 K642 Y647 S648 T654 L657 K658 L661	L641-L645 WeakPolarHBondContact O-CB 3.47Å; L641-L645 PolarHBondContact O-N 2.92Å; K642-L645 PolarHBondContact O-N 3.43Å; L645-Y647 PolarHBondContact O-N 2.98Å; L645-S648 PolarHBondContact O-N 3.43Å; L645-S648 VanDerWaalsContact O-N 3.16Å; L645-T654 HydrophobicContact CD1-CG2 3.66Å; L645-T654 WeakPolarHBondContact CD1-O 3.18Å; L645-L657 HydrophobicContact CB-CD2 4.04Å; L645-L657 HydrophobicContact CB-CG 4.2Å; L645-L657 HydrophobicContact CD1-CB 4.11Å; L645-L657 HydrophobicContact CD1-CD2 4.09Å; L645-L657 HydrophobicContact CD1-CG 3.99Å; L645-K658 HydrophobicContact CD1-CB 4.16Å; L645-K658 HydrophobicContact CD2-CB 4.18Å; L645-K658 HydrophobicContact CD2-CG 4.37Å; L645-L661 HydrophobicContact CD2-CD2 3.95Å
646	K	90.8	Very high	88.9	Confident	123 Å²	123	63.5 Å²	63.5	54%	0.535	32%	0.318	S	S	.	.	H	α-helix	trans	-60.6	-26.8	175	170.8	-164.3	178	-170.3	0	113.7	K642 E643 L644	K642-K646 WeakPolarHBondContact O-CB 3.3Å; K642-K646 PolarHBondContact O-N 3.49Å; E643-K646 WeakPolarHBondContact O-CB 3.5Å; E643-K646 IonicContact OE1-NZ 3.35Å; E643-K646 PolarHBondContact OE1-NZ 3.03Å; E643-K646 WeakPolarHBondContact OE2-CD 3.45Å; E643-K646 IonicContact OE2-NZ 2.82Å; E643-K646 PolarHBondContact OE2-NZ 2.76Å; L644-K646 VanDerWaalsContact C-N 3.34Å; L644-K646 PolarHBondContact O-N 3.35Å
647	Y	88.4	Confident	88.8	Confident	35 Å²	35	59 Å²	59	14%	0.137	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	13.1	176.7	-53.1	-49.1	0	0	0	113.6	L491 L494 V498 E643 L644 L645	L491-Y647 HydrophobicContact CD1-CD1 3.79Å; L491-Y647 HydrophobicContact CD1-CG 4.41Å; L494-Y647 HydrophobicContact CB-CD1 4.18Å; L494-Y647 HydrophobicContact CB-CD2 3.83Å; L494-Y647 HydrophobicContact CB-CE1 4.32Å; L494-Y647 HydrophobicContact CB-CE2 4Å; L494-Y647 HydrophobicContact CB-CG 3.95Å; L494-Y647 HydrophobicContact CD1-CD1 4.3Å; L494-Y647 HydrophobicContact CD1-CE1 3.94Å; V498-Y647 HydrophobicContact CG2-CD2 4.09Å; V498-Y647 HydrophobicContact CG2-CE2 4.12Å; E643-Y647 HydrophobicContact CG-CD2 4.49Å; E643-Y647 HydrophobicContact CG-CE2 3.81Å; E643-Y647 WeakPolarHBondContact O-CD2 3.5Å; E643-Y647 PolarHBondContact O-N 3.25Å; E643-Y647 WeakPolarHBondContact OE1-CE2 3.47Å; E643-Y647 PolarHBondContact OE1-OH 2.88Å; L644-Y647 CarbonylContact O-C 3.58Å; L644-Y647 PolarHBondContact O-N 2.7Å; L645-Y647 PolarHBondContact O-N 2.98Å
648	S	85.6	Confident	88.6	Confident	22 Å²	22	64.5 Å²	64.5	15%	0.154	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-101.9	130.5	178.1	-65.5	0	0	0	0	111.6	L644 L645	L644-S648 PolarHBondContact O-N 3.05Å; L644-S648 PolarHBondContact O-OG 3.38Å; L645-S648 PolarHBondContact O-N 3.43Å; L645-S648 VanDerWaalsContact O-N 3.16Å
649	K	80.9	Confident	88.6	Confident	91 Å²	91	66.6 Å²	66.6	40%	0.396	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-65.9	150.5	175.6	-65.4	163.9	-179.8	170.3	0	110.2	D488 L491 D492 G651 T654	D488-K649 WeakPolarHBondContact OD1-CE 3.25Å; D488-K649 IonicContact OD1-NZ 3.79Å; D488-K649 PolarHBondContact OD1-NZ 3.27Å; D488-K649 IonicContact OD2-NZ 3.46Å; D488-K649 PolarHBondContact OD2-NZ 3.12Å; L491-K649 HydrophobicContact CD2-CG 4.2Å; D492-K649 IonicContact OD1-NZ 2.65Å; D492-K649 IonicContact OD2-NZ 3.55Å; D492-K649 PolarHBondContact OD2-NZ 2.96Å; K649-G651 PolarHBondContact O-N 2.98Å; K649-T654 WeakPolarHBondContact O-CB 3.29Å; K649-T654 PolarHBondContact O-OG1 3Å
650	E	75.8	Confident	88.6	Confident	202 Å²	202	62.6 Å²	62.6	94%	0.944	31%	0.312	S	S	*	.	S	Bend	trans	-64.3	130.8	-178.2	-63.8	-168.6	149.9	0	0	111.7
651	G	74.9	Confident	88.6	Confident	44 Å²	44	62.8 Å²	62.8	45%	0.454	31%	0.313	S	S	.	.	S	Bend	trans	167.3	-179.7	-173.7	0	0	0	0	0	112.8	K649 G653 T654 T655	K649-G651 PolarHBondContact O-N 2.98Å; G651-G653 PolarHBondContact O-N 3.02Å; G651-T654 WeakPolarHBondContact O-CB 3.27Å; G651-T654 PolarHBondContact O-N 2.93Å; G651-T654 VanDerWaalsContact O-N 3.08Å; G651-T655 PolarHBondContact O-N 3.23Å; G651-T655 VanDerWaalsContact O-N 3.15Å
652	E	68.5	Low	88.6	Confident	156 Å²	156	66.4 Å²	66.4	73%	0.729	33%	0.332	S	S	*	.	H	α-helix	trans	-64.5	-40.6	-173.9	-173.3	175.7	-174.7	0	0	113.6	T654 T655 K656	E652-T654 PolarHBondContact O-N 3.13Å; E652-T655 PolarHBondContact O-N 2.9Å; E652-T655 VanDerWaalsContact O-N 3.16Å; E652-T655 PolarHBondContact O-OG1 3.46Å; E652-K656 PolarHBondContact O-N 3.47Å; E652-K656 VanDerWaalsContact O-N 3.08Å
653	G	79.2	Confident	88.7	Confident	20 Å²	20	62 Å²	62	21%	0.206	32%	0.317	C	S	.	.	H	α-helix	trans	-56.9	-34.5	172.6	0	0	0	0	0	112.7	G651 K656 L657	G651-G653 PolarHBondContact O-N 3.02Å; G653-K656 PolarHBondContact O-N 2.83Å; G653-L657 VanDerWaalsContact O-CB 3.24Å; G653-L657 WeakPolarHBondContact O-CB 3.43Å; G653-L657 PolarHBondContact O-N 2.7Å
654	T	85.6	Confident	88.8	Confident	30 Å²	30	59 Å²	59	18%	0.184	30%	0.303	C	S	.	.	H	α-helix	trans	-76.7	-29.7	-179	-55	0	0	0	0	111.9	L645 K649 G651 E652 K658	L645-T654 HydrophobicContact CD1-CG2 3.66Å; L645-T654 WeakPolarHBondContact CD1-O 3.18Å; K649-T654 WeakPolarHBondContact O-CB 3.29Å; K649-T654 PolarHBondContact O-OG1 3Å; G651-T654 WeakPolarHBondContact O-CB 3.27Å; G651-T654 PolarHBondContact O-N 2.93Å; G651-T654 VanDerWaalsContact O-N 3.08Å; E652-T654 PolarHBondContact O-N 3.13Å; T654-K658 WeakPolarHBondContact O-CB 3.5Å; T654-K658 PolarHBondContact O-N 3.44Å; T654-K658 VanDerWaalsContact O-N 3.12Å
655	T	90.6	Very high	88.9	Confident	75 Å²	75	62.3 Å²	62.3	46%	0.46	32%	0.321	S	S	.	.	H	α-helix	trans	-70.1	-43.5	169.2	66.7	0	0	0	0	111	G651 E652 L657 K658 E659	G651-T655 PolarHBondContact O-N 3.23Å; G651-T655 VanDerWaalsContact O-N 3.15Å; E652-T655 PolarHBondContact O-N 2.9Å; E652-T655 VanDerWaalsContact O-N 3.16Å; E652-T655 PolarHBondContact O-OG1 3.46Å; T655-L657 PolarHBondContact O-N 3.45Å; T655-K658 WeakPolarHBondContact O-CB 3.28Å; T655-K658 PolarHBondContact O-N 3.09Å; T655-E659 PolarHBondContact O-N 2.94Å
656	K	93.4	Very high	88.9	Confident	66 Å²	66	66.7 Å²	66.7	29%	0.287	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-35.2	175.7	-66.4	-70	162.7	-137.1	0	113.2	P575 L578 E652 G653 K658 E659 A660	P575-K656 HydrophobicContact CG-CB 4.23Å; P575-K656 HydrophobicContact CG-CG 4.44Å; L578-K656 HydrophobicContact CD1-CB 4.32Å; L578-K656 HydrophobicContact CD1-CD 3.83Å; E652-K656 PolarHBondContact O-N 3.47Å; E652-K656 VanDerWaalsContact O-N 3.08Å; G653-K656 PolarHBondContact O-N 2.83Å; K656-K658 VanDerWaalsContact C-N 3.33Å; K656-E659 WeakPolarHBondContact CD-OE2 3.48Å; K656-E659 IonicContact NZ-OE1 3Å; K656-E659 PolarHBondContact NZ-OE1 2.97Å; K656-E659 IonicContact NZ-OE2 3.91Å; K656-E659 PolarHBondContact NZ-OE2 3.48Å; K656-E659 PolarHBondContact O-N 2.97Å; K656-A660 WeakPolarHBondContact O-CB 3.2Å; K656-A660 PolarHBondContact O-N 3.21Å
657	L	94.3	Very high	89	Confident	5 Å²	5	61.2 Å²	61.2	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-66.4	-35.1	173.5	-177.3	57.8	0	0	0	112	V573 L641 L644 L645 G653 T655 L661	V573-L657 HydrophobicContact CG1-CD1 4.3Å; L641-L657 HydrophobicContact CB-CD1 4.41Å; L641-L657 HydrophobicContact CD2-CD1 3.52Å; L644-L657 HydrophobicContact CB-CD2 4.17Å; L644-L657 HydrophobicContact CD2-CD1 4.05Å; L644-L657 HydrophobicContact CD2-CD2 4.02Å; L644-L657 HydrophobicContact CG-CD2 3.86Å; L645-L657 HydrophobicContact CB-CD2 4.04Å; L645-L657 HydrophobicContact CB-CG 4.2Å; L645-L657 HydrophobicContact CD1-CB 4.11Å; L645-L657 HydrophobicContact CD1-CD2 4.09Å; L645-L657 HydrophobicContact CD1-CG 3.99Å; G653-L657 VanDerWaalsContact O-CB 3.24Å; G653-L657 WeakPolarHBondContact O-CB 3.43Å; G653-L657 PolarHBondContact O-N 2.7Å; T655-L657 PolarHBondContact O-N 3.45Å; L657-L661 PolarHBondContact O-N 3.43Å
658	K	94.8	Very high	89.2	Confident	116 Å²	116	61.1 Å²	61.1	50%	0.504	32%	0.318	S	S	.	.	H	α-helix	trans	-70	-45.6	172.1	-175.1	-177.2	172.7	-173.1	0	112.3	L645 T654 T655 K656 A660 L661 D662	L645-K658 HydrophobicContact CD1-CB 4.16Å; L645-K658 HydrophobicContact CD2-CB 4.18Å; L645-K658 HydrophobicContact CD2-CG 4.37Å; T654-K658 WeakPolarHBondContact O-CB 3.5Å; T654-K658 PolarHBondContact O-N 3.44Å; T654-K658 VanDerWaalsContact O-N 3.12Å; T655-K658 WeakPolarHBondContact O-CB 3.28Å; T655-K658 PolarHBondContact O-N 3.09Å; K656-K658 VanDerWaalsContact C-N 3.33Å; K658-A660 VanDerWaalsContact C-N 3.25Å; K658-A660 PolarHBondContact O-N 2.97Å; K658-L661 WeakPolarHBondContact O-CB 3.31Å; K658-L661 PolarHBondContact O-N 3.34Å; K658-L661 VanDerWaalsContact O-N 3.13Å; K658-D662 PolarHBondContact O-N 2.92Å
659	E	95.8	Very high	89.4	Confident	82 Å²	82	64.1 Å²	64.1	38%	0.383	33%	0.329	S	S	.	.	H	α-helix	trans	-55.3	-41.8	173.2	-74.4	172.4	-147	0	0	111.5	L578 T655 K656 S663	L578-E659 HydrophobicContact CD1-CB 3.91Å; L578-E659 HydrophobicContact CD2-CB 4.09Å; T655-E659 PolarHBondContact O-N 2.94Å; K656-E659 WeakPolarHBondContact CD-OE2 3.48Å; K656-E659 IonicContact NZ-OE1 3Å; K656-E659 PolarHBondContact NZ-OE1 2.97Å; K656-E659 IonicContact NZ-OE2 3.91Å; K656-E659 PolarHBondContact NZ-OE2 3.48Å; K656-E659 PolarHBondContact O-N 2.97Å; E659-S663 VanDerWaalsContact O-CB 3.29Å; E659-S663 WeakPolarHBondContact O-CB 3.48Å; E659-S663 PolarHBondContact O-N 2.85Å
660	A	96.9	Very high	89.8	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-45	174.6	0	0	0	0	0	112.6	F577 L578 L641 K656 K658 S663 M664	F577-A660 HydrophobicContact CB-CB 3.86Å; L578-A660 HydrophobicContact CG-CB 4.24Å; L641-A660 HydrophobicContact CD1-CB 4.44Å; L641-A660 HydrophobicContact CD2-CB 4.49Å; K656-A660 WeakPolarHBondContact O-CB 3.2Å; K656-A660 PolarHBondContact O-N 3.21Å; K658-A660 VanDerWaalsContact C-N 3.25Å; K658-A660 PolarHBondContact O-N 2.97Å; A660-S663 PolarHBondContact O-N 3.24Å; A660-M664 WeakPolarHBondContact O-CG 3.13Å; A660-M664 PolarHBondContact O-N 3.01Å
661	L	96.9	Very high	90.4	Very high	14 Å²	14	53.4 Å²	53.4	7%	0.073	29%	0.287	C	S	.	.	H	α-helix	trans	-58.9	-49.5	175.6	173.4	60.1	0	0	0	111.6	Q638 L641 K642 L645 L657 K658 S663 M664 L665	Q638-L661 HydrophobicContact CB-CD1 3.75Å; Q638-L661 WeakPolarHBondContact O-CD1 3.28Å; L641-L661 HydrophobicContact CB-CB 4.23Å; L641-L661 HydrophobicContact CB-CD1 4.19Å; K642-L661 HydrophobicContact CB-CD1 4.05Å; K642-L661 HydrophobicContact CB-CD2 3.9Å; K642-L661 HydrophobicContact CG-CD2 4.29Å; L645-L661 HydrophobicContact CD2-CD2 3.95Å; L657-L661 PolarHBondContact O-N 3.43Å; K658-L661 WeakPolarHBondContact O-CB 3.31Å; K658-L661 PolarHBondContact O-N 3.34Å; K658-L661 VanDerWaalsContact O-N 3.13Å; L661-S663 VanDerWaalsContact C-N 3.35Å; L661-S663 PolarHBondContact O-N 3.46Å; L661-M664 PolarHBondContact O-N 3.41Å; L661-L665 HydrophobicContact CD1-CD1 4.05Å; L661-L665 HydrophobicContact CD1-CG 4.3Å; L661-L665 HydrophobicContact CG-CD1 4.09Å; L661-L665 WeakPolarHBondContact O-CG 3.35Å; L661-L665 PolarHBondContact O-N 2.97Å
662	D	95.4	Very high	91.1	Very high	78 Å²	78	54.7 Å²	54.7	42%	0.417	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-41.3	179.4	-70.5	-28.7	0	0	0	110.6	K658 M664 L665 E666	K658-D662 PolarHBondContact O-N 2.92Å; D662-M664 PolarHBondContact O-N 3.42Å; D662-L665 PolarHBondContact O-N 3.02Å; D662-E666 PolarHBondContact O-N 3.38Å
663	S	96.6	Very high	92	Very high	34 Å²	34	47.8 Å²	47.8	24%	0.238	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-38.4	174.4	-171.7	0	0	0	0	113.3	E659 A660 L661 L667	E659-S663 VanDerWaalsContact O-CB 3.29Å; E659-S663 WeakPolarHBondContact O-CB 3.48Å; E659-S663 PolarHBondContact O-N 2.85Å; A660-S663 PolarHBondContact O-N 3.24Å; L661-S663 VanDerWaalsContact C-N 3.35Å; L661-S663 PolarHBondContact O-N 3.46Å; S663-L667 PolarHBondContact O-N 2.95Å
664	M	96.9	Very high	92.3	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-74.1	-30.5	176.9	-66.5	-54.8	-74.6	0	0	112.2	F577 F584 I634 Y637 Q638 L641 A660 L661 D662 L667 L668	F577-M664 HydrophobicContact CD1-CE 4.25Å; F577-M664 HydrophobicContact CD1-CG 3.96Å; F577-M664 HydrophobicContact CD1-SD 3.88Å; F577-M664 HydrophobicContact CE1-CE 4.19Å; F577-M664 HydrophobicContact CE1-CG 4.4Å; F577-M664 HydrophobicContact CE1-SD 4.4Å; F584-M664 HydrophobicContact CD1-CE 4.2Å; F584-M664 HydrophobicContact CD2-CE 4.41Å; F584-M664 HydrophobicContact CD2-SD 4.18Å; F584-M664 HydrophobicContact CE1-CE 4.21Å; F584-M664 HydrophobicContact CE2-CE 4.44Å; F584-M664 HydrophobicContact CE2-SD 4.34Å; F584-M664 HydrophobicContact CG-CE 4.32Å; F584-M664 HydrophobicContact CZ-CE 4.33Å; I634-M664 HydrophobicContact CD1-CE 3.63Å; Y637-M664 HydrophobicContact CD2-CE 3.66Å; Y637-M664 HydrophobicContact CG-CE 4.15Å; Q638-M664 HydrophobicContact CB-CB 4.48Å; L641-M664 HydrophobicContact CD1-CB 4.33Å; L641-M664 HydrophobicContact CD1-CG 3.78Å; A660-M664 WeakPolarHBondContact O-CG 3.13Å; A660-M664 PolarHBondContact O-N 3.01Å; L661-M664 PolarHBondContact O-N 3.41Å; D662-M664 PolarHBondContact O-N 3.42Å; M664-L667 HydrophobicContact CE-CD2 4.05Å; M664-L667 HydrophobicContact SD-CD2 4.23Å; M664-L668 VanDerWaalsContact O-CG 3.31Å; M664-L668 WeakPolarHBondContact O-CG 3.39Å; M664-L668 PolarHBondContact O-N 3.3Å
665	L	94.5	Very high	92.4	Very high	71 Å²	71	48.9 Å²	48.9	37%	0.372	25%	0.253	S	S	.	.	H	α-helix	trans	-69.3	-41.3	171.2	-70.2	168.5	0	0	0	111.6	Q638 L661 D662 L668 K669	Q638-L665 HydrophobicContact CB-CD2 3.9Å; Q638-L665 HydrophobicContact CB-CG 4.15Å; Q638-L665 HydrophobicContact CG-CD2 3.85Å; L661-L665 HydrophobicContact CD1-CD1 4.05Å; L661-L665 HydrophobicContact CD1-CG 4.3Å; L661-L665 HydrophobicContact CG-CD1 4.09Å; L661-L665 WeakPolarHBondContact O-CG 3.35Å; L661-L665 PolarHBondContact O-N 2.97Å; D662-L665 PolarHBondContact O-N 3.02Å; L665-L668 PolarHBondContact O-N 2.98Å; L665-K669 WeakPolarHBondContact O-CB 3.23Å; L665-K669 PolarHBondContact O-N 3.06Å
666	E	91.5	Very high	92.3	Very high	133 Å²	133	46.9 Å²	46.9	62%	0.621	24%	0.238	S	C	*	.	H	α-helix	trans	-62.2	-41.9	172.5	-76.1	-154.2	177.6	0	0	112.3	D662 K669 S670	D662-E666 PolarHBondContact O-N 3.38Å; E666-K669 PolarHBondContact O-N 3.3Å; E666-S670 VanDerWaalsContact O-CB 3.31Å; E666-S670 WeakPolarHBondContact O-CB 3.4Å; E666-S670 PolarHBondContact O-N 3.3Å
667	L	92.9	Very high	92.1	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-59.6	-50.4	174.1	173.4	66.9	0	0	0	111.5	F584 I634 S663 M664 K669 S670 V671	F584-L667 HydrophobicContact CB-CD2 3.57Å; F584-L667 HydrophobicContact CG-CD2 4.34Å; I634-L667 HydrophobicContact CD1-CD2 3.74Å; I634-L667 HydrophobicContact CG1-CD2 4.21Å; S663-L667 PolarHBondContact O-N 2.95Å; M664-L667 HydrophobicContact CE-CD2 4.05Å; M664-L667 HydrophobicContact SD-CD2 4.23Å; L667-K669 VanDerWaalsContact C-N 3.29Å; L667-K669 PolarHBondContact O-N 3.38Å; L667-S670 WeakPolarHBondContact O-CB 3.45Å; L667-S670 PolarHBondContact O-N 3.47Å; L667-S670 VanDerWaalsContact O-N 3.11Å; L667-V671 HydrophobicContact CD1-CG2 3.98Å; L667-V671 HydrophobicContact CG-CG2 4.34Å; L667-V671 WeakPolarHBondContact O-CG2 3.37Å; L667-V671 PolarHBondContact O-N 3.21Å
668	L	92.9	Very high	91.7	Very high	33 Å²	33	49.5 Å²	49.5	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-61	-39.1	-179.9	-74.7	170.2	0	0	0	112.1	I634 T635 Q638 M664 L665 N672	I634-L668 HydrophobicContact CB-CD2 4.42Å; I634-L668 HydrophobicContact CG1-CD2 4.05Å; I634-L668 HydrophobicContact CG2-CD2 3.95Å; T635-L668 HydrophobicContact CG2-CD2 3.73Å; Q638-L668 HydrophobicContact CB-CD1 4.41Å; Q638-L668 HydrophobicContact CG-CD1 3.53Å; M664-L668 VanDerWaalsContact O-CG 3.31Å; M664-L668 WeakPolarHBondContact O-CG 3.39Å; M664-L668 PolarHBondContact O-N 3.3Å; L665-L668 PolarHBondContact O-N 2.98Å; L668-N672 WeakPolarHBondContact O-CB 3.02Å; L668-N672 PolarHBondContact O-N 3.02Å
669	K	89.3	Confident	91.5	Very high	86 Å²	86	44.8 Å²	44.8	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-48.9	171.3	-177.3	-173.3	178	-59.1	0	111.4	L665 E666 L667 V671 N672 D673 V694	L665-K669 WeakPolarHBondContact O-CB 3.23Å; L665-K669 PolarHBondContact O-N 3.06Å; E666-K669 PolarHBondContact O-N 3.3Å; L667-K669 VanDerWaalsContact C-N 3.29Å; L667-K669 PolarHBondContact O-N 3.38Å; K669-V671 PolarHBondContact O-N 3.09Å; K669-N672 PolarHBondContact O-N 3.02Å; K669-D673 WeakPolarHBondContact CG-OD2 3.48Å; K669-D673 IonicContact NZ-OD2 2.91Å; K669-D673 PolarHBondContact NZ-OD2 3.44Å; K669-D673 WeakPolarHBondContact O-CB 3.43Å; K669-D673 VanDerWaalsContact O-CG 3.31Å; K669-D673 PolarHBondContact O-N 2.79Å; K669-V694 WeakPolarHBondContact CE-O 3.41Å; K669-V694 PolarHBondContact NZ-O 3.26Å
670	S	88.5	Confident	91.2	Very high	56 Å²	56	41.7 Å²	41.7	39%	0.392	23%	0.225	S	C	.	.	H	α-helix	trans	-58.4	-46.6	179.5	-172.3	0	0	0	0	111.9	E666 L667 D673 S674	E666-S670 VanDerWaalsContact O-CB 3.31Å; E666-S670 WeakPolarHBondContact O-CB 3.4Å; E666-S670 PolarHBondContact O-N 3.3Å; L667-S670 WeakPolarHBondContact O-CB 3.45Å; L667-S670 PolarHBondContact O-N 3.47Å; L667-S670 VanDerWaalsContact O-N 3.11Å; S670-D673 PolarHBondContact O-N 3.18Å; S670-S674 VanDerWaalsContact O-CB 3.24Å; S670-S674 WeakPolarHBondContact O-CB 3.13Å; S670-S674 PolarHBondContact O-N 2.94Å
671	V	89.7	Confident	90.8	Very high	11 Å²	11	45.4 Å²	45.4	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-59.9	-48.9	175.3	172.3	0	0	0	0	110.7	A588 C591 L667 K669 S674 M675	A588-V671 HydrophobicContact CB-CG2 4.02Å; C591-V671 HydrophobicContact CB-CG1 3.63Å; L667-V671 HydrophobicContact CD1-CG2 3.98Å; L667-V671 HydrophobicContact CG-CG2 4.34Å; L667-V671 WeakPolarHBondContact O-CG2 3.37Å; L667-V671 PolarHBondContact O-N 3.21Å; K669-V671 PolarHBondContact O-N 3.09Å; V671-S674 WeakPolarHBondContact O-CB 3.36Å; V671-S674 PolarHBondContact O-N 3.17Å; V671-M675 WeakPolarHBondContact O-CG 3.49Å; V671-M675 PolarHBondContact O-N 2.95Å
672	N	89.1	Confident	90.4	Very high	72 Å²	72	48.5 Å²	48.5	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-47.8	178.8	-178.2	87.1	0	0	0	112.3	L668 K669 S674 M675 H676 Q696	L668-N672 WeakPolarHBondContact O-CB 3.02Å; L668-N672 PolarHBondContact O-N 3.02Å; K669-N672 PolarHBondContact O-N 3.02Å; N672-S674 VanDerWaalsContact C-N 3.28Å; N672-S674 PolarHBondContact O-N 3.16Å; N672-M675 VanDerWaalsContact O-CB 3.26Å; N672-M675 WeakPolarHBondContact O-CB 3.14Å; N672-M675 PolarHBondContact O-N 3.25Å; N672-H676 PolarHBondContact ND2-CD2 2.93Å; N672-H676 PolarHBondContact ND2-NE2 3.32Å; N672-H676 VanDerWaalsContact ND2-NE2 3.15Å; N672-H676 PolarHBondContact O-CD2 2.82Å; N672-H676 PolarHBondContact O-N 3.5Å; N672-Q696 PolarHBondContact ND2-NE2 2.86Å
673	D	87	Confident	90.1	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.053	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-34.2	-179.4	-71.2	-11.8	0	0	0	111.3	K669 S670 H676 Q677 M693 Q696	K669-D673 WeakPolarHBondContact CG-OD2 3.48Å; K669-D673 IonicContact NZ-OD2 2.91Å; K669-D673 PolarHBondContact NZ-OD2 3.44Å; K669-D673 WeakPolarHBondContact O-CB 3.43Å; K669-D673 VanDerWaalsContact O-CG 3.31Å; K669-D673 PolarHBondContact O-N 2.79Å; S670-D673 PolarHBondContact O-N 3.18Å; D673-H676 PolarHBondContact O-N 3.24Å; D673-Q677 PolarHBondContact O-N 3.49Å; D673-M693 HydrophobicContact CB-SD 3.77Å; D673-Q696 WeakPolarHBondContact OD1-CG 3.44Å; D673-Q696 PolarHBondContact OD1-NE2 3.33Å
674	S	86.1	Confident	89.5	Confident	28 Å²	28	52.5 Å²	52.5	20%	0.196	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-36.8	170.2	-165.9	0	0	0	0	113	Q592 S670 V671 N672 H676 Q677 T678	Q592-S674 PolarHBondContact NE2-OG 3.11Å; S670-S674 VanDerWaalsContact O-CB 3.24Å; S670-S674 WeakPolarHBondContact O-CB 3.13Å; S670-S674 PolarHBondContact O-N 2.94Å; V671-S674 WeakPolarHBondContact O-CB 3.36Å; V671-S674 PolarHBondContact O-N 3.17Å; N672-S674 VanDerWaalsContact C-N 3.28Å; N672-S674 PolarHBondContact O-N 3.16Å; S674-H676 VanDerWaalsContact C-N 3.32Å; S674-H676 PolarHBondContact O-N 3.02Å; S674-Q677 PolarHBondContact O-N 3.02Å; S674-T678 WeakPolarHBondContact O-CG2 3.49Å; S674-T678 PolarHBondContact O-N 3.01Å; S674-T678 PolarHBondContact O-OG1 2.84Å
675	M	87.1	Confident	89	Confident	46 Å²	46	54.8 Å²	54.8	23%	0.227	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-45.7	170.6	-63.7	-59.5	-63.5	0	0	111.2	C591 Q592 P595 V671 N672 T678 A679	C591-M675 HydrophobicContact CB-SD 3.86Å; C591-M675 VanDerWaalsContact O-CE 3.28Å; C591-M675 WeakPolarHBondContact O-CE 3.39Å; C591-M675 VanDerWaalsContact O-SD 3.34Å; Q592-M675 VanDerWaalsContact CA-SD 3.55Å; Q592-M675 HydrophobicContact CB-SD 4.45Å; Q592-M675 HydrophobicContact CG-SD 4.19Å; Q592-M675 PolarHBondContact N-SD 3.3Å; Q592-M675 VanDerWaalsContact N-SD 3.36Å; P595-M675 HydrophobicContact CG-CE 3.65Å; V671-M675 WeakPolarHBondContact O-CG 3.49Å; V671-M675 PolarHBondContact O-N 2.95Å; N672-M675 VanDerWaalsContact O-CB 3.26Å; N672-M675 WeakPolarHBondContact O-CB 3.14Å; N672-M675 PolarHBondContact O-N 3.25Å; M675-T678 PolarHBondContact O-OG1 3.03Å; M675-A679 PolarHBondContact O-N 3.31Å
676	H	88.1	Confident	88.6	Confident	32 Å²	32	54.6 Å²	54.6	15%	0.148	32%	0.316	C	S	.	.	H	α-helix	trans	-70.4	-33.4	178.1	-61.2	-78	0	0	0	112.4	N672 D673 S674 A679 Q696 F726 Y751	N672-H676 PolarHBondContact ND2-CD2 2.93Å; N672-H676 PolarHBondContact ND2-NE2 3.32Å; N672-H676 VanDerWaalsContact ND2-NE2 3.15Å; N672-H676 PolarHBondContact O-CD2 2.82Å; N672-H676 PolarHBondContact O-N 3.5Å; D673-H676 PolarHBondContact O-N 3.24Å; S674-H676 VanDerWaalsContact C-N 3.32Å; S674-H676 PolarHBondContact O-N 3.02Å; H676-A679 PolarHBondContact O-N 3.22Å; H676-Q696 HydrophobicContact CB-CG 4.19Å; H676-Q696 PolarHBondContact CD2-NE2 3.42Å; H676-F726 HydrophobicContact CB-CE1 3.72Å; H676-F726 HydrophobicContact CB-CZ 4.29Å; H676-Y751 HydrophobicContact CB-CE2 4.08Å; H676-Y751 AromaticContact ND1-CE2 3.84Å; H676-Y751 AromaticContact ND1-CZ 3.79Å; H676-Y751 PolarHBondContact ND1-OH 2.91Å
677	Q	89.1	Confident	88.5	Confident	43 Å²	43	49.7 Å²	49.7	20%	0.201	29%	0.294	C	S	.	.	H	α-helix	trans	-64.3	-47.3	175.8	-167.1	174	-48.8	0	0	112.3	D673 S674 A679 I680 I687 M693	D673-Q677 PolarHBondContact O-N 3.49Å; S674-Q677 PolarHBondContact O-N 3.02Å; Q677-A679 PolarHBondContact O-N 3.34Å; Q677-I680 WeakPolarHBondContact O-CB 3.25Å; Q677-I680 WeakPolarHBondContact O-CG1 3.37Å; Q677-I680 PolarHBondContact O-N 3.06Å; Q677-I680 VanDerWaalsContact O-N 3.11Å; Q677-I687 HydrophobicContact CG-CG2 3.91Å; Q677-M693 HydrophobicContact CB-CE 3.59Å; Q677-M693 HydrophobicContact CG-CE 3.89Å
678	T	87.5	Confident	88.1	Confident	84 Å²	84	55 Å²	55	52%	0.515	32%	0.323	S	S	.	.	H	α-helix	trans	-67.7	-13.5	179.2	58.3	0	0	0	0	113.8	Q592 S674 M675	Q592-T678 HydrophobicContact CG-CG2 4.31Å; S674-T678 WeakPolarHBondContact O-CG2 3.49Å; S674-T678 PolarHBondContact O-N 3.01Å; S674-T678 PolarHBondContact O-OG1 2.84Å; M675-T678 PolarHBondContact O-OG1 3.03Å
679	A	89	Confident	88.1	Confident	16 Å²	16	59.3 Å²	59.3	13%	0.132	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5	173.3	0	0	0	0	0	114.4	M675 H676 Q677 N681 P749 Y751	M675-A679 PolarHBondContact O-N 3.31Å; H676-A679 PolarHBondContact O-N 3.22Å; Q677-A679 PolarHBondContact O-N 3.34Å; A679-N681 PolarHBondContact O-N 3.23Å; A679-P749 WeakPolarHBondContact CB-O 3.27Å; A679-Y751 HydrophobicContact CB-CD2 3.67Å; A679-Y751 HydrophobicContact CB-CE2 4Å; A679-Y751 WeakPolarHBondContact O-CB 3.47Å; A679-Y751 PolarHBondContact O-N 3.42Å
680	I	90.9	Very high	88.1	Confident	17 Å²	17	56.2 Å²	56.2	9%	0.087	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	110.3	178.2	-58.7	172.7	0	0	0	110.6	Q677 I687 F726 Y728 M733	Q677-I680 WeakPolarHBondContact O-CB 3.25Å; Q677-I680 WeakPolarHBondContact O-CG1 3.37Å; Q677-I680 PolarHBondContact O-N 3.06Å; Q677-I680 VanDerWaalsContact O-N 3.11Å; I680-I687 HydrophobicContact CB-CD1 4.23Å; I680-I687 HydrophobicContact CD1-CD1 4.45Å; I680-I687 HydrophobicContact CG2-CD1 4.37Å; I680-F726 HydrophobicContact CD1-CD1 4.09Å; I680-F726 HydrophobicContact CD1-CD2 3.86Å; I680-F726 HydrophobicContact CD1-CE1 3.85Å; I680-F726 HydrophobicContact CD1-CE2 3.63Å; I680-F726 HydrophobicContact CD1-CG 4.07Å; I680-F726 HydrophobicContact CD1-CZ 3.61Å; I680-F726 HydrophobicContact CG1-CD2 4.42Å; I680-F726 HydrophobicContact CG1-CE1 4.22Å; I680-F726 HydrophobicContact CG1-CE2 3.71Å; I680-F726 HydrophobicContact CG1-CZ 3.57Å; I680-Y728 WeakPolarHBondContact CD1-OH 3.34Å; I680-M733 HydrophobicContact CD1-SD 4.01Å; I680-M733 HydrophobicContact CG2-SD 3.89Å
681	N	88.4	Confident	88.2	Confident	79 Å²	79	54.5 Å²	54.5	42%	0.422	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	146.9	-179	-67.6	-45.1	0	0	0	112	A679 Y683 S750 Y751 F753	A679-N681 PolarHBondContact O-N 3.23Å; N681-Y683 VanDerWaalsContact C-N 3.33Å; N681-Y683 PolarHBondContact O-N 3.12Å; N681-S750 PolarHBondContact ND2-OG 3.1Å; N681-Y751 PolarHBondContact N-O 3.17Å; N681-F753 PolarHBondContact O-N 2.9Å
682	A	87.2	Confident	88.1	Confident	80 Å²	80	60.2 Å²	60.2	66%	0.661	34%	0.344	S	S	*	.	S	Bend	trans	61.4	28.7	176.5	0	0	0	0	0	116	F753	A682-F753 WeakPolarHBondContact O-CD1 3.32Å
683	Y	88.9	Confident	88.2	Confident	55 Å²	55	57.5 Å²	57.5	22%	0.216	33%	0.329	C	S	.	.			trans	-81.9	135	160.3	179.6	-115.1	0	0	0	109.3	N681 G685 I687 M733 F753	N681-Y683 VanDerWaalsContact C-N 3.33Å; N681-Y683 PolarHBondContact O-N 3.12Å; Y683-G685 VanDerWaalsContact CD1-O 3.32Å; Y683-G685 WeakPolarHBondContact CD1-O 3.47Å; Y683-G685 VanDerWaalsContact CE1-C 3.41Å; Y683-G685 WeakPolarHBondContact CE1-O 3.36Å; Y683-I687 HydrophobicContact CD1-CD1 4.32Å; Y683-I687 HydrophobicContact CD1-CG1 3.51Å; Y683-I687 HydrophobicContact CE1-CG1 3.85Å; Y683-I687 HydrophobicContact CG-CG1 4.46Å; Y683-M733 HydrophobicContact CD1-CE 4.23Å; Y683-M733 HydrophobicContact CD2-CE 3.64Å; Y683-M733 HydrophobicContact CE1-CE 4.24Å; Y683-M733 HydrophobicContact CE2-CE 3.68Å; Y683-M733 HydrophobicContact CG-CE 3.93Å; Y683-F753 HydrophobicContact CD2-CD1 4.23Å; Y683-F753 AromaticContact CD2-CD2 3.73Å; Y683-F753 HydrophobicContact CD2-CD2 3.73Å; Y683-F753 HydrophobicContact CD2-CE1 4.13Å; Y683-F753 AromaticContact CD2-CE2 3.61Å; Y683-F753 HydrophobicContact CD2-CE2 3.61Å; Y683-F753 HydrophobicContact CD2-CG 4.04Å; Y683-F753 AromaticContact CD2-CZ 3.83Å; Y683-F753 HydrophobicContact CD2-CZ 3.83Å; Y683-F753 HydrophobicContact CE2-CE2 4.05Å; Y683-F753 HydrophobicContact CE2-CZ 4.15Å
684	V	85.4	Confident	88.4	Confident	141 Å²	141	58.2 Å²	58.2	86%	0.855	33%	0.334	S	S	*	.			trans	-109.7	95	178.6	-177.7	0	0	0	0	107.8
685	G	86.9	Confident	88.7	Confident	50 Å²	50	57.6 Å²	57.6	52%	0.515	33%	0.329	S	S	.	.	S	Bend	trans	151.3	170.8	-173.2	0	0	0	0	0	111	Y683	Y683-G685 VanDerWaalsContact CD1-O 3.32Å; Y683-G685 WeakPolarHBondContact CD1-O 3.47Å; Y683-G685 VanDerWaalsContact CE1-C 3.41Å; Y683-G685 WeakPolarHBondContact CE1-O 3.36Å
686	N	85.9	Confident	89	Confident	68 Å²	68	57.2 Å²	57.2	36%	0.364	33%	0.326	S	S	.	.			trans	-91.9	112.4	178.4	174.1	13.1	0	0	0	110	N688 E689	N686-N688 PolarHBondContact O-N 3.45Å; N686-N688 VanDerWaalsContact O-N 3.12Å; N686-N688 WeakPolarHBondContact OD1-CB 3.3Å; N686-N688 PolarHBondContact OD1-N 3.33Å; N686-N688 PolarHBondContact OD1-ND2 2.99Å; N686-E689 HydrophobicContact CB-CG 4.22Å; N686-E689 VanDerWaalsContact CB-OE1 3.23Å; N686-E689 WeakPolarHBondContact CB-OE1 3.41Å; N686-E689 PolarHBondContact ND2-OE1 3.37Å; N686-E689 WeakPolarHBondContact O-CB 3.43Å; N686-E689 PolarHBondContact O-N 3.08Å; N686-E689 VanDerWaalsContact O-N 3.1Å
687	I	89.4	Confident	89.3	Confident	30 Å²	30	56.3 Å²	56.3	15%	0.154	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-58.9	-29.9	-176.9	-60.9	177.4	0	0	0	111.7	Q677 I680 Y683 E689 L690 Y728	Q677-I687 HydrophobicContact CG-CG2 3.91Å; I680-I687 HydrophobicContact CB-CD1 4.23Å; I680-I687 HydrophobicContact CD1-CD1 4.45Å; I680-I687 HydrophobicContact CG2-CD1 4.37Å; Y683-I687 HydrophobicContact CD1-CD1 4.32Å; Y683-I687 HydrophobicContact CD1-CG1 3.51Å; Y683-I687 HydrophobicContact CE1-CG1 3.85Å; Y683-I687 HydrophobicContact CG-CG1 4.46Å; I687-E689 PolarHBondContact O-N 3.16Å; I687-L690 HydrophobicContact CG2-CD1 4.5Å; I687-L690 WeakPolarHBondContact O-CB 3.47Å; I687-L690 WeakPolarHBondContact O-CG 3.24Å; I687-L690 PolarHBondContact O-N 2.94Å; I687-Y728 HydrophobicContact CG2-CE1 3.85Å; I687-Y728 WeakPolarHBondContact CG2-OH 3.48Å
688	N	84.8	Confident	89.5	Confident	119 Å²	119	57.2 Å²	57.2	64%	0.636	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-67.8	-22.3	-178.3	-56.7	-31.9	0	0	0	113	N686 L690 G691	N686-N688 PolarHBondContact O-N 3.45Å; N686-N688 VanDerWaalsContact O-N 3.12Å; N686-N688 WeakPolarHBondContact OD1-CB 3.3Å; N686-N688 PolarHBondContact OD1-N 3.33Å; N686-N688 PolarHBondContact OD1-ND2 2.99Å; N688-L690 PolarHBondContact O-N 3.17Å; N688-G691 PolarHBondContact O-N 2.93Å
689	E	91.1	Very high	89.9	Confident	123 Å²	123	53.4 Å²	53.4	58%	0.575	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-68.8	-21.2	176.5	-77	156.8	-150.6	0	0	112.5	N686 I687 G691 K730	N686-E689 HydrophobicContact CB-CG 4.22Å; N686-E689 VanDerWaalsContact CB-OE1 3.23Å; N686-E689 WeakPolarHBondContact CB-OE1 3.41Å; N686-E689 PolarHBondContact ND2-OE1 3.37Å; N686-E689 WeakPolarHBondContact O-CB 3.43Å; N686-E689 PolarHBondContact O-N 3.08Å; N686-E689 VanDerWaalsContact O-N 3.1Å; I687-E689 PolarHBondContact O-N 3.16Å; E689-G691 PolarHBondContact O-N 3.37Å; E689-K730 WeakPolarHBondContact O-CD 3.4Å; E689-K730 WeakPolarHBondContact O-CE 3.34Å; E689-K730 PolarHBondContact O-NZ 3.36Å
690	L	90.9	Very high	90.1	Very high	20 Å²	20	55.4 Å²	55.4	11%	0.105	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-72.6	-9.3	178.7	-52.1	-178.8	0	0	0	113.6	I687 N688 Y728 K730 A731 M733	I687-L690 HydrophobicContact CG2-CD1 4.5Å; I687-L690 WeakPolarHBondContact O-CB 3.47Å; I687-L690 WeakPolarHBondContact O-CG 3.24Å; I687-L690 PolarHBondContact O-N 2.94Å; N688-L690 PolarHBondContact O-N 3.17Å; L690-Y728 HydrophobicContact CB-CD1 4.13Å; L690-Y728 HydrophobicContact CB-CD2 4.25Å; L690-Y728 HydrophobicContact CB-CG 3.86Å; L690-Y728 HydrophobicContact CD1-CD2 3.95Å; L690-Y728 HydrophobicContact CD1-CE2 3.94Å; L690-Y728 HydrophobicContact CD1-CG 4.37Å; L690-Y728 WeakPolarHBondContact O-CB 3.48Å; L690-K730 VanDerWaalsContact O-CB 3.31Å; L690-K730 WeakPolarHBondContact O-CB 3.14Å; L690-K730 WeakPolarHBondContact O-CG 3.34Å; L690-K730 PolarHBondContact O-N 3.18Å; L690-A731 HydrophobicContact CD2-CB 3.99Å; L690-M733 HydrophobicContact CD1-CE 3.59Å
691	G	89.9	Confident	90.1	Very high	21 Å²	21	54.9 Å²	54.9	22%	0.216	32%	0.319	C	S	.	.			trans	87.7	-170.3	-174.8	0	0	0	0	0	113.3	N688 E689	N688-G691 PolarHBondContact O-N 2.93Å; E689-G691 PolarHBondContact O-N 3.37Å
692	K	87.5	Confident	90.1	Very high	130 Å²	130	53.2 Å²	53.2	57%	0.565	31%	0.307	S	S	*	.			trans	-64.1	139.9	178.8	-168.5	177	178	177	0	110.5	V694 Y728 E729	K692-V694 PolarHBondContact O-N 2.84Å; K692-Y728 WeakPolarHBondContact O-CA 3.31Å; K692-E729 VanDerWaalsContact CB-CD 3.46Å; K692-E729 HydrophobicContact CB-CG 4.2Å; K692-E729 WeakPolarHBondContact CB-OE1 3.48Å; K692-E729 WeakPolarHBondContact CB-OE2 3.46Å; K692-E729 PolarHBondContact N-OE2 2.86Å; K692-E729 PolarHBondContact O-N 3.04Å
693	M	90.8	Very high	89.9	Confident	15 Å²	15	51.1 Å²	51.1	7%	0.074	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	124.5	167.7	-169.4	-175.8	-61.3	0	0	109.8	D673 Q677 Q696 F726 Y728	D673-M693 HydrophobicContact CB-SD 3.77Å; Q677-M693 HydrophobicContact CB-CE 3.59Å; Q677-M693 HydrophobicContact CG-CE 3.89Å; M693-Q696 HydrophobicContact SD-CB 4.11Å; M693-Q696 HydrophobicContact SD-CG 4.02Å; M693-F726 HydrophobicContact CE-CB 4.48Å; M693-F726 HydrophobicContact CE-CD1 3.42Å; M693-F726 VanDerWaalsContact CE-CD1 3.42Å; M693-F726 HydrophobicContact CE-CE1 3.97Å; M693-F726 HydrophobicContact CE-CG 4.34Å; M693-F726 HydrophobicContact SD-CD1 3.77Å; M693-F726 HydrophobicContact SD-CE1 4.43Å; M693-Y728 HydrophobicContact CB-CD1 3.94Å; M693-Y728 HydrophobicContact CB-CE1 3.9Å; M693-Y728 HydrophobicContact CE-CE1 3.81Å; M693-Y728 WeakPolarHBondContact CE-OH 3.5Å; M693-Y728 HydrophobicContact CG-CD1 4.42Å; M693-Y728 HydrophobicContact CG-CE1 4.27Å
694	V	91.5	Very high	88.9	Confident	25 Å²	25	49.6 Å²	49.6	15%	0.152	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-44.6	-177	-171.9	0	0	0	0	110.7	K669 K692 L727 E729 E802 I806	K669-V694 WeakPolarHBondContact CE-O 3.41Å; K669-V694 PolarHBondContact NZ-O 3.26Å; K692-V694 PolarHBondContact O-N 2.84Å; V694-L727 HydrophobicContact CB-CD2 4.29Å; V694-L727 HydrophobicContact CB-CG 4.27Å; V694-L727 HydrophobicContact CG1-CD2 4.45Å; V694-L727 PolarHBondContact N-O 3.47Å; V694-E729 HydrophobicContact CG2-CG 4.02Å; V694-E802 HydrophobicContact CG1-CB 3.87Å; V694-E802 HydrophobicContact CG1-CG 4.16Å; V694-I806 HydrophobicContact CG2-CD1 4.11Å
695	L	93.1	Very high	87.5	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.079	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	152.7	176.9	-65.1	172.4	0	0	0	111.4	L727 L798 W799 E802	L695-L727 HydrophobicContact CB-CB 4.21Å; L695-L727 HydrophobicContact CB-CD2 4.35Å; L695-L727 HydrophobicContact CD1-CD2 4.14Å; L695-L727 HydrophobicContact CG-CD2 4.4Å; L695-L727 PolarHBondContact N-O 3.39Å; L695-L727 PolarHBondContact O-N 2.73Å; L695-L798 HydrophobicContact CD1-CG 4.16Å; L695-L798 HydrophobicContact CD2-CD2 4.06Å; L695-L798 HydrophobicContact CD2-CG 4.18Å; L695-W799 HydrophobicContact CB-CH2 4.32Å; L695-W799 HydrophobicContact CB-CZ2 3.65Å; L695-W799 HydrophobicContact CD1-CB 4.46Å; L695-W799 HydrophobicContact CD1-CD2 4.08Å; L695-W799 HydrophobicContact CD1-CG 3.89Å; L695-E802 HydrophobicContact CD1-CB 3.98Å; L695-E802 HydrophobicContact CD1-CG 4.04Å; L695-E802 HydrophobicContact CG-CG 4.45Å
696	Q	93.8	Very high	85.8	Confident	39 Å²	39	51.8 Å²	51.8	18%	0.182	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	162.9	159.9	52.6	65.7	29.4	0	0	111.3	N672 D673 H676 M693 H724 L725 F726	N672-Q696 PolarHBondContact ND2-NE2 2.86Å; D673-Q696 WeakPolarHBondContact OD1-CG 3.44Å; D673-Q696 PolarHBondContact OD1-NE2 3.33Å; H676-Q696 HydrophobicContact CB-CG 4.19Å; H676-Q696 PolarHBondContact CD2-NE2 3.42Å; M693-Q696 HydrophobicContact SD-CB 4.11Å; M693-Q696 HydrophobicContact SD-CG 4.02Å; Q696-H724 PolarHBondContact OE1-CE1 3.08Å; Q696-H724 PolarHBondContact OE1-NE2 3.14Å; Q696-L725 VanDerWaalsContact CA-O 3.22Å; Q696-L725 WeakPolarHBondContact CA-O 3.2Å; Q696-F726 HydrophobicContact CB-CD1 3.64Å; Q696-F726 HydrophobicContact CB-CE1 4.03Å; Q696-F726 HydrophobicContact CB-CG 4.4Å; Q696-F726 HydrophobicContact CG-CD1 4.41Å; Q696-F726 HydrophobicContact CG-CE1 4.48Å
697	G	92.9	Very high	83.9	Confident	13 Å²	13	58.4 Å²	58.4	13%	0.134	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.3	160.3	178.9	0	0	0	0	0	114.3	F699 H724 L725	G697-F699 VanDerWaalsContact C-CE2 3.49Å; G697-F699 VanDerWaalsContact O-CD2 3.25Å; G697-F699 WeakPolarHBondContact O-CD2 3.39Å; G697-F699 WeakPolarHBondContact O-CE2 3.39Å; G697-H724 VanDerWaalsContact C-ND1 3.28Å; G697-H724 CarbonylContact O-C 3.47Å; G697-H724 VanDerWaalsContact O-CA 3.31Å; G697-H724 WeakPolarHBondContact O-CA 3.32Å; G697-H724 PolarHBondContact O-ND1 3.34Å; G697-L725 PolarHBondContact N-O 3.49Å; G697-L725 VanDerWaalsContact N-O 3.09Å; G697-L725 PolarHBondContact O-N 2.95Å
698	S	93.3	Very high	81.4	Confident	61 Å²	61	59.9 Å²	59.9	43%	0.427	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.3	176.4	-64.3	0	0	0	0	111.5	H724	S698-H724 PolarHBondContact N-ND1 3.08Å; S698-H724 PolarHBondContact OG-ND1 3.31Å
699	F	95.6	Very high	79.2	Confident	5 Å²	5	58.9 Å²	58.9	2%	0.022	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.6	-174.9	-62.6	-86.5	0	0	0	112.1	G697 V701 Q722 R723 L725 V788 Q789 A790 V795 W799	G697-F699 VanDerWaalsContact C-CE2 3.49Å; G697-F699 VanDerWaalsContact O-CD2 3.25Å; G697-F699 WeakPolarHBondContact O-CD2 3.39Å; G697-F699 WeakPolarHBondContact O-CE2 3.39Å; F699-V701 HydrophobicContact CB-CG2 4.06Å; F699-Q722 WeakPolarHBondContact O-CA 3.46Å; F699-R723 PolarHBondContact N-O 2.97Å; F699-R723 PolarHBondContact O-N 2.9Å; F699-L725 HydrophobicContact CB-CD1 4.45Å; F699-L725 HydrophobicContact CD2-CB 3.99Å; F699-L725 HydrophobicContact CD2-CD1 4.14Å; F699-L725 HydrophobicContact CD2-CD2 4.07Å; F699-L725 HydrophobicContact CD2-CG 4.28Å; F699-L725 HydrophobicContact CE2-CB 4.17Å; F699-V788 HydrophobicContact CB-CG1 3.75Å; F699-V788 HydrophobicContact CD1-CG1 3.42Å; F699-V788 VanDerWaalsContact CD1-CG1 3.42Å; F699-V788 HydrophobicContact CD2-CG1 4.49Å; F699-V788 HydrophobicContact CE1-CG1 4.17Å; F699-V788 HydrophobicContact CG-CG1 3.63Å; F699-Q789 WeakPolarHBondContact CD1-O 3.24Å; F699-A790 HydrophobicContact CD1-CB 4.35Å; F699-A790 HydrophobicContact CE1-CB 3.97Å; F699-V795 HydrophobicContact CE1-CG1 4.04Å; F699-V795 HydrophobicContact CZ-CG1 4.06Å; F699-W799 HydrophobicContact CE2-CD2 4.16Å; F699-W799 AromaticContact CE2-CE2 3.71Å; F699-W799 HydrophobicContact CE2-CE3 4.45Å; F699-W799 HydrophobicContact CE2-CH2 4.02Å; F699-W799 AromaticContact CE2-CZ2 3.65Å; F699-W799 HydrophobicContact CE2-CZ2 3.65Å; F699-W799 HydrophobicContact CE2-CZ3 4.4Å; F699-W799 AromaticContact CZ-CD1 3.9Å; F699-W799 AromaticContact CZ-CD2 3.72Å; F699-W799 HydrophobicContact CZ-CD2 3.72Å; F699-W799 AromaticContact CZ-CE2 3.48Å; F699-W799 VanDerWaalsContact CZ-CE2 3.48Å; F699-W799 HydrophobicContact CZ-CE3 4.33Å; F699-W799 HydrophobicContact CZ-CG 4.02Å; F699-W799 AromaticContact CZ-CZ2 3.95Å; F699-W799 HydrophobicContact CZ-CZ2 3.95Å; F699-W799 AromaticContact CZ-NE1 3.57Å
700	N	92.9	Very high	76.6	Confident	57 Å²	57	58.7 Å²	58.7	31%	0.305	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.9	162.4	-76.4	-22.6	0	0	0	108.4	W702 P720 Q789	N700-W702 HydrophobicContact CB-CH2 4.01Å; N700-W702 HydrophobicContact CB-CZ3 4.05Å; N700-P720 HydrophobicContact CB-CB 3.73Å; N700-P720 HydrophobicContact CB-CG 4.45Å; N700-Q789 HydrophobicContact CB-CB 4.14Å; N700-Q789 PolarHBondContact N-O 3Å; N700-Q789 PolarHBondContact ND2-OE1 3.42Å; N700-Q789 PolarHBondContact O-N 3.09Å
701	V	92.4	Very high	74.2	Confident	6 Å²	6	66.2 Å²	66.2	4%	0.036	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.6	-174.5	-175	0	0	0	0	111.3	F699 M721 R723 L725 F734 Y786 I787 V788	F699-V701 HydrophobicContact CB-CG2 4.06Å; V701-M721 PolarHBondContact N-O 3.32Å; V701-M721 WeakPolarHBondContact O-CA 3.42Å; V701-M721 WeakPolarHBondContact O-CB 3.28Å; V701-M721 PolarHBondContact O-N 2.99Å; V701-R723 HydrophobicContact CB-CG 4.35Å; V701-R723 HydrophobicContact CG2-CB 3.96Å; V701-R723 HydrophobicContact CG2-CG 4.24Å; V701-L725 HydrophobicContact CG2-CD1 4.09Å; V701-F734 HydrophobicContact CG1-CE1 4.22Å; V701-Y786 HydrophobicContact CG1-CD1 4.06Å; V701-I787 CarbonylContact C-O 3.58Å; V701-I787 VanDerWaalsContact CA-O 3.29Å; V701-I787 WeakPolarHBondContact CA-O 3.35Å; V701-V788 HydrophobicContact CG2-CG2 4.34Å
702	W	87.7	Confident	71.7	Confident	44 Å²	44	68.9 Å²	68.9	17%	0.167	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	152.1	168.7	-60.1	-100.3	0	0	0	109.7	N700 F718 P720 K774 Y786 I787 Q789	N700-W702 HydrophobicContact CB-CH2 4.01Å; N700-W702 HydrophobicContact CB-CZ3 4.05Å; W702-F718 VanDerWaalsContact CD1-O 3.29Å; W702-F718 PolarHBondContact NE1-O 3.17Å; W702-P720 HydrophobicContact CD2-CB 4.17Å; W702-P720 HydrophobicContact CH2-CB 3.97Å; W702-P720 HydrophobicContact CH2-CG 4.38Å; W702-P720 HydrophobicContact CZ2-CB 3.57Å; W702-P720 HydrophobicContact CZ2-CG 3.77Å; W702-P720 HydrophobicContact CZ3-CB 4.43Å; W702-K774 HydrophobicContact CZ3-CD 4.35Å; W702-Y786 CarbonylContact O-C 3.58Å; W702-Y786 WeakPolarHBondContact O-CA 3.4Å; W702-I787 HydrophobicContact CB-CB 4.29Å; W702-I787 HydrophobicContact CE3-CB 4.43Å; W702-I787 HydrophobicContact CE3-CG2 4.33Å; W702-I787 PolarHBondContact N-O 2.92Å; W702-I787 PolarHBondContact O-N 2.88Å; W702-Q789 HydrophobicContact CH2-CB 4.13Å; W702-Q789 HydrophobicContact CZ3-CB 3.69Å
703	L	83	Confident	69.4	Low	36 Å²	36	72.2 Å²	72.2	19%	0.188	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128	169.3	-167.1	79.2	0	0	0	109.3	E784 I785 Y786	L703-E784 HydrophobicContact CD1-CB 4.17Å; L703-E784 HydrophobicContact CD1-CG 4.39Å; L703-I785 CarbonylContact C-O 3.52Å; L703-I785 WeakPolarHBondContact CA-O 3.31Å; L703-Y786 HydrophobicContact CD1-CD1 3.9Å; L703-Y786 HydrophobicContact CD1-CD2 4.1Å; L703-Y786 HydrophobicContact CD1-CE1 3.6Å; L703-Y786 HydrophobicContact CD1-CE2 3.79Å; L703-Y786 HydrophobicContact CD1-CG 4.12Å
704	G	67.4	Low	67	Low	23 Å²	23	74 Å²	74	24%	0.237	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	159.5	171.3	0	0	0	0	0	111.5	I785	G704-I785 PolarHBondContact N-O 3.04Å; G704-I785 WeakPolarHBondContact O-CB 3.39Å; G704-I785 PolarHBondContact O-N 3.31Å
705	H	56.7	Low	64.7	Low	100 Å²	100	77.8 Å²	77.8	46%	0.463	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145.6	-177.8	-71.5	-61	0	0	0	111.6	K707 D714 R717 E784	H705-K707 PolarHBondContact O-N 3.01Å; H705-D714 IonicContact CD2-OD2 3.82Å; H705-D714 PolarHBondContact CD2-OD2 3.06Å; H705-D714 IonicContact NE2-OD2 2.65Å; H705-D714 PolarHBondContact NE2-OD2 2.88Å; H705-R717 PolarHBondContact NE2-NH2 2.94Å; H705-E784 VanDerWaalsContact CE1-CG 3.47Å; H705-E784 WeakPolarHBondContact CE1-CG 3.44Å; H705-E784 IonicContact CE1-OE1 2.73Å
706	R	50.6	Low	62.1	Low	137 Å²	137	81.2 Å²	81.2	52%	0.517	44%	0.439	S	S	.	.	S	Bend	trans	-91.4	84	-166.9	-155.8	177	-164.4	-154.5	3.3	113.2	I785	R706-I785 HydrophobicContact CB-CD1 4.04Å; R706-I785 HydrophobicContact CG-CD1 4.09Å
707	K	46	Very low	60.1	Low	208 Å²	208	83.3 Å²	83.3	90%	0.904	45%	0.445	S	S	*	.	S	Bend	trans	61.1	61	171.9	-63.9	-175.5	171.3	-175.3	0	116.1	H705	H705-K707 PolarHBondContact O-N 3.01Å
708	G	38.5	Very low	58	Low	60 Å²	60	89 Å²	89	62%	0.619	47%	0.467	S	S	*	.	S	Bend	trans	-96.6	162.9	147.4	0	0	0	0	0	110.6	T710	G708-T710 PolarHBondContact O-N 3.25Å
709	A	37.1	Very low	56.3	Low	99 Å²	99	91.4 Å²	91.4	82%	0.818	47%	0.469	S	S	*	.			trans	-59.6	125	160.1	0	0	0	0	0	108.1	K711	A709-K711 PolarHBondContact O-N 3.45Å
710	T	37.8	Very low	55.3	Low	119 Å²	119	93 Å²	93	73%	0.73	48%	0.48	S	S	*	.			trans	-62.3	96.7	-164.4	-48.5	0	0	0	0	111.8	G708 M712	G708-T710 PolarHBondContact O-N 3.25Å; T710-M712 PolarHBondContact O-N 3.37Å; T710-M712 VanDerWaalsContact O-N 3.13Å
711	K	39.3	Very low	55	Low	177 Å²	177	94.8 Å²	94.8	77%	0.77	49%	0.488	S	S	*	.			trans	-63.2	116.6	177.3	-72	-177.7	177.8	176.8	0	109.1	A709 K713 D714	A709-K711 PolarHBondContact O-N 3.45Å; K711-K713 PolarHBondContact O-N 3.38Å; K711-D714 PolarHBondContact O-N 3.27Å
712	M	38.6	Very low	54.9	Low	78 Å²	78	99.6 Å²	99.6	38%	0.384	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-65.6	5.9	-171.2	-63.8	178.1	83.9	0	0	115.3	D198 A202 T710 D714 F715	D198-M712 HydrophobicContact CB-CE 4.1Å; D198-M712 HydrophobicContact CB-SD 3.92Å; D198-M712 WeakPolarHBondContact O-CE 3.41Å; A202-M712 HydrophobicContact CB-CE 3.74Å; T710-M712 PolarHBondContact O-N 3.37Å; T710-M712 VanDerWaalsContact O-N 3.13Å; M712-D714 PolarHBondContact O-N 2.9Å; M712-F715 HydrophobicContact CB-CD2 4.22Å; M712-F715 HydrophobicContact CB-CE2 3.68Å; M712-F715 HydrophobicContact CE-CE2 3.81Å; M712-F715 HydrophobicContact CE-CZ 4.25Å; M712-F715 HydrophobicContact CG-CE2 3.77Å; M712-F715 HydrophobicContact CG-CZ 4.39Å; M712-F715 VanDerWaalsContact O-CD2 3.26Å; M712-F715 WeakPolarHBondContact O-CD2 3.35Å
713	K	37.8	Very low	55.2	Low	200 Å²	200	99.5 Å²	99.5	87%	0.87	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-70.7	-13.5	169.7	-94.7	-175.3	171.6	-179.9	0	114	K711	K711-K713 PolarHBondContact O-N 3.38Å
714	D	40.9	Very low	55.8	Low	52 Å²	52	98.1 Å²	98.1	28%	0.278	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-96.6	-2.5	-166.4	-87.3	21.2	0	0	0	115.9	H705 K711 M712 A716 R717	H705-D714 IonicContact CD2-OD2 3.82Å; H705-D714 PolarHBondContact CD2-OD2 3.06Å; H705-D714 IonicContact NE2-OD2 2.65Å; H705-D714 PolarHBondContact NE2-OD2 2.88Å; K711-D714 PolarHBondContact O-N 3.27Å; M712-D714 PolarHBondContact O-N 2.9Å; D714-A716 PolarHBondContact O-N 2.92Å; D714-R717 WeakPolarHBondContact O-CB 3.21Å; D714-R717 PolarHBondContact O-N 3.01Å; D714-R717 IonicContact OD1-CZ 3.14Å; D714-R717 IonicContact OD1-NE 2.67Å; D714-R717 IonicContact OD1-NH2 2.74Å; D714-R717 PolarHBondContact OD1-NH2 2.99Å; D714-R717 IonicContact OD2-CZ 2.7Å; D714-R717 IonicContact OD2-NE 3.47Å; D714-R717 PolarHBondContact OD2-NE 2.91Å; D714-R717 IonicContact OD2-NH2 3.67Å; D714-R717 PolarHBondContact OD2-NH2 2.96Å
715	F	42.2	Very low	57.2	Low	105 Å²	105	97 Å²	97	46%	0.461	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-57.4	-22.1	-175.7	-74.6	-67.1	0	0	0	114.8	M712 R717 F718	M712-F715 HydrophobicContact CB-CD2 4.22Å; M712-F715 HydrophobicContact CB-CE2 3.68Å; M712-F715 HydrophobicContact CE-CE2 3.81Å; M712-F715 HydrophobicContact CE-CZ 4.25Å; M712-F715 HydrophobicContact CG-CE2 3.77Å; M712-F715 HydrophobicContact CG-CZ 4.39Å; M712-F715 VanDerWaalsContact O-CD2 3.26Å; M712-F715 WeakPolarHBondContact O-CD2 3.35Å; F715-R717 PolarHBondContact O-N 3.01Å; F715-F718 AromaticContact CD1-CE2 3.96Å; F715-F718 HydrophobicContact CD1-CE2 3.96Å; F715-F718 HydrophobicContact CE1-CE2 4.48Å
716	A	40.2	Very low	59.1	Low	86 Å²	86	92.2 Å²	92.2	71%	0.711	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-64.7	-3.6	173.7	0	0	0	0	0	115	D714	D714-A716 PolarHBondContact O-N 2.92Å
717	R	50.6	Low	61.2	Low	83 Å²	83	85.7 Å²	85.7	31%	0.313	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-101.4	7.1	-173.3	-57.8	-158.2	-117	-136.2	6.3	116.1	H705 D714 F715	H705-R717 PolarHBondContact NE2-NH2 2.94Å; D714-R717 WeakPolarHBondContact O-CB 3.21Å; D714-R717 PolarHBondContact O-N 3.01Å; D714-R717 IonicContact OD1-CZ 3.14Å; D714-R717 IonicContact OD1-NE 2.67Å; D714-R717 IonicContact OD1-NH2 2.74Å; D714-R717 PolarHBondContact OD1-NH2 2.99Å; D714-R717 IonicContact OD2-CZ 2.7Å; D714-R717 IonicContact OD2-NE 3.47Å; D714-R717 PolarHBondContact OD2-NE 2.91Å; D714-R717 IonicContact OD2-NH2 3.67Å; D714-R717 PolarHBondContact OD2-NH2 2.96Å; F715-R717 PolarHBondContact O-N 3.01Å
718	F	50.1	Low	63.6	Low	133 Å²	133	75.8 Å²	75.8	58%	0.583	40%	0.401	S	S	*	.			trans	-71.3	-31.5	175.4	-82.4	-78.7	0	0	0	114	W702 F715 P720	W702-F718 VanDerWaalsContact CD1-O 3.29Å; W702-F718 PolarHBondContact NE1-O 3.17Å; F715-F718 AromaticContact CD1-CE2 3.96Å; F715-F718 HydrophobicContact CD1-CE2 3.96Å; F715-F718 HydrophobicContact CE1-CE2 4.48Å; F718-P720 WeakPolarHBondContact O-CD 3.44Å
719	K	57.8	Low	66.2	Low	111 Å²	111	77 Å²	77	48%	0.483	39%	0.39	S	S	.	.	S	Bend	trans	-69.4	122.3	174.3	-170.7	162	-163.9	161	0	109.5	A120 M721	A120-K719 WeakPolarHBondContact O-CD 3.42Å; A120-K719 WeakPolarHBondContact O-CE 3.3Å; A120-K719 PolarHBondContact O-NZ 2.96Å; K719-M721 PolarHBondContact O-N 3.11Å
720	P	74.4	Confident	68.9	Low	39 Å²	39	78 Å²	78	25%	0.253	38%	0.376	S	S	.	.			trans	-57.4	129.2	177.2	18.1	-28.3	0	0	0	110.9	N700 W702 F718 Q722	N700-P720 HydrophobicContact CB-CB 3.73Å; N700-P720 HydrophobicContact CB-CG 4.45Å; W702-P720 HydrophobicContact CD2-CB 4.17Å; W702-P720 HydrophobicContact CH2-CB 3.97Å; W702-P720 HydrophobicContact CH2-CG 4.38Å; W702-P720 HydrophobicContact CZ2-CB 3.57Å; W702-P720 HydrophobicContact CZ2-CG 3.77Å; W702-P720 HydrophobicContact CZ3-CB 4.43Å; F718-P720 WeakPolarHBondContact O-CD 3.44Å; P720-Q722 PolarHBondContact O-N 3.36Å
721	M	85.9	Confident	71.6	Confident	94 Å²	94	72.4 Å²	72.4	46%	0.463	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	106.2	167.9	-67.8	-165.2	176.5	0	0	108.4	V701 K719 R723	V701-M721 PolarHBondContact N-O 3.32Å; V701-M721 WeakPolarHBondContact O-CA 3.42Å; V701-M721 WeakPolarHBondContact O-CB 3.28Å; V701-M721 PolarHBondContact O-N 2.99Å; K719-M721 PolarHBondContact O-N 3.11Å; M721-R723 HydrophobicContact CB-CG 4.41Å; M721-R723 PolarHBondContact O-N 3.4Å; M721-R723 PolarHBondContact SD-NH2 3.2Å
722	Q	90.6	Very high	74.3	Confident	108 Å²	108	64 Å²	64	51%	0.505	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	123.5	167.4	-162.6	-171.8	48.4	0	0	108.5	F699 P720	F699-Q722 WeakPolarHBondContact O-CA 3.46Å; P720-Q722 PolarHBondContact O-N 3.36Å
723	R	94	Very high	77	Confident	42 Å²	42	60.3 Å²	60.3	16%	0.158	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	143.1	179.8	-70.4	-67.6	179.3	-86.2	-1.4	109.6	F699 V701 M721 L725 F734 C735	F699-R723 PolarHBondContact N-O 2.97Å; F699-R723 PolarHBondContact O-N 2.9Å; V701-R723 HydrophobicContact CB-CG 4.35Å; V701-R723 HydrophobicContact CG2-CB 3.96Å; V701-R723 HydrophobicContact CG2-CG 4.24Å; M721-R723 HydrophobicContact CB-CG 4.41Å; M721-R723 PolarHBondContact O-N 3.4Å; M721-R723 PolarHBondContact SD-NH2 3.2Å; R723-L725 HydrophobicContact CB-CD1 3.52Å; R723-F734 HydrophobicContact CG-CD1 4.43Å; R723-C735 CarbonylContact C-O 3.57Å; R723-C735 VanDerWaalsContact CA-O 3.3Å; R723-C735 WeakPolarHBondContact CA-O 3.43Å; R723-C735 WeakPolarHBondContact CD-O 3.47Å
724	H	95.1	Very high	79.8	Confident	6 Å²	6	51 Å²	51	3%	0.028	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.2	163.4	-157.8	78	0	0	0	106.8	Q696 G697 S698 F726 C735 Y751	Q696-H724 PolarHBondContact OE1-CE1 3.08Å; Q696-H724 PolarHBondContact OE1-NE2 3.14Å; G697-H724 VanDerWaalsContact C-ND1 3.28Å; G697-H724 CarbonylContact O-C 3.47Å; G697-H724 VanDerWaalsContact O-CA 3.31Å; G697-H724 WeakPolarHBondContact O-CA 3.32Å; G697-H724 PolarHBondContact O-ND1 3.34Å; S698-H724 PolarHBondContact N-ND1 3.08Å; S698-H724 PolarHBondContact OG-ND1 3.31Å; H724-F726 AromaticContact CD2-CE2 3.76Å; H724-F726 AromaticContact CD2-CZ 3.58Å; H724-C735 PolarHBondContact N-O 3.36Å; H724-C735 PolarHBondContact O-N 3.4Å; H724-Y751 HydrophobicContact CB-CD1 3.73Å; H724-Y751 HydrophobicContact CB-CE1 3.48Å; H724-Y751 VanDerWaalsContact CB-CE1 3.48Å; H724-Y751 AromaticContact CD2-CD1 3.93Å; H724-Y751 AromaticContact CD2-CE1 3.23Å; H724-Y751 WeakPolarHBondContact CD2-CE1 3.49Å; H724-Y751 AromaticContact CD2-CZ 3.35Å; H724-Y751 PolarHBondContact CD2-OH 3.15Å; H724-Y751 AromaticContact CE1-CZ 3.97Å; H724-Y751 PolarHBondContact CE1-OH 2.98Å; H724-Y751 VanDerWaalsContact CE1-OH 3.23Å; H724-Y751 AromaticContact CG-CD1 3.95Å; H724-Y751 AromaticContact CG-CE1 3.23Å; H724-Y751 AromaticContact CG-CZ 3.8Å; H724-Y751 AromaticContact ND1-CE1 3.78Å; H724-Y751 AromaticContact NE2-CE1 3.75Å; H724-Y751 AromaticContact NE2-CZ 3.43Å; H724-Y751 PolarHBondContact NE2-OH 3.2Å
725	L	96.5	Very high	82.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	142.3	-178.6	-84.7	56.9	0	0	0	108.7	Q696 G697 F699 V701 R723 V732 M733 F734 I777 V788 W799	Q696-L725 VanDerWaalsContact CA-O 3.22Å; Q696-L725 WeakPolarHBondContact CA-O 3.2Å; G697-L725 PolarHBondContact N-O 3.49Å; G697-L725 VanDerWaalsContact N-O 3.09Å; G697-L725 PolarHBondContact O-N 2.95Å; F699-L725 HydrophobicContact CB-CD1 4.45Å; F699-L725 HydrophobicContact CD2-CB 3.99Å; F699-L725 HydrophobicContact CD2-CD1 4.14Å; F699-L725 HydrophobicContact CD2-CD2 4.07Å; F699-L725 HydrophobicContact CD2-CG 4.28Å; F699-L725 HydrophobicContact CE2-CB 4.17Å; V701-L725 HydrophobicContact CG2-CD1 4.09Å; R723-L725 HydrophobicContact CB-CD1 3.52Å; L725-V732 HydrophobicContact CD2-CG1 4.5Å; L725-M733 CarbonylContact C-O 3.6Å; L725-M733 WeakPolarHBondContact CA-O 3.48Å; L725-F734 HydrophobicContact CD1-CD1 3.59Å; L725-F734 HydrophobicContact CD1-CE1 3.86Å; L725-F734 HydrophobicContact CD1-CG 4.33Å; L725-F734 HydrophobicContact CD2-CD1 4.38Å; L725-F734 HydrophobicContact CD2-CE1 3.85Å; L725-F734 HydrophobicContact CD2-CZ 4.15Å; L725-F734 HydrophobicContact CG-CD1 3.87Å; L725-F734 HydrophobicContact CG-CE1 3.85Å; L725-F734 HydrophobicContact CG-CG 4.35Å; L725-F734 HydrophobicContact CG-CZ 4.31Å; L725-I777 HydrophobicContact CD2-CD1 4.4Å; L725-V788 HydrophobicContact CD2-CG1 4.29Å; L725-V788 HydrophobicContact CD2-CG2 4.36Å; L725-W799 HydrophobicContact CB-CH2 3.57Å; L725-W799 HydrophobicContact CB-CZ2 4.49Å; L725-W799 HydrophobicContact CB-CZ3 3.87Å; L725-W799 HydrophobicContact CD2-CZ3 4.14Å
726	F	96.1	Very high	84.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	117.6	171.5	-60.5	-91.7	0	0	0	108	H676 I680 M693 Q696 H724 Y728 V732 M733 C735 Y751	H676-F726 HydrophobicContact CB-CE1 3.72Å; H676-F726 HydrophobicContact CB-CZ 4.29Å; I680-F726 HydrophobicContact CD1-CD1 4.09Å; I680-F726 HydrophobicContact CD1-CD2 3.86Å; I680-F726 HydrophobicContact CD1-CE1 3.85Å; I680-F726 HydrophobicContact CD1-CE2 3.63Å; I680-F726 HydrophobicContact CD1-CG 4.07Å; I680-F726 HydrophobicContact CD1-CZ 3.61Å; I680-F726 HydrophobicContact CG1-CD2 4.42Å; I680-F726 HydrophobicContact CG1-CE1 4.22Å; I680-F726 HydrophobicContact CG1-CE2 3.71Å; I680-F726 HydrophobicContact CG1-CZ 3.57Å; M693-F726 HydrophobicContact CE-CB 4.48Å; M693-F726 HydrophobicContact CE-CD1 3.42Å; M693-F726 VanDerWaalsContact CE-CD1 3.42Å; M693-F726 HydrophobicContact CE-CE1 3.97Å; M693-F726 HydrophobicContact CE-CG 4.34Å; M693-F726 HydrophobicContact SD-CD1 3.77Å; M693-F726 HydrophobicContact SD-CE1 4.43Å; Q696-F726 HydrophobicContact CB-CD1 3.64Å; Q696-F726 HydrophobicContact CB-CE1 4.03Å; Q696-F726 HydrophobicContact CB-CG 4.4Å; Q696-F726 HydrophobicContact CG-CD1 4.41Å; Q696-F726 HydrophobicContact CG-CE1 4.48Å; H724-F726 AromaticContact CD2-CE2 3.76Å; H724-F726 AromaticContact CD2-CZ 3.58Å; F726-Y728 HydrophobicContact CB-CD2 4.26Å; F726-Y728 HydrophobicContact CB-CE2 3.59Å; F726-V732 WeakPolarHBondContact O-CA 3.35Å; F726-M733 HydrophobicContact CB-CB 4.25Å; F726-M733 PolarHBondContact N-O 2.97Å; F726-M733 PolarHBondContact O-N 3.22Å; F726-C735 HydrophobicContact CE2-CB 4.04Å; F726-Y751 HydrophobicContact CE2-CD2 4.47Å; F726-Y751 HydrophobicContact CE2-CG 4.34Å; F726-Y751 AromaticContact CZ-CD2 3.82Å; F726-Y751 HydrophobicContact CZ-CD2 3.82Å; F726-Y751 AromaticContact CZ-CE2 3.97Å; F726-Y751 HydrophobicContact CZ-CE2 3.97Å; F726-Y751 HydrophobicContact CZ-CG 4.14Å
727	L	96.2	Very high	87	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.7	175.6	178	65.6	0	0	0	108.6	V694 L695 V732 M759 W799 E802 I803 I806	V694-L727 HydrophobicContact CB-CD2 4.29Å; V694-L727 HydrophobicContact CB-CG 4.27Å; V694-L727 HydrophobicContact CG1-CD2 4.45Å; V694-L727 PolarHBondContact N-O 3.47Å; L695-L727 HydrophobicContact CB-CB 4.21Å; L695-L727 HydrophobicContact CB-CD2 4.35Å; L695-L727 HydrophobicContact CD1-CD2 4.14Å; L695-L727 HydrophobicContact CG-CD2 4.4Å; L695-L727 PolarHBondContact N-O 3.39Å; L695-L727 PolarHBondContact O-N 2.73Å; L727-V732 HydrophobicContact CD1-CG2 3.89Å; L727-M759 HydrophobicContact CD1-SD 4.08Å; L727-W799 HydrophobicContact CB-CH2 3.97Å; L727-W799 HydrophobicContact CB-CZ3 3.96Å; L727-E802 HydrophobicContact CD2-CB 4.23Å; L727-I803 HydrophobicContact CD1-CG1 3.9Å; L727-I803 HydrophobicContact CD2-CG1 3.78Å; L727-I806 HydrophobicContact CD1-CD1 3.82Å; L727-I806 HydrophobicContact CD2-CD1 3.96Å; L727-I806 HydrophobicContact CG-CD1 3.85Å
728	Y	95.1	Very high	88.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	161.7	169.9	-56.4	-95.4	0	0	0	110	I680 I687 L690 K692 M693 F726 K730 A731 M733	I680-Y728 WeakPolarHBondContact CD1-OH 3.34Å; I687-Y728 HydrophobicContact CG2-CE1 3.85Å; I687-Y728 WeakPolarHBondContact CG2-OH 3.48Å; L690-Y728 HydrophobicContact CB-CD1 4.13Å; L690-Y728 HydrophobicContact CB-CD2 4.25Å; L690-Y728 HydrophobicContact CB-CG 3.86Å; L690-Y728 HydrophobicContact CD1-CD2 3.95Å; L690-Y728 HydrophobicContact CD1-CE2 3.94Å; L690-Y728 HydrophobicContact CD1-CG 4.37Å; L690-Y728 WeakPolarHBondContact O-CB 3.48Å; K692-Y728 WeakPolarHBondContact O-CA 3.31Å; M693-Y728 HydrophobicContact CB-CD1 3.94Å; M693-Y728 HydrophobicContact CB-CE1 3.9Å; M693-Y728 HydrophobicContact CE-CE1 3.81Å; M693-Y728 WeakPolarHBondContact CE-OH 3.5Å; M693-Y728 HydrophobicContact CG-CD1 4.42Å; M693-Y728 HydrophobicContact CG-CE1 4.27Å; F726-Y728 HydrophobicContact CB-CD2 4.26Å; F726-Y728 HydrophobicContact CB-CE2 3.59Å; Y728-K730 PolarHBondContact O-N 3.38Å; Y728-K730 VanDerWaalsContact O-N 3.09Å; Y728-A731 WeakPolarHBondContact CA-O 3.45Å; Y728-A731 PolarHBondContact N-O 3.46Å; Y728-A731 PolarHBondContact O-N 3.31Å; Y728-M733 HydrophobicContact CE2-CB 4.1Å; Y728-M733 HydrophobicContact CE2-CE 4.42Å
729	E	93.3	Very high	89.4	Confident	84 Å²	84	48.5 Å²	48.5	39%	0.393	22%	0.215	S	C	.	.	S	Bend	trans	-55.4	-26.5	178.8	-67.5	166.3	154.9	0	0	114.3	K692 V694 I806 Q810	K692-E729 VanDerWaalsContact CB-CD 3.46Å; K692-E729 HydrophobicContact CB-CG 4.2Å; K692-E729 WeakPolarHBondContact CB-OE1 3.48Å; K692-E729 WeakPolarHBondContact CB-OE2 3.46Å; K692-E729 PolarHBondContact N-OE2 2.86Å; K692-E729 PolarHBondContact O-N 3.04Å; V694-E729 HydrophobicContact CG2-CG 4.02Å; E729-I806 WeakPolarHBondContact O-CG2 3.49Å; E729-Q810 PolarHBondContact O-NE2 3.32Å
730	K	94.1	Very high	89.3	Confident	120 Å²	120	49.1 Å²	49.1	52%	0.522	22%	0.22	S	C	.	.	S	Bend	trans	-115.4	-8.2	178.6	-50.2	-177.9	-158.3	160.5	0	114.8	E689 L690 Y728 M759	E689-K730 WeakPolarHBondContact O-CD 3.4Å; E689-K730 WeakPolarHBondContact O-CE 3.34Å; E689-K730 PolarHBondContact O-NZ 3.36Å; L690-K730 VanDerWaalsContact O-CB 3.31Å; L690-K730 WeakPolarHBondContact O-CB 3.14Å; L690-K730 WeakPolarHBondContact O-CG 3.34Å; L690-K730 PolarHBondContact O-N 3.18Å; Y728-K730 PolarHBondContact O-N 3.38Å; Y728-K730 VanDerWaalsContact O-N 3.09Å; K730-M759 PolarHBondContact O-N 3.03Å
731	A	95.3	Very high	88	Confident	3 Å²	3	54 Å²	54	3%	0.025	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	151.1	-177.8	0	0	0	0	0	115.5	L690 Y728 L757	L690-A731 HydrophobicContact CD2-CB 3.99Å; Y728-A731 WeakPolarHBondContact CA-O 3.45Å; Y728-A731 PolarHBondContact N-O 3.46Å; Y728-A731 PolarHBondContact O-N 3.31Å; A731-L757 CarbonylContact C-O 3.56Å; A731-L757 WeakPolarHBondContact CA-O 3.34Å; A731-L757 WeakPolarHBondContact CB-O 3.42Å
732	V	95.9	Very high	86.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	110.2	164	-167.5	0	0	0	0	109.1	L725 F726 L727 F734 C756 L757 M759 V762 I777	L725-V732 HydrophobicContact CD2-CG1 4.5Å; F726-V732 WeakPolarHBondContact O-CA 3.35Å; L727-V732 HydrophobicContact CD1-CG2 3.89Å; V732-F734 HydrophobicContact CB-CE2 4.12Å; V732-F734 HydrophobicContact CG1-CD2 4.31Å; V732-F734 HydrophobicContact CG1-CE2 3.68Å; V732-F734 HydrophobicContact CG1-CZ 4.17Å; V732-C756 WeakPolarHBondContact O-CA 3.4Å; V732-L757 HydrophobicContact CB-CB 4.45Å; V732-L757 PolarHBondContact N-O 2.97Å; V732-L757 PolarHBondContact O-N 3.1Å; V732-M759 HydrophobicContact CG2-SD 3.57Å; V732-M759 VanDerWaalsContact CG2-SD 3.57Å; V732-V762 HydrophobicContact CG2-CG2 4.37Å; V732-I777 HydrophobicContact CG1-CD1 4.43Å
733	M	95.5	Very high	84.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	134.8	176	-176	-177.5	-65.4	0	0	111.1	I680 Y683 L690 L725 F726 Y728 F753	I680-M733 HydrophobicContact CD1-SD 4.01Å; I680-M733 HydrophobicContact CG2-SD 3.89Å; Y683-M733 HydrophobicContact CD1-CE 4.23Å; Y683-M733 HydrophobicContact CD2-CE 3.64Å; Y683-M733 HydrophobicContact CE1-CE 4.24Å; Y683-M733 HydrophobicContact CE2-CE 3.68Å; Y683-M733 HydrophobicContact CG-CE 3.93Å; L690-M733 HydrophobicContact CD1-CE 3.59Å; L725-M733 CarbonylContact C-O 3.6Å; L725-M733 WeakPolarHBondContact CA-O 3.48Å; F726-M733 HydrophobicContact CB-CB 4.25Å; F726-M733 PolarHBondContact N-O 2.97Å; F726-M733 PolarHBondContact O-N 3.22Å; Y728-M733 HydrophobicContact CE2-CB 4.1Å; Y728-M733 HydrophobicContact CE2-CE 4.42Å; M733-F753 HydrophobicContact CE-CD2 4.37Å; M733-F753 HydrophobicContact CE-CE2 4.37Å; M733-F753 HydrophobicContact CG-CD2 3.78Å; M733-F753 HydrophobicContact CG-CE2 3.87Å; M733-F753 HydrophobicContact SD-CD2 3.84Å; M733-F753 HydrophobicContact SD-CE2 4.28Å
734	F	95.2	Very high	82.1	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.5	178.1	-68.1	-108.9	0	0	0	109.6	V701 R723 L725 V732 K754 H755 L757 I777 Y786	V701-F734 HydrophobicContact CG1-CE1 4.22Å; R723-F734 HydrophobicContact CG-CD1 4.43Å; L725-F734 HydrophobicContact CD1-CD1 3.59Å; L725-F734 HydrophobicContact CD1-CE1 3.86Å; L725-F734 HydrophobicContact CD1-CG 4.33Å; L725-F734 HydrophobicContact CD2-CD1 4.38Å; L725-F734 HydrophobicContact CD2-CE1 3.85Å; L725-F734 HydrophobicContact CD2-CZ 4.15Å; L725-F734 HydrophobicContact CG-CD1 3.87Å; L725-F734 HydrophobicContact CG-CE1 3.85Å; L725-F734 HydrophobicContact CG-CG 4.35Å; L725-F734 HydrophobicContact CG-CZ 4.31Å; V732-F734 HydrophobicContact CB-CE2 4.12Å; V732-F734 HydrophobicContact CG1-CD2 4.31Å; V732-F734 HydrophobicContact CG1-CE2 3.68Å; V732-F734 HydrophobicContact CG1-CZ 4.17Å; F734-K754 WeakPolarHBondContact O-CA 3.4Å; F734-K754 WeakPolarHBondContact O-CB 3.47Å; F734-K754 PolarHBondContact O-N 3.16Å; F734-H755 HydrophobicContact CB-CB 4.19Å; F734-H755 PolarHBondContact N-O 3.26Å; F734-H755 PolarHBondContact O-N 3.28Å; F734-L757 HydrophobicContact CD2-CG 4.44Å; F734-L757 HydrophobicContact CE2-CD1 3.63Å; F734-L757 HydrophobicContact CE2-CG 3.82Å; F734-L757 HydrophobicContact CZ-CD1 4.07Å; F734-I777 HydrophobicContact CZ-CD1 4.44Å; F734-Y786 HydrophobicContact CD1-CD1 4.47Å; F734-Y786 AromaticContact CE1-CD1 3.82Å; F734-Y786 HydrophobicContact CE1-CD1 3.82Å; F734-Y786 HydrophobicContact CE1-CE1 4.44Å; F734-Y786 HydrophobicContact CE1-CG 4.35Å; F734-Y786 AromaticContact CZ-CD1 3.97Å; F734-Y786 HydrophobicContact CZ-CD1 3.97Å; F734-Y786 HydrophobicContact CZ-CG 4.15Å
735	C	94.7	Very high	79.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	155.7	178	-64.7	0	0	0	0	111.5	R723 H724 F726 S752	R723-C735 CarbonylContact C-O 3.57Å; R723-C735 VanDerWaalsContact CA-O 3.3Å; R723-C735 WeakPolarHBondContact CA-O 3.43Å; R723-C735 WeakPolarHBondContact CD-O 3.47Å; H724-C735 PolarHBondContact N-O 3.36Å; H724-C735 PolarHBondContact O-N 3.4Å; F726-C735 HydrophobicContact CE2-CB 4.04Å; C735-S752 CarbonylContact C-O 3.54Å; C735-S752 VanDerWaalsContact CA-O 3.29Å; C735-S752 WeakPolarHBondContact CA-O 3.42Å
736	K	92.7	Very high	77.7	Confident	99 Å²	99	62.2 Å²	62.2	43%	0.43	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	120.9	166.7	-174.3	-171.1	174.1	-177.1	0	108.4	R738 S752 K754	K736-R738 PolarHBondContact O-N 2.96Å; K736-S752 PolarHBondContact N-O 2.9Å; K736-S752 PolarHBondContact O-N 3.04Å; K736-K754 HydrophobicContact CB-CG 4.13Å
737	R	87.7	Confident	76.1	Confident	66 Å²	66	69.9 Å²	69.9	25%	0.249	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	135.4	168.7	179.4	169.1	169.5	159	-7	109.2	F739 D746 S750 Y751	R737-F739 HydrophobicContact CG-CE2 4.32Å; R737-F739 HydrophobicContact CG-CZ 4.3Å; R737-D746 IonicContact NH2-OD1 3.9Å; R737-D746 PolarHBondContact NH2-OD1 2.79Å; R737-D746 VanDerWaalsContact NH2-OD1 3.14Å; R737-S750 CarbonylContact C-O 3.57Å; R737-S750 WeakPolarHBondContact CA-O 3.42Å; R737-Y751 HydrophobicContact CB-CD1 4.09Å; R737-Y751 HydrophobicContact CB-CE1 4.15Å; R737-Y751 HydrophobicContact CG-CE1 4.43Å
738	R	82.9	Confident	74.8	Confident	116 Å²	116	73.9 Å²	73.9	44%	0.438	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	148.3	169.2	-63.6	-62.1	-173	143.6	11.6	108.9	K736 S750 S752	K736-R738 PolarHBondContact O-N 2.96Å; R738-S750 PolarHBondContact N-O 3.13Å; R738-S752 PolarHBondContact NE-OG 3.16Å; R738-S752 PolarHBondContact NH2-OG 2.98Å; R738-S752 VanDerWaalsContact NH2-OG 3.15Å
739	F	68.2	Low	73.7	Confident	127 Å²	127	75.6 Å²	75.6	56%	0.557	38%	0.379	S	S	*	.			trans	-118.4	125.2	160.6	-57.9	-90.3	0	0	0	103.8	R737	R737-F739 HydrophobicContact CG-CE2 4.32Å; R737-F739 HydrophobicContact CG-CZ 4.3Å
740	E	56.3	Low	73.4	Confident	124 Å²	124	72.4 Å²	72.4	58%	0.579	37%	0.367	S	S	*	.			trans	-96.9	141	177.4	-70.8	162.7	-156.8	0	0	107.6	G742 A745 S750	E740-G742 PolarHBondContact O-N 2.71Å; E740-A745 HydrophobicContact CB-CB 4.01Å; E740-A745 WeakPolarHBondContact O-CB 3.12Å; E740-S750 PolarHBondContact OE1-OG 3.4Å
741	S	45.7	Very low	73.3	Confident	142 Å²	142	66.8 Å²	66.8	99%	0.993	34%	0.342	S	S	*	.	S	Bend	trans	-79.4	29.2	-168.9	-48	0	0	0	0	114.4
742	G	54.6	Low	73.1	Confident	46 Å²	46	67.3 Å²	67.3	47%	0.474	35%	0.346	S	S	.	.	S	Bend	trans	-113.1	156.8	-173.5	0	0	0	0	0	114	E740 G744 A745	E740-G742 PolarHBondContact O-N 2.71Å; G742-G744 PolarHBondContact O-N 3.29Å; G742-G744 VanDerWaalsContact O-N 3.08Å; G742-A745 VanDerWaalsContact O-CB 3.29Å; G742-A745 WeakPolarHBondContact O-CB 3.46Å; G742-A745 PolarHBondContact O-N 2.87Å; G742-A745 VanDerWaalsContact O-N 3.07Å
743	E	43.7	Very low	73	Confident	201 Å²	201	69.5 Å²	69.5	94%	0.939	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	113.7	-177.9	-70.3	-163.1	131.2	0	0	113
744	G	49.4	Very low	72.9	Confident	31 Å²	31	74.4 Å²	74.4	32%	0.32	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	12.3	178.5	0	0	0	0	0	115.5	G742 D746 R747	G742-G744 PolarHBondContact O-N 3.29Å; G742-G744 VanDerWaalsContact O-N 3.08Å; G744-D746 PolarHBondContact O-N 3.36Å; G744-R747 PolarHBondContact O-N 3.28Å
745	A	48.5	Very low	72.6	Confident	32 Å²	32	76.7 Å²	76.7	26%	0.264	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-59.9	-23.9	173.5	0	0	0	0	0	114.2	E740 G742 R747	E740-A745 HydrophobicContact CB-CB 4.01Å; E740-A745 WeakPolarHBondContact O-CB 3.12Å; G742-A745 VanDerWaalsContact O-CB 3.29Å; G742-A745 WeakPolarHBondContact O-CB 3.46Å; G742-A745 PolarHBondContact O-N 2.87Å; G742-A745 VanDerWaalsContact O-N 3.07Å; A745-R747 VanDerWaalsContact C-N 3.27Å; A745-R747 PolarHBondContact O-N 3.01Å
746	D	51.4	Low	72.5	Confident	112 Å²	112	78.1 Å²	78.1	60%	0.599	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-73.7	-15.9	178.8	-164.7	41.5	0	0	0	113.7	R737 G744 Y748	R737-D746 IonicContact NH2-OD1 3.9Å; R737-D746 PolarHBondContact NH2-OD1 2.79Å; R737-D746 VanDerWaalsContact NH2-OD1 3.14Å; G744-D746 PolarHBondContact O-N 3.36Å; D746-Y748 VanDerWaalsContact C-N 3.34Å; D746-Y748 PolarHBondContact O-N 3.48Å
747	R	61.2	Low	72.5	Confident	161 Å²	161	73.4 Å²	73.4	61%	0.608	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-74.2	-19	-177.9	-59.6	-157.3	-158.4	167.5	0.8	114.3	E598 G744 A745	E598-R747 IonicContact OE1-NH1 2.78Å; E598-R747 PolarHBondContact OE1-NH1 2.89Å; G744-R747 PolarHBondContact O-N 3.28Å; A745-R747 VanDerWaalsContact C-N 3.27Å; A745-R747 PolarHBondContact O-N 3.01Å
748	Y	68.9	Low	72.7	Confident	83 Å²	83	74.1 Å²	74.1	33%	0.325	38%	0.381	S	S	.	.	S	Bend	trans	-136.3	126.5	-178.9	-59.9	-59	0	0	0	110.5	P595 E598 D746	P595-Y748 HydrophobicContact CB-CD1 3.93Å; P595-Y748 HydrophobicContact CB-CD2 3.84Å; P595-Y748 HydrophobicContact CB-CE1 3.87Å; P595-Y748 HydrophobicContact CB-CE2 3.75Å; P595-Y748 HydrophobicContact CB-CG 3.94Å; P595-Y748 HydrophobicContact CG-CD1 3.77Å; P595-Y748 HydrophobicContact CG-CE1 3.68Å; P595-Y748 HydrophobicContact CG-CE2 4.47Å; P595-Y748 HydrophobicContact CG-CG 4.25Å; E598-Y748 HydrophobicContact CB-CE2 4.27Å; E598-Y748 WeakPolarHBondContact CB-OH 3.45Å; E598-Y748 HydrophobicContact CG-CE2 4.09Å; E598-Y748 WeakPolarHBondContact CG-OH 3.35Å; D746-Y748 VanDerWaalsContact C-N 3.34Å; D746-Y748 PolarHBondContact O-N 3.48Å
749	P	73.6	Confident	73.2	Confident	36 Å²	36	68.6 Å²	68.6	23%	0.234	36%	0.36	C	S	.	.			trans	-72.5	145.9	-178.5	31.3	-35.1	0	0	0	111.3	A679 Y751	A679-P749 WeakPolarHBondContact CB-O 3.27Å; P749-Y751 HydrophobicContact CB-CE1 4.33Å; P749-Y751 HydrophobicContact CB-CE2 3.7Å; P749-Y751 HydrophobicContact CG-CE2 3.94Å
750	S	85.5	Confident	74.2	Confident	18 Å²	18	69.1 Å²	69.1	13%	0.126	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.9	170.9	171.3	0	0	0	0	107.8	N681 R737 R738 E740	N681-S750 PolarHBondContact ND2-OG 3.1Å; R737-S750 CarbonylContact C-O 3.57Å; R737-S750 WeakPolarHBondContact CA-O 3.42Å; R738-S750 PolarHBondContact N-O 3.13Å; E740-S750 PolarHBondContact OE1-OG 3.4Å
751	Y	91.7	Very high	75.8	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.008	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	115.2	-172.6	-59.7	-73.6	0	0	0	111.4	H676 A679 N681 H724 F726 R737 P749	H676-Y751 HydrophobicContact CB-CE2 4.08Å; H676-Y751 AromaticContact ND1-CE2 3.84Å; H676-Y751 AromaticContact ND1-CZ 3.79Å; H676-Y751 PolarHBondContact ND1-OH 2.91Å; A679-Y751 HydrophobicContact CB-CD2 3.67Å; A679-Y751 HydrophobicContact CB-CE2 4Å; A679-Y751 WeakPolarHBondContact O-CB 3.47Å; A679-Y751 PolarHBondContact O-N 3.42Å; N681-Y751 PolarHBondContact N-O 3.17Å; H724-Y751 HydrophobicContact CB-CD1 3.73Å; H724-Y751 HydrophobicContact CB-CE1 3.48Å; H724-Y751 VanDerWaalsContact CB-CE1 3.48Å; H724-Y751 AromaticContact CD2-CD1 3.93Å; H724-Y751 AromaticContact CD2-CE1 3.23Å; H724-Y751 WeakPolarHBondContact CD2-CE1 3.49Å; H724-Y751 AromaticContact CD2-CZ 3.35Å; H724-Y751 PolarHBondContact CD2-OH 3.15Å; H724-Y751 AromaticContact CE1-CZ 3.97Å; H724-Y751 PolarHBondContact CE1-OH 2.98Å; H724-Y751 VanDerWaalsContact CE1-OH 3.23Å; H724-Y751 AromaticContact CG-CD1 3.95Å; H724-Y751 AromaticContact CG-CE1 3.23Å; H724-Y751 AromaticContact CG-CZ 3.8Å; H724-Y751 AromaticContact ND1-CE1 3.78Å; H724-Y751 AromaticContact NE2-CE1 3.75Å; H724-Y751 AromaticContact NE2-CZ 3.43Å; H724-Y751 PolarHBondContact NE2-OH 3.2Å; F726-Y751 HydrophobicContact CE2-CD2 4.47Å; F726-Y751 HydrophobicContact CE2-CG 4.34Å; F726-Y751 AromaticContact CZ-CD2 3.82Å; F726-Y751 HydrophobicContact CZ-CD2 3.82Å; F726-Y751 AromaticContact CZ-CE2 3.97Å; F726-Y751 HydrophobicContact CZ-CE2 3.97Å; F726-Y751 HydrophobicContact CZ-CG 4.14Å; R737-Y751 HydrophobicContact CB-CD1 4.09Å; R737-Y751 HydrophobicContact CB-CE1 4.15Å; R737-Y751 HydrophobicContact CG-CE1 4.43Å; P749-Y751 HydrophobicContact CB-CE1 4.33Å; P749-Y751 HydrophobicContact CB-CE2 3.7Å; P749-Y751 HydrophobicContact CG-CE2 3.94Å
752	S	91.9	Very high	78.1	Confident	14 Å²	14	58.2 Å²	58.2	10%	0.098	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124.6	168.2	-64.6	0	0	0	0	110.8	C735 K736 R738	C735-S752 CarbonylContact C-O 3.54Å; C735-S752 VanDerWaalsContact CA-O 3.29Å; C735-S752 WeakPolarHBondContact CA-O 3.42Å; K736-S752 PolarHBondContact N-O 2.9Å; K736-S752 PolarHBondContact O-N 3.04Å; R738-S752 PolarHBondContact NE-OG 3.16Å; R738-S752 PolarHBondContact NH2-OG 2.98Å; R738-S752 VanDerWaalsContact NH2-OG 3.15Å
753	F	94.4	Very high	79.8	Confident	46 Å²	46	57.2 Å²	57.2	20%	0.202	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.2	143.7	168.8	176.3	-111.9	0	0	0	112.3	N681 A682 Y683 M733 H755 C756	N681-F753 PolarHBondContact O-N 2.9Å; A682-F753 WeakPolarHBondContact O-CD1 3.32Å; Y683-F753 HydrophobicContact CD2-CD1 4.23Å; Y683-F753 AromaticContact CD2-CD2 3.73Å; Y683-F753 HydrophobicContact CD2-CD2 3.73Å; Y683-F753 HydrophobicContact CD2-CE1 4.13Å; Y683-F753 AromaticContact CD2-CE2 3.61Å; Y683-F753 HydrophobicContact CD2-CE2 3.61Å; Y683-F753 HydrophobicContact CD2-CG 4.04Å; Y683-F753 AromaticContact CD2-CZ 3.83Å; Y683-F753 HydrophobicContact CD2-CZ 3.83Å; Y683-F753 HydrophobicContact CE2-CE2 4.05Å; Y683-F753 HydrophobicContact CE2-CZ 4.15Å; M733-F753 HydrophobicContact CE-CD2 4.37Å; M733-F753 HydrophobicContact CE-CE2 4.37Å; M733-F753 HydrophobicContact CG-CD2 3.78Å; M733-F753 HydrophobicContact CG-CE2 3.87Å; M733-F753 HydrophobicContact SD-CD2 3.84Å; M733-F753 HydrophobicContact SD-CE2 4.28Å; F753-H755 VanDerWaalsContact CE2-C 3.41Å; F753-H755 WeakPolarHBondContact CE2-O 3.47Å; F753-C756 HydrophobicContact CE2-CB 3.96Å; F753-C756 HydrophobicContact CZ-CB 4.1Å
754	K	92.4	Very high	82.2	Confident	103 Å²	103	49.4 Å²	49.4	45%	0.448	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	-43.4	176.8	-67.6	-72.7	140.1	-106	0	113	F734 K736	F734-K754 WeakPolarHBondContact O-CA 3.4Å; F734-K754 WeakPolarHBondContact O-CB 3.47Å; F734-K754 PolarHBondContact O-N 3.16Å; K736-K754 HydrophobicContact CB-CG 4.13Å
755	H	89.1	Confident	84.2	Confident	51 Å²	51	49.8 Å²	49.8	24%	0.236	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	161.5	178.6	-152.1	49.6	0	0	0	112.6	F734 F753 L757 Y786	F734-H755 HydrophobicContact CB-CB 4.19Å; F734-H755 PolarHBondContact N-O 3.26Å; F734-H755 PolarHBondContact O-N 3.28Å; F753-H755 VanDerWaalsContact CE2-C 3.41Å; F753-H755 WeakPolarHBondContact CE2-O 3.47Å; H755-L757 VanDerWaalsContact CD2-CD2 3.41Å; H755-L757 WeakPolarHBondContact CD2-CD2 3.35Å; H755-Y786 PolarHBondContact CD2-OH 3.37Å
756	C	92.4	Very high	86.2	Confident	31 Å²	31	50.5 Å²	50.5	21%	0.209	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	125.6	173.5	-153	0	0	0	0	108.2	V732 F753	V732-C756 WeakPolarHBondContact O-CA 3.4Å; F753-C756 HydrophobicContact CE2-CB 3.96Å; F753-C756 HydrophobicContact CZ-CB 4.1Å
757	L	93.3	Very high	87.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.1	172.8	-55.5	-177.5	0	0	0	107.5	A731 V732 F734 H755 V762 I777 Y779 Y786	A731-L757 CarbonylContact C-O 3.56Å; A731-L757 WeakPolarHBondContact CA-O 3.34Å; A731-L757 WeakPolarHBondContact CB-O 3.42Å; V732-L757 HydrophobicContact CB-CB 4.45Å; V732-L757 PolarHBondContact N-O 2.97Å; V732-L757 PolarHBondContact O-N 3.1Å; F734-L757 HydrophobicContact CD2-CG 4.44Å; F734-L757 HydrophobicContact CE2-CD1 3.63Å; F734-L757 HydrophobicContact CE2-CG 3.82Å; F734-L757 HydrophobicContact CZ-CD1 4.07Å; H755-L757 VanDerWaalsContact CD2-CD2 3.41Å; H755-L757 WeakPolarHBondContact CD2-CD2 3.35Å; L757-V762 HydrophobicContact CB-CG2 4.01Å; L757-I777 HydrophobicContact CD1-CG2 3.91Å; L757-Y779 HydrophobicContact CB-CD2 3.76Å; L757-Y779 HydrophobicContact CB-CE2 3.73Å; L757-Y779 HydrophobicContact CD1-CD2 4.32Å; L757-Y779 HydrophobicContact CD2-CD1 4.01Å; L757-Y779 HydrophobicContact CD2-CD2 3.68Å; L757-Y779 HydrophobicContact CD2-CE1 4.3Å; L757-Y779 HydrophobicContact CD2-CE2 3.96Å; L757-Y779 HydrophobicContact CD2-CG 3.69Å; L757-Y779 HydrophobicContact CG-CD2 4.11Å; L757-Y779 HydrophobicContact CG-CE2 4.4Å; L757-Y786 HydrophobicContact CD1-CD2 3.93Å; L757-Y786 HydrophobicContact CD1-CE2 3.97Å; L757-Y786 HydrophobicContact CD2-CE2 4.03Å
758	K	92.6	Very high	89	Confident	80 Å²	80	45.9 Å²	45.9	35%	0.348	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	143.9	170	-50.6	-177.7	-154.2	143.5	0	110.1	E760 D761 V762 E781	K758-E760 VanDerWaalsContact C-N 3.3Å; K758-E760 HydrophobicContact CB-CG 3.87Å; K758-E760 HydrophobicContact CD-CG 3.85Å; K758-E760 WeakPolarHBondContact CD-OE1 3.46Å; K758-E760 WeakPolarHBondContact CE-OE1 3.4Å; K758-E760 IonicContact NZ-OE1 2.68Å; K758-E760 PolarHBondContact NZ-OE1 2.78Å; K758-E760 PolarHBondContact O-N 2.81Å; K758-D761 IonicContact NZ-OD2 2.75Å; K758-D761 PolarHBondContact O-N 2.98Å; K758-V762 WeakPolarHBondContact O-CG2 3.13Å; K758-E781 IonicContact NZ-OE1 2.79Å; K758-E781 PolarHBondContact NZ-OE1 3.26Å
759	M	93.1	Very high	89.4	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-70	-25.5	179.2	-79.7	-60.1	-55.1	0	0	113.5	L727 K730 V732 D761 V762 I803 I806 L807 Q810	L727-M759 HydrophobicContact CD1-SD 4.08Å; K730-M759 PolarHBondContact O-N 3.03Å; V732-M759 HydrophobicContact CG2-SD 3.57Å; V732-M759 VanDerWaalsContact CG2-SD 3.57Å; M759-D761 PolarHBondContact O-N 2.94Å; M759-V762 HydrophobicContact CE-CB 4.21Å; M759-V762 HydrophobicContact CE-CG1 4.02Å; M759-V762 PolarHBondContact O-N 2.89Å; M759-V762 VanDerWaalsContact O-N 3.12Å; M759-V762 HydrophobicContact SD-CB 4.04Å; M759-V762 HydrophobicContact SD-CG1 4.04Å; M759-V762 HydrophobicContact SD-CG2 4.18Å; M759-I803 HydrophobicContact CE-CG2 4.22Å; M759-I806 HydrophobicContact CB-CG2 4.33Å; M759-I806 HydrophobicContact CE-CB 4.09Å; M759-I806 HydrophobicContact CE-CG2 3.74Å; M759-I806 HydrophobicContact CG-CG2 4.14Å; M759-L807 HydrophobicContact CE-CD1 4.46Å; M759-L807 HydrophobicContact CE-CD2 3.57Å; M759-L807 HydrophobicContact CE-CG 3.68Å; M759-L807 WeakPolarHBondContact O-CD2 3.36Å; M759-Q810 VanDerWaalsContact C-OE1 3.31Å; M759-Q810 PolarHBondContact O-OE1 3.21Å
760	E	89.3	Confident	89.5	Confident	138 Å²	138	54.5 Å²	54.5	65%	0.645	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-59.9	-25.9	175.1	66.3	-163.6	-159	0	0	112.9	K758	K758-E760 VanDerWaalsContact C-N 3.3Å; K758-E760 HydrophobicContact CB-CG 3.87Å; K758-E760 HydrophobicContact CD-CG 3.85Å; K758-E760 WeakPolarHBondContact CD-OE1 3.46Å; K758-E760 WeakPolarHBondContact CE-OE1 3.4Å; K758-E760 IonicContact NZ-OE1 2.68Å; K758-E760 PolarHBondContact NZ-OE1 2.78Å; K758-E760 PolarHBondContact O-N 2.81Å
761	D	89.6	Confident	89.3	Confident	28 Å²	28	54.9 Å²	54.9	15%	0.15	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-105.8	7	179.7	-80.7	-72.2	0	0	0	114.1	K758 M759 Y779 S780 E781	K758-D761 IonicContact NZ-OD2 2.75Å; K758-D761 PolarHBondContact O-N 2.98Å; M759-D761 PolarHBondContact O-N 2.94Å; D761-Y779 HydrophobicContact CB-CD2 3.69Å; D761-Y779 HydrophobicContact CB-CE2 3.36Å; D761-Y779 WeakPolarHBondContact O-CA 3.24Å; D761-S780 WeakPolarHBondContact CA-OG 3.41Å; D761-S780 WeakPolarHBondContact CB-OG 3.45Å; D761-S780 PolarHBondContact O-N 3.48Å; D761-S780 PolarHBondContact O-OG 2.91Å; D761-S780 VanDerWaalsContact O-OG 3.08Å; D761-S780 WeakPolarHBondContact OD1-CB 3.44Å; D761-S780 PolarHBondContact OD1-OG 3.48Å; D761-E781 HydrophobicContact CB-CG 4.35Å; D761-E781 WeakPolarHBondContact OD2-CG 3.39Å
762	V	92.8	Very high	89.2	Confident	10 Å²	10	61 Å²	61	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	114.1	-176	162	0	0	0	0	112	V732 L757 K758 M759 I764 I777 R778 Y779 I803 L807	V732-V762 HydrophobicContact CG2-CG2 4.37Å; L757-V762 HydrophobicContact CB-CG2 4.01Å; K758-V762 WeakPolarHBondContact O-CG2 3.13Å; M759-V762 HydrophobicContact CE-CB 4.21Å; M759-V762 HydrophobicContact CE-CG1 4.02Å; M759-V762 PolarHBondContact O-N 2.89Å; M759-V762 VanDerWaalsContact O-N 3.12Å; M759-V762 HydrophobicContact SD-CB 4.04Å; M759-V762 HydrophobicContact SD-CG1 4.04Å; M759-V762 HydrophobicContact SD-CG2 4.18Å; V762-I764 HydrophobicContact CG1-CG2 4.5Å; V762-I777 HydrophobicContact CG1-CG2 3.99Å; V762-I777 HydrophobicContact CG2-CG2 4.23Å; V762-R778 WeakPolarHBondContact CA-O 3.46Å; V762-Y779 HydrophobicContact CG2-CD2 4.43Å; V762-I803 HydrophobicContact CG1-CG2 4.44Å; V762-L807 HydrophobicContact CG1-CD1 4.49Å; V762-L807 WeakPolarHBondContact O-CD1 3.18Å; V762-L807 WeakPolarHBondContact O-CD2 3.32Å
763	G	91.4	Very high	89.3	Confident	25 Å²	25	64.4 Å²	64.4	26%	0.258	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	163.6	159.9	0	0	0	0	0	111.7	I777 R778	G763-I777 CarbonylContact O-C 3.57Å; G763-I777 WeakPolarHBondContact O-CA 3.4Å; G763-R778 PolarHBondContact N-O 3.35Å; G763-R778 PolarHBondContact O-N 3.03Å
764	I	93.9	Very high	89.2	Confident	37 Å²	37	64.3 Å²	64.3	19%	0.19	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	156.4	173.7	48.9	166.5	0	0	0	112.7	V762 E776 I777 L800 I803 R804 L807	V762-I764 HydrophobicContact CG1-CG2 4.5Å; I764-E776 CarbonylContact C-O 3.58Å; I764-E776 WeakPolarHBondContact CA-O 3.48Å; I764-E776 WeakPolarHBondContact CB-O 3.43Å; I764-I777 HydrophobicContact CG2-CG1 4.33Å; I764-L800 HydrophobicContact CB-CD2 4.41Å; I764-L800 HydrophobicContact CD1-CD2 3.9Å; I764-I803 HydrophobicContact CD1-CG2 4.08Å; I764-I803 HydrophobicContact CG2-CG2 3.71Å; I764-R804 HydrophobicContact CD1-CG 3.74Å; I764-L807 HydrophobicContact CG1-CD1 4.37Å
765	T	91.4	Very high	89.4	Confident	38 Å²	38	59.4 Å²	59.4	23%	0.233	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.9	167.8	-45.8	0	0	0	0	109.2	F775 E776 R778	T765-F775 CarbonylContact O-C 3.56Å; T765-F775 WeakPolarHBondContact O-CA 3.47Å; T765-F775 WeakPolarHBondContact O-CB 3.44Å; T765-E776 WeakPolarHBondContact CB-OE2 3.32Å; T765-E776 PolarHBondContact N-O 3Å; T765-E776 PolarHBondContact O-N 3.19Å; T765-E776 PolarHBondContact OG1-OE2 2.94Å; T765-R778 PolarHBondContact OG1-NH2 3.26Å
766	E	91.4	Very high	89.6	Confident	48 Å²	48	58.8 Å²	58.8	22%	0.224	31%	0.311	C	S	.	.	S	Bend	trans	-77	-29.6	-177.4	175.6	164.3	159.4	0	0	113.9	K796 L800 R804	E766-K796 VanDerWaalsContact O-CE 3.27Å; E766-K796 WeakPolarHBondContact O-CE 3.39Å; E766-K796 PolarHBondContact O-NZ 3.41Å; E766-L800 HydrophobicContact CB-CD1 4.02Å; E766-L800 HydrophobicContact CG-CD1 3.66Å; E766-R804 IonicContact OE2-CZ 3.36Å; E766-R804 IonicContact OE2-NH1 2.9Å; E766-R804 PolarHBondContact OE2-NH1 3.28Å; E766-R804 IonicContact OE2-NH2 3Å; E766-R804 PolarHBondContact OE2-NH2 2.95Å
767	H	85	Confident	89.7	Confident	149 Å²	149	57.3 Å²	57.3	69%	0.69	30%	0.301	S	S	*	.			trans	-112.4	112.8	-170.9	-72.1	86.8	0	0	0	111.5
768	V	85.4	Confident	89.5	Confident	27 Å²	27	60 Å²	60	16%	0.164	31%	0.311	C	S	.	.			trans	-114	133.3	173.3	176.8	0	0	0	0	108.3	K774 E776 I787	V768-K774 HydrophobicContact CB-CB 3.71Å; V768-K774 HydrophobicContact CG1-CB 3.9Å; V768-K774 HydrophobicContact CG1-CD 4.26Å; V768-K774 HydrophobicContact CG2-CB 4.11Å; V768-E776 HydrophobicContact CG2-CG 3.67Å; V768-I787 HydrophobicContact CG1-CG2 4.25Å; V768-I787 HydrophobicContact CG2-CG2 4.43Å
769	K	76.9	Confident	89.3	Confident	212 Å²	212	56.5 Å²	56.5	92%	0.922	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	135.2	-179.1	-67.2	-174.9	177.9	-177	0	111
770	G	75.6	Confident	88.6	Confident	87 Å²	87	60 Å²	60	90%	0.897	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.8	-16	168.8	0	0	0	0	0	117
771	D	81.9	Confident	87.7	Confident	26 Å²	26	58.2 Å²	58.2	14%	0.139	31%	0.311	C	S	.	.			trans	-150.7	115.6	170.8	-175.2	-16	0	0	0	110.3	R773 K774 Q789	D771-R773 PolarHBondContact O-N 3.07Å; D771-R773 VanDerWaalsContact O-N 3.1Å; D771-R773 VanDerWaalsContact OD1-CB 3.3Å; D771-R773 WeakPolarHBondContact OD1-CB 3.21Å; D771-R773 WeakPolarHBondContact OD1-CG 3.33Å; D771-R773 IonicContact OD1-CZ 2.83Å; D771-R773 PolarHBondContact OD1-N 2.84Å; D771-R773 IonicContact OD1-NE 2.7Å; D771-R773 PolarHBondContact OD1-NE 3.01Å; D771-R773 IonicContact OD1-NH2 3.77Å; D771-R773 IonicContact OD2-CZ 2.71Å; D771-R773 IonicContact OD2-NE 3.16Å; D771-R773 PolarHBondContact OD2-NE 3.13Å; D771-R773 IonicContact OD2-NH2 2.69Å; D771-R773 PolarHBondContact OD2-NH2 2.88Å; D771-K774 HydrophobicContact CB-CB 4.48Å; D771-K774 HydrophobicContact CB-CD 3.9Å; D771-K774 HydrophobicContact CB-CG 3.94Å; D771-K774 WeakPolarHBondContact O-CB 3.39Å; D771-K774 PolarHBondContact O-N 3.37Å; D771-Q789 PolarHBondContact OD2-NE2 2.91Å
772	N	90.2	Very high	86.5	Confident	130 Å²	130	61.6 Å²	61.6	70%	0.695	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-15.4	-177.2	-68.6	-7.2	0	0	0	113.3	K774 K796	N772-K774 VanDerWaalsContact C-N 3.35Å; N772-K796 VanDerWaalsContact O-CD 3.25Å; N772-K796 WeakPolarHBondContact O-CD 3.4Å; N772-K796 WeakPolarHBondContact O-CE 3.31Å; N772-K796 PolarHBondContact O-NZ 3.02Å
773	R	93.2	Very high	85.7	Confident	87 Å²	87	67 Å²	67	33%	0.328	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.4	174.1	-53.9	169.8	-65.7	171.9	1.9	113.6	D771 A790 P791 V793	D771-R773 PolarHBondContact O-N 3.07Å; D771-R773 VanDerWaalsContact O-N 3.1Å; D771-R773 VanDerWaalsContact OD1-CB 3.3Å; D771-R773 WeakPolarHBondContact OD1-CB 3.21Å; D771-R773 WeakPolarHBondContact OD1-CG 3.33Å; D771-R773 IonicContact OD1-CZ 2.83Å; D771-R773 PolarHBondContact OD1-N 2.84Å; D771-R773 IonicContact OD1-NE 2.7Å; D771-R773 PolarHBondContact OD1-NE 3.01Å; D771-R773 IonicContact OD1-NH2 3.77Å; D771-R773 IonicContact OD2-CZ 2.71Å; D771-R773 IonicContact OD2-NE 3.16Å; D771-R773 PolarHBondContact OD2-NE 3.13Å; D771-R773 IonicContact OD2-NH2 2.69Å; D771-R773 PolarHBondContact OD2-NH2 2.88Å; R773-A790 WeakPolarHBondContact CB-O 3.25Å; R773-A790 PolarHBondContact O-N 2.89Å; R773-P791 WeakPolarHBondContact CD-O 3.46Å; R773-P791 PolarHBondContact NH1-O 3.4Å; R773-V793 HydrophobicContact CG-CG2 3.99Å
774	K	93.3	Very high	85.3	Confident	43 Å²	43	67.2 Å²	67.2	19%	0.187	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	143.1	177	-71.5	-178.9	-171	-172.1	0	112	W702 V768 D771 N772 I787 V788 Q789 K796	W702-K774 HydrophobicContact CZ3-CD 4.35Å; V768-K774 HydrophobicContact CB-CB 3.71Å; V768-K774 HydrophobicContact CG1-CB 3.9Å; V768-K774 HydrophobicContact CG1-CD 4.26Å; V768-K774 HydrophobicContact CG2-CB 4.11Å; D771-K774 HydrophobicContact CB-CB 4.48Å; D771-K774 HydrophobicContact CB-CD 3.9Å; D771-K774 HydrophobicContact CB-CG 3.94Å; D771-K774 WeakPolarHBondContact O-CB 3.39Å; D771-K774 PolarHBondContact O-N 3.37Å; N772-K774 VanDerWaalsContact C-N 3.35Å; K774-I787 HydrophobicContact CB-CG2 4.44Å; K774-I787 HydrophobicContact CD-CG2 4.21Å; K774-V788 CarbonylContact C-O 3.24Å; K774-V788 VanDerWaalsContact CA-O 3.3Å; K774-V788 WeakPolarHBondContact CA-O 3.27Å; K774-Q789 HydrophobicContact CG-CB 3.75Å; K774-Q789 HydrophobicContact CG-CG 4.16Å; K774-K796 WeakPolarHBondContact O-CE 3.31Å; K774-K796 PolarHBondContact O-NZ 3.09Å
775	F	95.3	Very high	84.9	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	169.4	167.9	68.1	-82.7	0	0	0	109.4	T765 I777 V788 K796 W799 L800 I803	T765-F775 CarbonylContact O-C 3.56Å; T765-F775 WeakPolarHBondContact O-CA 3.47Å; T765-F775 WeakPolarHBondContact O-CB 3.44Å; F775-I777 HydrophobicContact CD2-CG1 4.28Å; F775-I777 HydrophobicContact CE2-CD1 4.03Å; F775-I777 HydrophobicContact CE2-CG1 3.78Å; F775-V788 HydrophobicContact CD1-CB 4.16Å; F775-V788 HydrophobicContact CD1-CG1 4.4Å; F775-V788 WeakPolarHBondContact CD1-O 3.41Å; F775-V788 HydrophobicContact CD2-CB 4.46Å; F775-V788 HydrophobicContact CE1-CB 3.78Å; F775-V788 HydrophobicContact CE1-CG1 3.61Å; F775-V788 HydrophobicContact CE2-CB 4.12Å; F775-V788 HydrophobicContact CE2-CG1 4.44Å; F775-V788 HydrophobicContact CE2-CG2 4.41Å; F775-V788 HydrophobicContact CG-CB 4.49Å; F775-V788 HydrophobicContact CZ-CB 3.77Å; F775-V788 HydrophobicContact CZ-CG1 3.64Å; F775-V788 HydrophobicContact CZ-CG2 4.37Å; F775-V788 PolarHBondContact N-O 3.42Å; F775-V788 PolarHBondContact O-N 3.36Å; F775-K796 HydrophobicContact CB-CD 4.44Å; F775-K796 HydrophobicContact CD1-CB 4.33Å; F775-K796 HydrophobicContact CD1-CD 4.4Å; F775-K796 HydrophobicContact CD1-CG 4Å; F775-W799 HydrophobicContact CZ-CB 4.17Å; F775-L800 HydrophobicContact CB-CD1 4.15Å; F775-L800 HydrophobicContact CB-CD2 4.06Å; F775-L800 HydrophobicContact CB-CG 4.36Å; F775-L800 HydrophobicContact CD2-CD2 3.75Å; F775-L800 HydrophobicContact CD2-CG 4.31Å; F775-L800 HydrophobicContact CE2-CD2 4.42Å; F775-L800 HydrophobicContact CG-CD2 4.06Å; F775-L800 HydrophobicContact CG-CG 4.27Å; F775-I803 HydrophobicContact CE2-CD1 4.29Å
776	E	93.8	Very high	84.9	Confident	39 Å²	39	65.8 Å²	65.8	18%	0.182	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.8	175.3	-51.2	178.8	160.3	0	0	110.7	I764 T765 V768 R778 I785 Y786	I764-E776 CarbonylContact C-O 3.58Å; I764-E776 WeakPolarHBondContact CA-O 3.48Å; I764-E776 WeakPolarHBondContact CB-O 3.43Å; T765-E776 WeakPolarHBondContact CB-OE2 3.32Å; T765-E776 PolarHBondContact N-O 3Å; T765-E776 PolarHBondContact O-N 3.19Å; T765-E776 PolarHBondContact OG1-OE2 2.94Å; V768-E776 HydrophobicContact CG2-CG 3.67Å; E776-R778 IonicContact OE2-NH2 3.59Å; E776-R778 PolarHBondContact OE2-NH2 3.07Å; E776-I785 HydrophobicContact CB-CG2 4.02Å; E776-I785 HydrophobicContact CG-CG2 4.11Å; E776-Y786 CarbonylContact C-O 3.58Å; E776-Y786 WeakPolarHBondContact CA-O 3.45Å
777	I	94	Very high	84.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	123.7	159.6	-58	176.2	0	0	0	106.4	L725 V732 F734 L757 V762 G763 I764 F775 Y786 V788 I803	L725-I777 HydrophobicContact CD2-CD1 4.4Å; V732-I777 HydrophobicContact CG1-CD1 4.43Å; F734-I777 HydrophobicContact CZ-CD1 4.44Å; L757-I777 HydrophobicContact CD1-CG2 3.91Å; V762-I777 HydrophobicContact CG1-CG2 3.99Å; V762-I777 HydrophobicContact CG2-CG2 4.23Å; G763-I777 CarbonylContact O-C 3.57Å; G763-I777 WeakPolarHBondContact O-CA 3.4Å; I764-I777 HydrophobicContact CG2-CG1 4.33Å; F775-I777 HydrophobicContact CD2-CG1 4.28Å; F775-I777 HydrophobicContact CE2-CD1 4.03Å; F775-I777 HydrophobicContact CE2-CG1 3.78Å; I777-Y786 PolarHBondContact N-O 3.16Å; I777-Y786 PolarHBondContact O-N 2.89Å; I777-V788 HydrophobicContact CD1-CG2 4.05Å; I777-V788 HydrophobicContact CG1-CG2 4.24Å; I777-I803 HydrophobicContact CD1-CD1 4.43Å
778	R	89.6	Confident	85.4	Confident	57 Å²	57	58.4 Å²	58.4	22%	0.215	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	140.8	-179.6	-175.3	-174.3	-51.2	106	14.1	109.2	V762 G763 T765 E776 E784 I785	V762-R778 WeakPolarHBondContact CA-O 3.46Å; G763-R778 PolarHBondContact N-O 3.35Å; G763-R778 PolarHBondContact O-N 3.03Å; T765-R778 PolarHBondContact OG1-NH2 3.26Å; E776-R778 IonicContact OE2-NH2 3.59Å; E776-R778 PolarHBondContact OE2-NH2 3.07Å; R778-E784 WeakPolarHBondContact CA-O 3.43Å; R778-I785 HydrophobicContact CG-CG1 4.28Å
779	Y	88.2	Confident	85.8	Confident	6 Å²	6	58.4 Å²	58.4	2%	0.024	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.7	179.1	-163.7	-118.9	0	0	0	111.4	L757 D761 V762 E781 K782 E783 E784	L757-Y779 HydrophobicContact CB-CD2 3.76Å; L757-Y779 HydrophobicContact CB-CE2 3.73Å; L757-Y779 HydrophobicContact CD1-CD2 4.32Å; L757-Y779 HydrophobicContact CD2-CD1 4.01Å; L757-Y779 HydrophobicContact CD2-CD2 3.68Å; L757-Y779 HydrophobicContact CD2-CE1 4.3Å; L757-Y779 HydrophobicContact CD2-CE2 3.96Å; L757-Y779 HydrophobicContact CD2-CG 3.69Å; L757-Y779 HydrophobicContact CG-CD2 4.11Å; L757-Y779 HydrophobicContact CG-CE2 4.4Å; D761-Y779 HydrophobicContact CB-CD2 3.69Å; D761-Y779 HydrophobicContact CB-CE2 3.36Å; D761-Y779 WeakPolarHBondContact O-CA 3.24Å; V762-Y779 HydrophobicContact CG2-CD2 4.43Å; Y779-E781 HydrophobicContact CD1-CB 4.17Å; Y779-E781 HydrophobicContact CE1-CB 3.68Å; Y779-E781 HydrophobicContact CE1-CG 3.91Å; Y779-E781 WeakPolarHBondContact CE1-OE2 3.38Å; Y779-E781 VanDerWaalsContact OH-CD 3.24Å; Y779-E781 PolarHBondContact OH-OE2 3.44Å; Y779-K782 HydrophobicContact CD1-CB 4.24Å; Y779-K782 HydrophobicContact CD1-CD 4.2Å; Y779-K782 HydrophobicContact CD1-CG 4.15Å; Y779-K782 HydrophobicContact CE1-CD 4.23Å; Y779-K782 HydrophobicContact CE1-CG 4.3Å; Y779-E783 PolarHBondContact O-N 3.45Å; Y779-E784 PolarHBondContact N-O 3.49Å
780	S	78.3	Confident	86.7	Confident	74 Å²	74	48.3 Å²	48.3	52%	0.517	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-69.4	-46.9	-174.6	17.5	0	0	0	0	113.9	D761 K782	D761-S780 WeakPolarHBondContact CA-OG 3.41Å; D761-S780 WeakPolarHBondContact CB-OG 3.45Å; D761-S780 PolarHBondContact O-N 3.48Å; D761-S780 PolarHBondContact O-OG 2.91Å; D761-S780 VanDerWaalsContact O-OG 3.08Å; D761-S780 WeakPolarHBondContact OD1-CB 3.44Å; D761-S780 PolarHBondContact OD1-OG 3.48Å; S780-K782 PolarHBondContact O-N 2.93Å
781	E	70.3	Confident	87.5	Confident	99 Å²	99	48 Å²	48	46%	0.463	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-55.6	-20.5	-175.2	-56.9	-178.8	145.6	0	0	114.5	K758 D761 Y779	K758-E781 IonicContact NZ-OE1 2.79Å; K758-E781 PolarHBondContact NZ-OE1 3.26Å; D761-E781 HydrophobicContact CB-CG 4.35Å; D761-E781 WeakPolarHBondContact OD2-CG 3.39Å; Y779-E781 HydrophobicContact CD1-CB 4.17Å; Y779-E781 HydrophobicContact CE1-CB 3.68Å; Y779-E781 HydrophobicContact CE1-CG 3.91Å; Y779-E781 WeakPolarHBondContact CE1-OE2 3.38Å; Y779-E781 VanDerWaalsContact OH-CD 3.24Å; Y779-E781 PolarHBondContact OH-OE2 3.44Å
782	K	64.7	Low	88.1	Confident	99 Å²	99	50 Å²	50	43%	0.43	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-134.8	3.3	-169.4	-58.3	177.3	-171.6	163.2	0	115.5	Y779 S780 E784	Y779-K782 HydrophobicContact CD1-CB 4.24Å; Y779-K782 HydrophobicContact CD1-CD 4.2Å; Y779-K782 HydrophobicContact CD1-CG 4.15Å; Y779-K782 HydrophobicContact CE1-CD 4.23Å; Y779-K782 HydrophobicContact CE1-CG 4.3Å; S780-K782 PolarHBondContact O-N 2.93Å; K782-E784 HydrophobicContact CB-CG 3.87Å; K782-E784 PolarHBondContact O-N 3.21Å; K782-E784 VanDerWaalsContact O-N 3.07Å
783	E	75.6	Confident	88.3	Confident	124 Å²	124	46.9 Å²	46.9	58%	0.579	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	17.1	-172.2	-56	-156.2	108.1	0	0	116.2	Y779	Y779-E783 PolarHBondContact O-N 3.45Å
784	E	82.4	Confident	88.4	Confident	30 Å²	30	48.3 Å²	48.3	14%	0.14	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	142.2	-177.4	-70.1	-176.8	152.5	0	0	112.4	L703 H705 R778 Y779 K782 Y786	L703-E784 HydrophobicContact CD1-CB 4.17Å; L703-E784 HydrophobicContact CD1-CG 4.39Å; H705-E784 VanDerWaalsContact CE1-CG 3.47Å; H705-E784 WeakPolarHBondContact CE1-CG 3.44Å; H705-E784 IonicContact CE1-OE1 2.73Å; R778-E784 WeakPolarHBondContact CA-O 3.43Å; Y779-E784 PolarHBondContact N-O 3.49Å; K782-E784 HydrophobicContact CB-CG 3.87Å; K782-E784 PolarHBondContact O-N 3.21Å; K782-E784 VanDerWaalsContact O-N 3.07Å; E784-Y786 HydrophobicContact CB-CD2 4.36Å; E784-Y786 HydrophobicContact CB-CE2 3.7Å; E784-Y786 WeakPolarHBondContact OE2-CE2 3.33Å; E784-Y786 PolarHBondContact OE2-OH 2.83Å
785	I	86.9	Confident	88.4	Confident	20 Å²	20	48.2 Å²	48.2	10%	0.103	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	114.5	174.4	-55.7	174	0	0	0	109	L703 G704 R706 E776 R778 I787	L703-I785 CarbonylContact C-O 3.52Å; L703-I785 WeakPolarHBondContact CA-O 3.31Å; G704-I785 PolarHBondContact N-O 3.04Å; G704-I785 WeakPolarHBondContact O-CB 3.39Å; G704-I785 PolarHBondContact O-N 3.31Å; R706-I785 HydrophobicContact CB-CD1 4.04Å; R706-I785 HydrophobicContact CG-CD1 4.09Å; E776-I785 HydrophobicContact CB-CG2 4.02Å; E776-I785 HydrophobicContact CG-CG2 4.11Å; R778-I785 HydrophobicContact CG-CG1 4.28Å; I785-I787 HydrophobicContact CG2-CG1 4.34Å
786	Y	90.6	Very high	88.5	Confident	25 Å²	25	48.8 Å²	48.8	10%	0.098	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	105	174.4	-65.6	-99.5	0	0	0	108.8	V701 W702 L703 F734 H755 L757 E776 I777 E784	V701-Y786 HydrophobicContact CG1-CD1 4.06Å; W702-Y786 CarbonylContact O-C 3.58Å; W702-Y786 WeakPolarHBondContact O-CA 3.4Å; L703-Y786 HydrophobicContact CD1-CD1 3.9Å; L703-Y786 HydrophobicContact CD1-CD2 4.1Å; L703-Y786 HydrophobicContact CD1-CE1 3.6Å; L703-Y786 HydrophobicContact CD1-CE2 3.79Å; L703-Y786 HydrophobicContact CD1-CG 4.12Å; F734-Y786 HydrophobicContact CD1-CD1 4.47Å; F734-Y786 AromaticContact CE1-CD1 3.82Å; F734-Y786 HydrophobicContact CE1-CD1 3.82Å; F734-Y786 HydrophobicContact CE1-CE1 4.44Å; F734-Y786 HydrophobicContact CE1-CG 4.35Å; F734-Y786 AromaticContact CZ-CD1 3.97Å; F734-Y786 HydrophobicContact CZ-CD1 3.97Å; F734-Y786 HydrophobicContact CZ-CG 4.15Å; H755-Y786 PolarHBondContact CD2-OH 3.37Å; L757-Y786 HydrophobicContact CD1-CD2 3.93Å; L757-Y786 HydrophobicContact CD1-CE2 3.97Å; L757-Y786 HydrophobicContact CD2-CE2 4.03Å; E776-Y786 CarbonylContact C-O 3.58Å; E776-Y786 WeakPolarHBondContact CA-O 3.45Å; I777-Y786 PolarHBondContact N-O 3.16Å; I777-Y786 PolarHBondContact O-N 2.89Å; E784-Y786 HydrophobicContact CB-CD2 4.36Å; E784-Y786 HydrophobicContact CB-CE2 3.7Å; E784-Y786 WeakPolarHBondContact OE2-CE2 3.33Å; E784-Y786 PolarHBondContact OE2-OH 2.83Å
787	I	91.9	Very high	88.6	Confident	41 Å²	41	50.6 Å²	50.6	21%	0.21	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.3	174.3	-51.9	174.7	0	0	0	107.5	V701 W702 V768 K774 I785	V701-I787 CarbonylContact C-O 3.58Å; V701-I787 VanDerWaalsContact CA-O 3.29Å; V701-I787 WeakPolarHBondContact CA-O 3.35Å; W702-I787 HydrophobicContact CB-CB 4.29Å; W702-I787 HydrophobicContact CE3-CB 4.43Å; W702-I787 HydrophobicContact CE3-CG2 4.33Å; W702-I787 PolarHBondContact N-O 2.92Å; W702-I787 PolarHBondContact O-N 2.88Å; V768-I787 HydrophobicContact CG1-CG2 4.25Å; V768-I787 HydrophobicContact CG2-CG2 4.43Å; K774-I787 HydrophobicContact CB-CG2 4.44Å; K774-I787 HydrophobicContact CD-CG2 4.21Å; I785-I787 HydrophobicContact CG2-CG1 4.34Å
788	V	94.6	Very high	88.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	121	-174.1	-175.8	0	0	0	0	109.5	F699 V701 L725 K774 F775 I777	F699-V788 HydrophobicContact CB-CG1 3.75Å; F699-V788 HydrophobicContact CD1-CG1 3.42Å; F699-V788 VanDerWaalsContact CD1-CG1 3.42Å; F699-V788 HydrophobicContact CD2-CG1 4.49Å; F699-V788 HydrophobicContact CE1-CG1 4.17Å; F699-V788 HydrophobicContact CG-CG1 3.63Å; V701-V788 HydrophobicContact CG2-CG2 4.34Å; L725-V788 HydrophobicContact CD2-CG1 4.29Å; L725-V788 HydrophobicContact CD2-CG2 4.36Å; K774-V788 CarbonylContact C-O 3.24Å; K774-V788 VanDerWaalsContact CA-O 3.3Å; K774-V788 WeakPolarHBondContact CA-O 3.27Å; F775-V788 HydrophobicContact CD1-CB 4.16Å; F775-V788 HydrophobicContact CD1-CG1 4.4Å; F775-V788 WeakPolarHBondContact CD1-O 3.41Å; F775-V788 HydrophobicContact CD2-CB 4.46Å; F775-V788 HydrophobicContact CE1-CB 3.78Å; F775-V788 HydrophobicContact CE1-CG1 3.61Å; F775-V788 HydrophobicContact CE2-CB 4.12Å; F775-V788 HydrophobicContact CE2-CG1 4.44Å; F775-V788 HydrophobicContact CE2-CG2 4.41Å; F775-V788 HydrophobicContact CG-CB 4.49Å; F775-V788 HydrophobicContact CZ-CB 3.77Å; F775-V788 HydrophobicContact CZ-CG1 3.64Å; F775-V788 HydrophobicContact CZ-CG2 4.37Å; F775-V788 PolarHBondContact N-O 3.42Å; F775-V788 PolarHBondContact O-N 3.36Å; I777-V788 HydrophobicContact CD1-CG2 4.05Å; I777-V788 HydrophobicContact CG1-CG2 4.24Å
789	Q	94.4	Very high	89.1	Confident	27 Å²	27	51.8 Å²	51.8	13%	0.126	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.3	171.7	176.2	-174.8	60.3	0	0	109.8	F699 N700 W702 D771 K774	F699-Q789 WeakPolarHBondContact CD1-O 3.24Å; N700-Q789 HydrophobicContact CB-CB 4.14Å; N700-Q789 PolarHBondContact N-O 3Å; N700-Q789 PolarHBondContact ND2-OE1 3.42Å; N700-Q789 PolarHBondContact O-N 3.09Å; W702-Q789 HydrophobicContact CH2-CB 4.13Å; W702-Q789 HydrophobicContact CZ3-CB 3.69Å; D771-Q789 PolarHBondContact OD2-NE2 2.91Å; K774-Q789 HydrophobicContact CG-CB 3.75Å; K774-Q789 HydrophobicContact CG-CG 4.16Å
790	A	95.1	Very high	89.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.008	27%	0.27	C	S	.	.			trans	-74.5	155.7	169.8	0	0	0	0	0	111.6	F699 R773 N792 V795 K796	F699-A790 HydrophobicContact CD1-CB 4.35Å; F699-A790 HydrophobicContact CE1-CB 3.97Å; R773-A790 WeakPolarHBondContact CB-O 3.25Å; R773-A790 PolarHBondContact O-N 2.89Å; A790-N792 VanDerWaalsContact C-N 3.33Å; A790-N792 VanDerWaalsContact CB-O 3.28Å; A790-N792 WeakPolarHBondContact CB-O 3.24Å; A790-N792 PolarHBondContact O-N 2.65Å; A790-V795 HydrophobicContact CB-CB 4.33Å; A790-V795 HydrophobicContact CB-CG1 4.19Å; A790-K796 HydrophobicContact CB-CB 3.69Å
791	P	93.5	Very high	90.3	Very high	80 Å²	80	53.9 Å²	53.9	52%	0.519	27%	0.272	S	S	.	.	S	Bend	trans	-61.2	-41.3	176	23.5	-33.6	0	0	0	112.4	R773 V795	R773-P791 WeakPolarHBondContact CD-O 3.46Å; R773-P791 PolarHBondContact NH1-O 3.4Å; P791-V795 HydrophobicContact CG-CB 4.28Å; P791-V795 HydrophobicContact CG-CG1 4.3Å; P791-V795 HydrophobicContact CG-CG2 4.25Å
792	N	94.6	Very high	91.6	Very high	67 Å²	67	50 Å²	50	36%	0.358	25%	0.253	S	S	.	.	S	Bend	trans	-135.6	177.3	175.9	65.7	16.5	0	0	0	111	A790 D794 V795	A790-N792 VanDerWaalsContact C-N 3.33Å; A790-N792 VanDerWaalsContact CB-O 3.28Å; A790-N792 WeakPolarHBondContact CB-O 3.24Å; A790-N792 PolarHBondContact O-N 2.65Å; N792-D794 PolarHBondContact OD1-N 3.11Å; N792-V795 VanDerWaalsContact OD1-CB 3.3Å; N792-V795 WeakPolarHBondContact OD1-CB 3.4Å; N792-V795 VanDerWaalsContact OD1-CG2 3.22Å; N792-V795 WeakPolarHBondContact OD1-CG2 3.21Å; N792-V795 PolarHBondContact OD1-N 3.4Å
793	V	94.2	Very high	93.1	Very high	65 Å²	65	45.3 Å²	45.3	39%	0.394	23%	0.233	S	C	.	.	H	α-helix	trans	-71.7	-37.6	-178.7	178.9	0	0	0	0	111.2	R773 V795 K796 M797	R773-V793 HydrophobicContact CG-CG2 3.99Å; V793-V795 PolarHBondContact O-N 3.16Å; V793-K796 WeakPolarHBondContact O-CA 3.35Å; V793-K796 WeakPolarHBondContact O-CB 3.49Å; V793-K796 PolarHBondContact O-N 3.41Å; V793-K796 VanDerWaalsContact O-N 3.09Å; V793-M797 HydrophobicContact CG1-CG 4.04Å; V793-M797 WeakPolarHBondContact O-CG 2.99Å; V793-M797 PolarHBondContact O-N 2.89Å
794	D	94.4	Very high	94	Very high	117 Å²	117	44.1 Å²	44.1	63%	0.626	22%	0.223	S	C	*	.	H	α-helix	trans	-62.8	-42.1	-176	-44.9	-72.2	0	0	0	112.1	N792 M797 L798	N792-D794 PolarHBondContact OD1-N 3.11Å; D794-M797 PolarHBondContact O-N 3.12Å; D794-L798 WeakPolarHBondContact O-CB 3.37Å; D794-L798 PolarHBondContact O-N 3.33Å
795	V	94.9	Very high	94.6	Very high	42 Å²	42	47.7 Å²	47.7	26%	0.255	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-39.9	173.9	171.3	0	0	0	0	111.2	F699 A790 P791 N792 V793 W799	F699-V795 HydrophobicContact CE1-CG1 4.04Å; F699-V795 HydrophobicContact CZ-CG1 4.06Å; A790-V795 HydrophobicContact CB-CB 4.33Å; A790-V795 HydrophobicContact CB-CG1 4.19Å; P791-V795 HydrophobicContact CG-CB 4.28Å; P791-V795 HydrophobicContact CG-CG1 4.3Å; P791-V795 HydrophobicContact CG-CG2 4.25Å; N792-V795 VanDerWaalsContact OD1-CB 3.3Å; N792-V795 WeakPolarHBondContact OD1-CB 3.4Å; N792-V795 VanDerWaalsContact OD1-CG2 3.22Å; N792-V795 WeakPolarHBondContact OD1-CG2 3.21Å; N792-V795 PolarHBondContact OD1-N 3.4Å; V793-V795 PolarHBondContact O-N 3.16Å; V795-W799 WeakPolarHBondContact O-CB 3.42Å; V795-W799 PolarHBondContact O-N 3.19Å
796	K	96.4	Very high	95	Very high	11 Å²	11	47 Å²	47	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-59.8	-47.1	172	158.4	178.3	167.4	176.6	0	111.1	E766 N772 K774 F775 A790 V793 W799 L800	E766-K796 VanDerWaalsContact O-CE 3.27Å; E766-K796 WeakPolarHBondContact O-CE 3.39Å; E766-K796 PolarHBondContact O-NZ 3.41Å; N772-K796 VanDerWaalsContact O-CD 3.25Å; N772-K796 WeakPolarHBondContact O-CD 3.4Å; N772-K796 WeakPolarHBondContact O-CE 3.31Å; N772-K796 PolarHBondContact O-NZ 3.02Å; K774-K796 WeakPolarHBondContact O-CE 3.31Å; K774-K796 PolarHBondContact O-NZ 3.09Å; F775-K796 HydrophobicContact CB-CD 4.44Å; F775-K796 HydrophobicContact CD1-CB 4.33Å; F775-K796 HydrophobicContact CD1-CD 4.4Å; F775-K796 HydrophobicContact CD1-CG 4Å; A790-K796 HydrophobicContact CB-CB 3.69Å; V793-K796 WeakPolarHBondContact O-CA 3.35Å; V793-K796 WeakPolarHBondContact O-CB 3.49Å; V793-K796 PolarHBondContact O-N 3.41Å; V793-K796 VanDerWaalsContact O-N 3.09Å; K796-W799 PolarHBondContact O-N 2.92Å; K796-L800 HydrophobicContact CD-CD1 4.32Å; K796-L800 HydrophobicContact CG-CD1 3.71Å; K796-L800 HydrophobicContact CG-CG 4.39Å; K796-L800 WeakPolarHBondContact O-CB 3.46Å; K796-L800 WeakPolarHBondContact O-CG 3.41Å; K796-L800 PolarHBondContact O-N 2.97Å
797	M	96.7	Very high	95.1	Very high	77 Å²	77	47.4 Å²	47.4	38%	0.379	24%	0.238	S	C	.	.	H	α-helix	trans	-68.1	-37.4	-176.7	-63.7	-51.5	-72.5	0	0	111.8	V793 D794 L800 K801	V793-M797 HydrophobicContact CG1-CG 4.04Å; V793-M797 WeakPolarHBondContact O-CG 2.99Å; V793-M797 PolarHBondContact O-N 2.89Å; D794-M797 PolarHBondContact O-N 3.12Å; M797-L800 HydrophobicContact SD-CD1 4.44Å; M797-K801 VanDerWaalsContact O-CB 3.27Å; M797-K801 WeakPolarHBondContact O-CB 3.1Å; M797-K801 PolarHBondContact O-N 3.39Å
798	L	95.5	Very high	95.1	Very high	78 Å²	78	49 Å²	49	41%	0.408	25%	0.25	S	C	.	.	H	α-helix	trans	-61.7	-47.1	171.8	178.6	60.7	0	0	0	111.8	L695 D794 K801 E802	L695-L798 HydrophobicContact CD1-CG 4.16Å; L695-L798 HydrophobicContact CD2-CD2 4.06Å; L695-L798 HydrophobicContact CD2-CG 4.18Å; D794-L798 WeakPolarHBondContact O-CB 3.37Å; D794-L798 PolarHBondContact O-N 3.33Å; L798-K801 WeakPolarHBondContact O-CB 3.24Å; L798-K801 PolarHBondContact O-N 2.86Å; L798-E802 HydrophobicContact CD1-CG 4.33Å; L798-E802 PolarHBondContact O-N 3.49Å
799	W	97.1	Very high	94.9	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.015	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-44.9	177.5	-87.6	66.9	0	0	0	112.2	L695 F699 L725 L727 F775 V795 K796 K801 E802 I803	L695-W799 HydrophobicContact CB-CH2 4.32Å; L695-W799 HydrophobicContact CB-CZ2 3.65Å; L695-W799 HydrophobicContact CD1-CB 4.46Å; L695-W799 HydrophobicContact CD1-CD2 4.08Å; L695-W799 HydrophobicContact CD1-CG 3.89Å; F699-W799 HydrophobicContact CE2-CD2 4.16Å; F699-W799 AromaticContact CE2-CE2 3.71Å; F699-W799 HydrophobicContact CE2-CE3 4.45Å; F699-W799 HydrophobicContact CE2-CH2 4.02Å; F699-W799 AromaticContact CE2-CZ2 3.65Å; F699-W799 HydrophobicContact CE2-CZ2 3.65Å; F699-W799 HydrophobicContact CE2-CZ3 4.4Å; F699-W799 AromaticContact CZ-CD1 3.9Å; F699-W799 AromaticContact CZ-CD2 3.72Å; F699-W799 HydrophobicContact CZ-CD2 3.72Å; F699-W799 AromaticContact CZ-CE2 3.48Å; F699-W799 VanDerWaalsContact CZ-CE2 3.48Å; F699-W799 HydrophobicContact CZ-CE3 4.33Å; F699-W799 HydrophobicContact CZ-CG 4.02Å; F699-W799 AromaticContact CZ-CZ2 3.95Å; F699-W799 HydrophobicContact CZ-CZ2 3.95Å; F699-W799 AromaticContact CZ-NE1 3.57Å; L725-W799 HydrophobicContact CB-CH2 3.57Å; L725-W799 HydrophobicContact CB-CZ2 4.49Å; L725-W799 HydrophobicContact CB-CZ3 3.87Å; L725-W799 HydrophobicContact CD2-CZ3 4.14Å; L727-W799 HydrophobicContact CB-CH2 3.97Å; L727-W799 HydrophobicContact CB-CZ3 3.96Å; F775-W799 HydrophobicContact CZ-CB 4.17Å; V795-W799 WeakPolarHBondContact O-CB 3.42Å; V795-W799 PolarHBondContact O-N 3.19Å; K796-W799 PolarHBondContact O-N 2.92Å; W799-K801 VanDerWaalsContact C-N 3.3Å; W799-K801 PolarHBondContact O-N 3.31Å; W799-E802 PolarHBondContact O-N 3.35Å; W799-I803 HydrophobicContact CE3-CD1 4.18Å; W799-I803 WeakPolarHBondContact O-CB 3.26Å; W799-I803 WeakPolarHBondContact O-CD1 3.49Å; W799-I803 WeakPolarHBondContact O-CG1 3.33Å; W799-I803 PolarHBondContact O-N 3.34Å
800	L	96.7	Very high	94.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-29.1	175.6	-72.1	171.3	0	0	0	113.2	I764 E766 F775 K796 M797 R804	I764-L800 HydrophobicContact CB-CD2 4.41Å; I764-L800 HydrophobicContact CD1-CD2 3.9Å; E766-L800 HydrophobicContact CB-CD1 4.02Å; E766-L800 HydrophobicContact CG-CD1 3.66Å; F775-L800 HydrophobicContact CB-CD1 4.15Å; F775-L800 HydrophobicContact CB-CD2 4.06Å; F775-L800 HydrophobicContact CB-CG 4.36Å; F775-L800 HydrophobicContact CD2-CD2 3.75Å; F775-L800 HydrophobicContact CD2-CG 4.31Å; F775-L800 HydrophobicContact CE2-CD2 4.42Å; F775-L800 HydrophobicContact CG-CD2 4.06Å; F775-L800 HydrophobicContact CG-CG 4.27Å; K796-L800 HydrophobicContact CD-CD1 4.32Å; K796-L800 HydrophobicContact CG-CD1 3.71Å; K796-L800 HydrophobicContact CG-CG 4.39Å; K796-L800 WeakPolarHBondContact O-CB 3.46Å; K796-L800 WeakPolarHBondContact O-CG 3.41Å; K796-L800 PolarHBondContact O-N 2.97Å; M797-L800 HydrophobicContact SD-CD1 4.44Å; L800-R804 VanDerWaalsContact O-CB 3.29Å; L800-R804 WeakPolarHBondContact O-CB 3.42Å; L800-R804 VanDerWaalsContact O-CG 3.25Å; L800-R804 WeakPolarHBondContact O-CG 3.14Å; L800-R804 PolarHBondContact O-N 3.31Å; L800-R804 VanDerWaalsContact O-N 3.16Å; L800-R804 PolarHBondContact O-NE 3.38Å; L800-R804 VanDerWaalsContact O-NE 3.08Å
801	K	96.8	Very high	93.9	Very high	125 Å²	125	61.2 Å²	61.2	54%	0.543	30%	0.304	S	S	.	.	H	α-helix	trans	-67.3	-54.6	174	177.4	-174.3	172	-111.8	0	111	M797 L798 W799 R804 K805	M797-K801 VanDerWaalsContact O-CB 3.27Å; M797-K801 WeakPolarHBondContact O-CB 3.1Å; M797-K801 PolarHBondContact O-N 3.39Å; L798-K801 WeakPolarHBondContact O-CB 3.24Å; L798-K801 PolarHBondContact O-N 2.86Å; W799-K801 VanDerWaalsContact C-N 3.3Å; W799-K801 PolarHBondContact O-N 3.31Å; K801-R804 PolarHBondContact O-N 3.04Å; K801-K805 PolarHBondContact O-N 3.14Å
802	E	95.9	Very high	93.6	Very high	17 Å²	17	63 Å²	63	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-73.3	-32.3	-175.9	-58.4	-53	126.7	0	0	112.3	V694 L695 L727 L798 W799 K805 I806	V694-E802 HydrophobicContact CG1-CB 3.87Å; V694-E802 HydrophobicContact CG1-CG 4.16Å; L695-E802 HydrophobicContact CD1-CB 3.98Å; L695-E802 HydrophobicContact CD1-CG 4.04Å; L695-E802 HydrophobicContact CG-CG 4.45Å; L727-E802 HydrophobicContact CD2-CB 4.23Å; L798-E802 HydrophobicContact CD1-CG 4.33Å; L798-E802 PolarHBondContact O-N 3.49Å; W799-E802 PolarHBondContact O-N 3.35Å; E802-K805 WeakPolarHBondContact O-CB 3.29Å; E802-K805 PolarHBondContact O-N 3.13Å; E802-K805 WeakPolarHBondContact OE2-CD 3.41Å; E802-K805 IonicContact OE2-NZ 2.84Å; E802-K805 PolarHBondContact OE2-NZ 3.3Å; E802-I806 WeakPolarHBondContact O-CG1 3.25Å; E802-I806 PolarHBondContact O-N 3.41Å
803	I	96.3	Very high	93	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-44.2	169.3	-68.1	166.9	0	0	0	110.8	L727 M759 V762 I764 F775 I777 W799 K805 I806 L807	L727-I803 HydrophobicContact CD1-CG1 3.9Å; L727-I803 HydrophobicContact CD2-CG1 3.78Å; M759-I803 HydrophobicContact CE-CG2 4.22Å; V762-I803 HydrophobicContact CG1-CG2 4.44Å; I764-I803 HydrophobicContact CD1-CG2 4.08Å; I764-I803 HydrophobicContact CG2-CG2 3.71Å; F775-I803 HydrophobicContact CE2-CD1 4.29Å; I777-I803 HydrophobicContact CD1-CD1 4.43Å; W799-I803 HydrophobicContact CE3-CD1 4.18Å; W799-I803 WeakPolarHBondContact O-CB 3.26Å; W799-I803 WeakPolarHBondContact O-CD1 3.49Å; W799-I803 WeakPolarHBondContact O-CG1 3.33Å; W799-I803 PolarHBondContact O-N 3.34Å; I803-K805 VanDerWaalsContact C-N 3.34Å; I803-K805 PolarHBondContact O-N 3.14Å; I803-I806 PolarHBondContact O-N 2.88Å; I803-L807 HydrophobicContact CG2-CD1 3.82Å; I803-L807 HydrophobicContact CG2-CG 4.35Å; I803-L807 WeakPolarHBondContact O-CG 3.48Å; I803-L807 PolarHBondContact O-N 3.42Å
804	R	95.7	Very high	92.2	Very high	100 Å²	100	68.1 Å²	68.1	38%	0.377	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-42.9	175.3	-84.4	-175.9	-90.2	-128	5.4	112.5	I764 E766 L800 K801 L807 V808	I764-R804 HydrophobicContact CD1-CG 3.74Å; E766-R804 IonicContact OE2-CZ 3.36Å; E766-R804 IonicContact OE2-NH1 2.9Å; E766-R804 PolarHBondContact OE2-NH1 3.28Å; E766-R804 IonicContact OE2-NH2 3Å; E766-R804 PolarHBondContact OE2-NH2 2.95Å; L800-R804 VanDerWaalsContact O-CB 3.29Å; L800-R804 WeakPolarHBondContact O-CB 3.42Å; L800-R804 VanDerWaalsContact O-CG 3.25Å; L800-R804 WeakPolarHBondContact O-CG 3.14Å; L800-R804 PolarHBondContact O-N 3.31Å; L800-R804 VanDerWaalsContact O-N 3.16Å; L800-R804 PolarHBondContact O-NE 3.38Å; L800-R804 VanDerWaalsContact O-NE 3.08Å; K801-R804 PolarHBondContact O-N 3.04Å; R804-L807 PolarHBondContact O-N 2.82Å; R804-V808 WeakPolarHBondContact O-CG2 3.49Å; R804-V808 PolarHBondContact O-N 2.84Å
805	K	95	Very high	91.4	Very high	105 Å²	105	66 Å²	66	46%	0.457	32%	0.32	S	S	.	.	H	α-helix	trans	-57.5	-49.7	177.4	-178.9	-169	178.4	-169	0	111.5	K801 E802 I803 L807 V808 Q809	K801-K805 PolarHBondContact O-N 3.14Å; E802-K805 WeakPolarHBondContact O-CB 3.29Å; E802-K805 PolarHBondContact O-N 3.13Å; E802-K805 WeakPolarHBondContact OE2-CD 3.41Å; E802-K805 IonicContact OE2-NZ 2.84Å; E802-K805 PolarHBondContact OE2-NZ 3.3Å; I803-K805 VanDerWaalsContact C-N 3.34Å; I803-K805 PolarHBondContact O-N 3.14Å; K805-L807 PolarHBondContact O-N 2.97Å; K805-V808 PolarHBondContact O-N 3.47Å; K805-Q809 WeakPolarHBondContact O-CG 3.16Å; K805-Q809 PolarHBondContact O-N 2.72Å
806	I	94.8	Very high	90.5	Very high	6 Å²	6	66.5 Å²	66.5	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-45.6	177.2	-62.1	160.8	0	0	0	110.8	V694 L727 E729 M759 E802 I803 V808 Q809 Q810	V694-I806 HydrophobicContact CG2-CD1 4.11Å; L727-I806 HydrophobicContact CD1-CD1 3.82Å; L727-I806 HydrophobicContact CD2-CD1 3.96Å; L727-I806 HydrophobicContact CG-CD1 3.85Å; E729-I806 WeakPolarHBondContact O-CG2 3.49Å; M759-I806 HydrophobicContact CB-CG2 4.33Å; M759-I806 HydrophobicContact CE-CB 4.09Å; M759-I806 HydrophobicContact CE-CG2 3.74Å; M759-I806 HydrophobicContact CG-CG2 4.14Å; E802-I806 WeakPolarHBondContact O-CG1 3.25Å; E802-I806 PolarHBondContact O-N 3.41Å; I803-I806 PolarHBondContact O-N 2.88Å; I806-V808 VanDerWaalsContact C-N 3.27Å; I806-V808 PolarHBondContact O-N 3.27Å; I806-Q809 PolarHBondContact O-N 3.33Å; I806-Q810 HydrophobicContact CG2-CG 4.4Å; I806-Q810 WeakPolarHBondContact O-CG 3.27Å; I806-Q810 PolarHBondContact O-N 2.54Å
807	L	92.5	Very high	89.3	Confident	33 Å²	33	72.1 Å²	72.1	17%	0.173	35%	0.352	C	S	.	.	H	α-helix	trans	-67.2	-23.5	179.4	-68.8	173.9	0	0	0	114.1	M759 V762 I764 I803 R804 K805 K811	M759-L807 HydrophobicContact CE-CD1 4.46Å; M759-L807 HydrophobicContact CE-CD2 3.57Å; M759-L807 HydrophobicContact CE-CG 3.68Å; M759-L807 WeakPolarHBondContact O-CD2 3.36Å; V762-L807 HydrophobicContact CG1-CD1 4.49Å; V762-L807 WeakPolarHBondContact O-CD1 3.18Å; V762-L807 WeakPolarHBondContact O-CD2 3.32Å; I764-L807 HydrophobicContact CG1-CD1 4.37Å; I803-L807 HydrophobicContact CG2-CD1 3.82Å; I803-L807 HydrophobicContact CG2-CG 4.35Å; I803-L807 WeakPolarHBondContact O-CG 3.48Å; I803-L807 PolarHBondContact O-N 3.42Å; R804-L807 PolarHBondContact O-N 2.82Å; K805-L807 PolarHBondContact O-N 2.97Å; L807-K811 WeakPolarHBondContact O-CG 3.49Å
808	V	92.4	Very high	88	Confident	74 Å²	74	71.5 Å²	71.5	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-75.9	-51	170.3	167.5	0	0	0	0	109.9	R804 K805 I806 Q810 K811 E812	R804-V808 WeakPolarHBondContact O-CG2 3.49Å; R804-V808 PolarHBondContact O-N 2.84Å; K805-V808 PolarHBondContact O-N 3.47Å; I806-V808 VanDerWaalsContact C-N 3.27Å; I806-V808 PolarHBondContact O-N 3.27Å; V808-Q810 VanDerWaalsContact C-N 3.27Å; V808-Q810 PolarHBondContact O-N 3.29Å; V808-K811 WeakPolarHBondContact O-CA 3.36Å; V808-K811 WeakPolarHBondContact O-CB 3.33Å; V808-K811 PolarHBondContact O-N 3.32Å; V808-E812 HydrophobicContact CG1-CG 4.41Å; V808-E812 VanDerWaalsContact CG1-OE1 3.29Å; V808-E812 WeakPolarHBondContact CG1-OE1 3.3Å; V808-E812 WeakPolarHBondContact O-CG 3.27Å; V808-E812 PolarHBondContact O-N 3.19Å
809	Q	89.4	Confident	86.6	Confident	91 Å²	91	73.9 Å²	73.9	43%	0.425	36%	0.362	S	S	.	.	H	α-helix	trans	-57.5	-38.3	178.8	-69.5	175.7	-57.8	0	0	112.6	K805 I806 E812 L813	K805-Q809 WeakPolarHBondContact O-CG 3.16Å; K805-Q809 PolarHBondContact O-N 2.72Å; I806-Q809 PolarHBondContact O-N 3.33Å; Q809-E812 PolarHBondContact O-N 3.11Å; Q809-L813 WeakPolarHBondContact O-CB 3.28Å; Q809-L813 VanDerWaalsContact O-CG 3.3Å; Q809-L813 WeakPolarHBondContact O-CG 3.3Å; Q809-L813 PolarHBondContact O-N 3.2Å
810	Q	84.9	Confident	84.6	Confident	42 Å²	42	80.2 Å²	80.2	20%	0.196	39%	0.392	C	S	.	.	H	α-helix	trans	-68	-35.5	175.2	-71.7	-173.4	-2.5	0	0	112.9	E729 M759 I806 V808 M814	E729-Q810 PolarHBondContact O-NE2 3.32Å; M759-Q810 VanDerWaalsContact C-OE1 3.31Å; M759-Q810 PolarHBondContact O-OE1 3.21Å; I806-Q810 HydrophobicContact CG2-CG 4.4Å; I806-Q810 WeakPolarHBondContact O-CG 3.27Å; I806-Q810 PolarHBondContact O-N 2.54Å; V808-Q810 VanDerWaalsContact C-N 3.27Å; V808-Q810 PolarHBondContact O-N 3.29Å; Q810-M814 WeakPolarHBondContact O-CB 3.49Å; Q810-M814 VanDerWaalsContact O-CG 3.24Å; Q810-M814 WeakPolarHBondContact O-CG 3.26Å; Q810-M814 PolarHBondContact O-N 3.49Å
811	K	84.3	Confident	82.6	Confident	151 Å²	151	84.7 Å²	84.7	66%	0.657	42%	0.416	S	S	*	.	H	α-helix	trans	-69.1	-39.1	174	-74.5	175.5	179.5	-173.2	0	112.3	L807 V808 M814 T815	L807-K811 WeakPolarHBondContact O-CG 3.49Å; V808-K811 WeakPolarHBondContact O-CA 3.36Å; V808-K811 WeakPolarHBondContact O-CB 3.33Å; V808-K811 PolarHBondContact O-N 3.32Å; K811-M814 PolarHBondContact O-N 3.43Å; K811-T815 VanDerWaalsContact O-CB 3.31Å; K811-T815 WeakPolarHBondContact O-CB 3.34Å; K811-T815 PolarHBondContact O-N 3.28Å; K811-T815 PolarHBondContact O-OG1 3.19Å
812	E	87.3	Confident	80.7	Confident	117 Å²	117	84 Å²	84	55%	0.547	41%	0.414	S	S	.	.	H	α-helix	trans	-60.1	-48.8	173.7	-68.7	165.4	169.2	0	0	110.4	V808 Q809 M814 T815 A816	V808-E812 HydrophobicContact CG1-CG 4.41Å; V808-E812 VanDerWaalsContact CG1-OE1 3.29Å; V808-E812 WeakPolarHBondContact CG1-OE1 3.3Å; V808-E812 WeakPolarHBondContact O-CG 3.27Å; V808-E812 PolarHBondContact O-N 3.19Å; Q809-E812 PolarHBondContact O-N 3.11Å; E812-M814 PolarHBondContact O-N 3.06Å; E812-T815 PolarHBondContact O-N 3.19Å; E812-A816 WeakPolarHBondContact O-CB 3.33Å; E812-A816 PolarHBondContact O-N 3.42Å
813	L	81.7	Confident	78.6	Confident	118 Å²	118	86.2 Å²	86.2	62%	0.618	44%	0.435	S	S	*	.	H	α-helix	trans	-61.3	-42.5	176.2	-73.8	171.5	0	0	0	113.5	Q809 K817	Q809-L813 WeakPolarHBondContact O-CB 3.28Å; Q809-L813 VanDerWaalsContact O-CG 3.3Å; Q809-L813 WeakPolarHBondContact O-CG 3.3Å; Q809-L813 PolarHBondContact O-N 3.2Å; L813-K817 WeakPolarHBondContact O-CG 3.38Å; L813-K817 PolarHBondContact O-N 3.16Å; L813-K817 VanDerWaalsContact O-N 3.08Å
814	M	77.4	Confident	76.4	Confident	122 Å²	122	92.1 Å²	92.1	60%	0.601	47%	0.467	S	S	*	.	H	α-helix	trans	-66.5	-39.2	176	-72.1	-64.9	-71.5	0	0	111.7	Q810 K811 E812 K817 T818	Q810-M814 WeakPolarHBondContact O-CB 3.49Å; Q810-M814 VanDerWaalsContact O-CG 3.24Å; Q810-M814 WeakPolarHBondContact O-CG 3.26Å; Q810-M814 PolarHBondContact O-N 3.49Å; K811-M814 PolarHBondContact O-N 3.43Å; E812-M814 PolarHBondContact O-N 3.06Å; M814-K817 PolarHBondContact O-N 3.34Å; M814-T818 PolarHBondContact O-N 3.09Å; M814-T818 PolarHBondContact O-OG1 3.43Å; M814-T818 VanDerWaalsContact O-OG1 3.07Å
815	T	78.7	Confident	74	Confident	74 Å²	74	93.4 Å²	93.4	45%	0.454	48%	0.481	S	S	.	.	H	α-helix	trans	-66.8	-42.2	178.3	-54.3	0	0	0	0	111.1	K811 E812 T818 Q819	K811-T815 VanDerWaalsContact O-CB 3.31Å; K811-T815 WeakPolarHBondContact O-CB 3.34Å; K811-T815 PolarHBondContact O-N 3.28Å; K811-T815 PolarHBondContact O-OG1 3.19Å; E812-T815 PolarHBondContact O-N 3.19Å; T815-T818 PolarHBondContact O-N 2.74Å; T815-Q819 WeakPolarHBondContact O-CG 3.24Å; T815-Q819 PolarHBondContact O-N 3.07Å
816	A	74.6	Confident	71.5	Confident	52 Å²	52	96.2 Å²	96.2	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-61.4	-42.7	174.8	0	0	0	0	0	112	E812 Q819 Q820	E812-A816 WeakPolarHBondContact O-CB 3.33Å; E812-A816 PolarHBondContact O-N 3.42Å; A816-Q819 PolarHBondContact O-N 3.4Å; A816-Q820 WeakPolarHBondContact O-CB 3.19Å; A816-Q820 PolarHBondContact O-N 2.97Å
817	K	72.4	Confident	69	Low	128 Å²	128	103.2 Å²	103.2	56%	0.557	53%	0.533	S	S	*	.	H	α-helix	trans	-60.1	-52.9	172.4	-76.8	-175	174.6	-171	0	111.9	L813 M814 Q819 Q820 D821	L813-K817 WeakPolarHBondContact O-CG 3.38Å; L813-K817 PolarHBondContact O-N 3.16Å; L813-K817 VanDerWaalsContact O-N 3.08Å; M814-K817 PolarHBondContact O-N 3.34Å; K817-Q819 PolarHBondContact O-N 3.27Å; K817-Q820 CarbonylContact O-C 3.57Å; K817-Q820 WeakPolarHBondContact O-CA 3.45Å; K817-Q820 WeakPolarHBondContact O-CB 3.4Å; K817-Q820 PolarHBondContact O-N 3.07Å; K817-D821 VanDerWaalsContact O-CG 3.25Å; K817-D821 PolarHBondContact O-N 3.31Å
818	T	69	Low	66.7	Low	65 Å²	65	108.9 Å²	108.9	40%	0.399	56%	0.559	S	S	.	*	H	α-helix	trans	-58.7	-34.2	179.8	-55.9	0	0	0	0	112.5	M814 T815 Q822	M814-T818 PolarHBondContact O-N 3.09Å; M814-T818 PolarHBondContact O-OG1 3.43Å; M814-T818 VanDerWaalsContact O-OG1 3.07Å; T815-T818 PolarHBondContact O-N 2.74Å; T818-Q822 HydrophobicContact CG2-CG 4.44Å; T818-Q822 VanDerWaalsContact O-CB 3.24Å; T818-Q822 WeakPolarHBondContact O-CB 3.48Å; T818-Q822 WeakPolarHBondContact O-CG 3.27Å; T818-Q822 PolarHBondContact O-N 3.09Å
819	Q	65.6	Low	64	Low	128 Å²	128	112.2 Å²	112.2	60%	0.598	57%	0.573	S	S	*	*	H	α-helix	trans	-69.8	-36.3	173	-73.5	173.8	-12.2	0	0	112.8	T815 A816 K817 A823	T815-Q819 WeakPolarHBondContact O-CG 3.24Å; T815-Q819 PolarHBondContact O-N 3.07Å; A816-Q819 PolarHBondContact O-N 3.4Å; K817-Q819 PolarHBondContact O-N 3.27Å; Q819-A823 WeakPolarHBondContact O-CB 3.45Å; Q819-A823 PolarHBondContact O-N 3.41Å
820	Q	55.8	Low	61.3	Low	137 Å²	137	116.6 Å²	116.6	64%	0.64	59%	0.591	S	S	*	*	H	α-helix	trans	-72.6	-38.1	176.6	-168.5	168.5	9.9	0	0	112.2	A816 K817 A823 L824	A816-Q820 WeakPolarHBondContact O-CB 3.19Å; A816-Q820 PolarHBondContact O-N 2.97Å; K817-Q820 CarbonylContact O-C 3.57Å; K817-Q820 WeakPolarHBondContact O-CA 3.45Å; K817-Q820 WeakPolarHBondContact O-CB 3.4Å; K817-Q820 PolarHBondContact O-N 3.07Å; Q820-A823 PolarHBondContact O-N 2.95Å; Q820-L824 PolarHBondContact O-N 3.46Å
821	D	55.1	Low	59.2	Low	94 Å²	94	120.1 Å²	120.1	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-67.8	-43.7	174	-59.7	-37	0	0	0	110.6	K817 A823 L824 D825	K817-D821 VanDerWaalsContact O-CG 3.25Å; K817-D821 PolarHBondContact O-N 3.31Å; D821-A823 VanDerWaalsContact C-N 3.27Å; D821-A823 PolarHBondContact O-N 3.23Å; D821-L824 WeakPolarHBondContact O-CB 3.4Å; D821-L824 PolarHBondContact O-N 3.17Å; D821-D825 PolarHBondContact O-N 3.25Å
822	Q	55.7	Low	56.8	Low	110 Å²	110	122 Å²	122	51%	0.514	63%	0.629	S	S	.	*	H	α-helix	trans	-65.5	-26.6	175.1	-76.2	174.7	-0.9	0	0	113.6	T818 L824 Q826	T818-Q822 HydrophobicContact CG2-CG 4.44Å; T818-Q822 VanDerWaalsContact O-CB 3.24Å; T818-Q822 WeakPolarHBondContact O-CB 3.48Å; T818-Q822 WeakPolarHBondContact O-CG 3.27Å; T818-Q822 PolarHBondContact O-N 3.09Å; Q822-L824 VanDerWaalsContact C-N 3.3Å; Q822-Q826 WeakPolarHBondContact O-CG 3.24Å; Q822-Q826 PolarHBondContact O-N 3.48Å
823	A	53	Low	54	Low	63 Å²	63	125.2 Å²	125.2	52%	0.521	64%	0.644	S	S	.	*	H	α-helix	trans	-73.4	-21.4	172.3	0	0	0	0	0	112.9	Q819 Q820 D821	Q819-A823 WeakPolarHBondContact O-CB 3.45Å; Q819-A823 PolarHBondContact O-N 3.41Å; Q820-A823 PolarHBondContact O-N 2.95Å; D821-A823 VanDerWaalsContact C-N 3.27Å; D821-A823 PolarHBondContact O-N 3.23Å
824	L	49.8	Very low	51.5	Low	125 Å²	125	127.6 Å²	127.6	65%	0.654	65%	0.652	S	S	*	*	H	α-helix	trans	-87.4	-34	174.3	-68.1	166.5	0	0	0	112	Q820 D821 Q822	Q820-L824 PolarHBondContact O-N 3.46Å; D821-L824 WeakPolarHBondContact O-CB 3.4Å; D821-L824 PolarHBondContact O-N 3.17Å; Q822-L824 VanDerWaalsContact C-N 3.3Å
825	D	45.8	Very low	49	Very low	126 Å²	126	128.8 Å²	128.8	67%	0.674	66%	0.661	S	S	*	*	H	α-helix	trans	-71.9	-25.1	174.4	-92.7	-12	0	0	0	113.3	D821 D827 Q828	D821-D825 PolarHBondContact O-N 3.25Å; D825-D827 VanDerWaalsContact C-N 3.31Å; D825-D827 PolarHBondContact O-N 3.22Å; D825-Q828 PolarHBondContact O-N 3.48Å; D825-Q828 VanDerWaalsContact O-O 3.12Å
826	Q	42.5	Very low	46.7	Very low	165 Å²	165	129.9 Å²	129.9	77%	0.771	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-16.7	-178.1	-85	-172.1	7.6	0	0	115.3	Q822 Q828	Q822-Q826 WeakPolarHBondContact O-CG 3.24Å; Q822-Q826 PolarHBondContact O-N 3.48Å; Q826-Q828 VanDerWaalsContact C-N 3.31Å
827	D	42.3	Very low	44.5	Very low	153 Å²	153	136.2 Å²	136.2	82%	0.818	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	1.6	174.9	-93.6	-16.4	0	0	0	113.3	D825	D825-D827 VanDerWaalsContact C-N 3.31Å; D825-D827 PolarHBondContact O-N 3.22Å
828	Q	44.1	Very low	42.3	Very low	152 Å²	152	137.7 Å²	137.7	71%	0.71	71%	0.711	S	S	*	*	S	Bend	trans	-132.7	127.9	176.7	-60.1	-168.8	29.3	0	0	112.2	D825 Q826	D825-Q828 PolarHBondContact O-N 3.48Å; D825-Q828 VanDerWaalsContact O-O 3.12Å; Q826-Q828 VanDerWaalsContact C-N 3.31Å
829	L	34.9	Very low	40.3	Very low	143 Å²	143	140 Å²	140	75%	0.749	73%	0.728	S	S	*	*			trans	90.4	113.7	-172.2	-54.2	159.8	0	0	0	112.3
830	F	32.6	Very low	38.4	Very low	184 Å²	184	143.3 Å²	143.3	81%	0.807	74%	0.741	S	S	*	*			cis	-160.6	180	27.6	-80.1	-77.1	0	0	0	110.1
831	P	41.7	Very low	37.1	Very low	116 Å²	116	142.4 Å²	142.4	75%	0.753	75%	0.75	S	S	*	*			cis	-128.3	170.3	-35.1	34.5	-18.7	0	0	0	112.9
832	Q	32.3	Very low	35.6	Very low	189 Å²	189	143.3 Å²	143.3	88%	0.883	76%	0.763	S	S	*	*			trans	-88.9	129	162.8	-72.6	-177.6	-37.8	0	0	111.7
833	Q	30.1	Very low	35.3	Very low	185 Å²	185	142.9 Å²	142.9	86%	0.864	77%	0.77	S	S	*	*				165.5	113.9	128.3	-94	-178.2	7.3	0	0	111.7
834	Q	27.8	Very low	34.1	Very low	169 Å²	169	149 Å²	149	79%	0.79	79%	0.785	S	S	*	*				-178.7	154.2	117.8	-102.5	-179.4	18	0	0	112.9
835	N	26.1	Very low	32.9	Very low	147 Å²	147	147.9 Å²	147.9	79%	0.786	79%	0.787	S	S	*	*			trans	62.9	120.8	161.2	-54.9	-19	0	0	0	118.9
836	A	30.4	Very low	32	Very low	96 Å²	96	147.8 Å²	147.8	79%	0.793	79%	0.791	S	S	*	*			trans	-90.4	142.3	155.9	0	0	0	0	0	109.3
837	E	27.6	Very low	31.2	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.864	78%	0.782	S	S	*	*			trans	-173.1	157.5	130.4	-109.6	-177.1	177.5	0	0	113.1
838	L	25.8	Very low	30.4	Very low	159 Å²	159	144.7 Å²	144.7	83%	0.832	78%	0.78	S	S	*	*			trans	60.9	120.2	160.1	-121.3	68.5	0	0	0	121.3
839	C	26.6	Very low	29.6	Very low	114 Å²	114	145.2 Å²	145.2	77%	0.77	78%	0.782	S	S	*	*			trans	-78.7	157.2	169.2	-39	0	0	0	0	112.9
840	K	27.6	Very low	29.2	Very low	198 Å²	198	143.7 Å²	143.7	86%	0.861	78%	0.779	S	S	*	*				-174.3	168	125.4	-101.2	152.6	-171.2	174.4	0	114.4
841	S	26.7	Very low	28.9	Very low	118 Å²	118	141.9 Å²	141.9	83%	0.825	78%	0.777	S	S	*	*			trans	60.4	88.5	167.3	54.8	0	0	0	0	120.1
842	S	24.7	Very low	28.1	Very low	113 Å²	113	145.8 Å²	145.8	79%	0.79	78%	0.783	S	S	*	*			trans	-69.9	-174.6	132.5	-24.4	0	0	0	0	109.8
843	P	48.3	Very low	27.8	Very low	101 Å²	101	143.4 Å²	143.4	66%	0.656	78%	0.776	S	S	*	*			cis	-145.7	-178.2	25	33.5	-7.4	0	0	0	119
844	F	28.5	Very low	27.7	Very low	191 Å²	191	138.7 Å²	138.7	84%	0.838	77%	0.769	S	S	*	*			trans	73.1	146.8	167.9	-64	-70.6	0	0	0	118
845	C	25.7	Very low	27.6	Very low	102 Å²	102	137.8 Å²	137.8	69%	0.689	78%	0.775	S	S	*	*			cis	-152.5	143	7.7	-140.5	0	0	0	0	113.7
846	V	25.7	Very low	27.7	Very low	124 Å²	124	140 Å²	140	75%	0.752	78%	0.781	S	S	*	*			trans	38.4	134.6	134.5	170.6	0	0	0	0	119.7
847	C	25.4	Very low	27.5	Very low	87 Å²	87	140.6 Å²	140.6	59%	0.588	79%	0.785	S	S	*	*			cis	-162.4	156.1	-7.2	-104.5	0	0	0	0	107.4
848	E	26	Very low	27.3	Very low	165 Å²	165	135.5 Å²	135.5	77%	0.771	78%	0.783	S	S	*	*				45.1	137.6	87.7	-65	168.6	150.5	0	0	114.6
849	E	28.4	Very low	27.4	Very low	164 Å²	164	132.9 Å²	132.9	77%	0.766	78%	0.784	S	S	*	*			cis	-151.9	-172.9	7.3	-123.4	-177.7	162	0	0	108.1
850	T	25.7	Very low	27.4	Very low	111 Å²	111	136.4 Å²	136.4	68%	0.681	79%	0.789	S	S	*	*			cis	-160.1	160.7	31.3	-23.3	0	0	0	0	111.1	F852	T850-F852 HydrophobicContact CG2-CD2 4.46Å
851	L	27	Very low	27.4	Very low	145 Å²	145	133.1 Å²	133.1	76%	0.759	79%	0.785	S	S	*	*			trans	-107.9	149.4	161.6	-166.4	92.4	0	0	0	109.1
852	F	24.3	Very low	27.3	Very low	199 Å²	199	136.3 Å²	136.3	87%	0.873	79%	0.787	S	S	*	*			trans	-143.4	148.3	162.5	-116.7	-81.9	0	0	0	112.6	T850	T850-F852 HydrophobicContact CG2-CD2 4.46Å
853	N	25.6	Very low	27.3	Very low	138 Å²	138	140 Å²	140	74%	0.738	79%	0.792	S	S	*	*			trans	-142.5	149	-167.9	-130	-7.1	0	0	0	111.1
854	A	28.2	Very low	26.2	Very low	87 Å²	87	139.8 Å²	139.8	72%	0.719	80%	0.798	S	S	*	*			trans	58.6	135.7	159.7	0	0	0	0	0	121.5
855	T	25.7	Very low	26.4	Very low	150 Å²	150	135.1 Å²	135.1	92%	0.92	81%	0.805	S	S	*	*			trans	-156.6	158.6	136.3	-4.3	0	0	0	0	109.2
856	E	27.1	Very low	26.5	Very low	194 Å²	194	134.5 Å²	134.5	91%	0.907	81%	0.807	S	S	*	*			trans	-106.3	-172.3	-159.6	-58.5	177.8	106.4	0	0	115.3
857	A	27.1	Very low	26.7	Very low	107 Å²	107	136.8 Å²	136.8	88%	0.884	81%	0.814	S	S	*	*			trans	88.9	136.7	173.7	0	0	0	0	0	117.1
858	G	23.6	Very low	26.8	Very low	79 Å²	79	140 Å²	140	81%	0.814	82%	0.824	S	S	*	*			cis	155.7	101.1	-8	0	0	0	0	0	113.5
859	A	26.9	Very low	27.2	Very low	104 Å²	104	142.1 Å²	142.1	86%	0.86	83%	0.83	S	S	*	*			trans	-158	150.1	168.9	0	0	0	0	0	110.5
860	E	26.7	Very low	27.5	Very low	187 Å²	187	140.1 Å²	140.1	87%	0.874	83%	0.829	S	S	*	*			trans	-81.1	161.3	-174.6	-63.3	154.8	142.6	0	0	110.9
861	V	27.2	Very low	27.7	Very low	129 Å²	129	144.8 Å²	144.8	78%	0.782	83%	0.834	S	S	*	*				-149.7	138.4	68.5	165.6	0	0	0	0	113
862	E	25.1	Very low	27.9	Very low	185 Å²	185	146.4 Å²	146.4	86%	0.864	84%	0.838	S	S	*	*			trans	24.5	131	160.3	-63.5	-172.5	117.9	0	0	123.3
863	Q	26	Very low	28.1	Very low	191 Å²	191	140.6 Å²	140.6	89%	0.893	83%	0.827	S	S	*	*			trans	-82.7	143	158.1	-56.6	168.7	-17.4	0	0	111
864	A	25.3	Very low	28.3	Very low	96 Å²	96	137 Å²	137	79%	0.793	82%	0.816	S	S	*	*			trans	-160.5	64.3	154.3	0	0	0	0	0	112.7	A866	A864-A866 PolarHBondContact O-N 2.76Å
865	G	31.8	Very low	28.5	Very low	94 Å²	94	138.2 Å²	138.2	97%	0.969	81%	0.814	S	S	*	*			trans	-74.3	63.8	176.7	0	0	0	0	0	114.1
866	A	28.4	Very low	28.8	Very low	89 Å²	89	137.5 Å²	137.5	74%	0.736	80%	0.804	S	S	*	*			trans	-149.9	156.7	177.9	0	0	0	0	0	113.8	A864	A864-A866 PolarHBondContact O-N 2.76Å
867	L	28.5	Very low	28.9	Very low	171 Å²	171	131.7 Å²	131.7	90%	0.895	79%	0.789	S	S	*	*			trans	68.3	55.9	163.2	-152.5	82.4	0	0	0	119.3
868	I	27.2	Very low	29.1	Very low	156 Å²	156	134.2 Å²	134.2	80%	0.8	78%	0.783	S	S	*	*			trans	-124.5	84.5	144.4	-53.4	-177.5	0	0	0	109.9
869	K	35.1	Very low	29.4	Very low	208 Å²	208	133.6 Å²	133.6	90%	0.904	77%	0.77	S	S	*	*			trans	-129.3	30.1	163.9	-144.5	-178.5	-174.5	-177.1	0	112.7
870	V	35.2	Very low	29.7	Very low	122 Å²	122	136 Å²	136	74%	0.739	76%	0.764	S	S	*	*			trans	-142.9	89	170.9	-175.6	0	0	0	0	109.2
871	R	29.4	Very low	29.8	Very low	210 Å²	210	130.8 Å²	130.8	79%	0.792	75%	0.752	S	S	*	*	S	Bend	trans	-151.2	11.4	162.7	-136.6	-178.4	177.7	173.1	0.7	117.8
872	E	30.6	Very low	29.9	Very low	179 Å²	179	129.2 Å²	129.2	84%	0.836	75%	0.747	S	S	*	*	S	Bend	trans	-101.8	-26.7	171.1	-69.1	-179.6	121.4	0	0	113	A874	E872-A874 VanDerWaalsContact C-N 3.33Å; E872-A874 PolarHBondContact O-N 3.17Å
873	A	30.5	Very low	30.1	Very low	77 Å²	77	125.1 Å²	125.1	64%	0.636	74%	0.739	S	S	*	*	H	α-helix	trans	-70.6	-24.4	178.2	0	0	0	0	0	114.3	V875	A873-V875 PolarHBondContact O-N 2.9Å
874	A	28.9	Very low	30.3	Very low	62 Å²	62	119.8 Å²	119.8	51%	0.512	73%	0.727	S	S	.	*	H	α-helix	trans	-79.9	-15.4	-171.2	0	0	0	0	0	114.7	E872	E872-A874 VanDerWaalsContact C-N 3.33Å; E872-A874 PolarHBondContact O-N 3.17Å
875	V	31.7	Very low	30.5	Very low	113 Å²	113	118.9 Å²	118.9	69%	0.685	72%	0.72	S	S	*	*	H	α-helix	trans	-90.4	-30.3	-176.7	-179.2	0	0	0	0	112	A873	A873-V875 PolarHBondContact O-N 2.9Å
876	L	32.6	Very low	30.5	Very low	134 Å²	134	125.6 Å²	125.6	70%	0.702	72%	0.716	S	S	*	*	H	α-helix	trans	-73.9	-40	178.6	-75.8	163.1	0	0	0	112.5	Q878 A879	L876-Q878 PolarHBondContact O-N 3.07Å; L876-Q878 VanDerWaalsContact O-N 3.08Å; L876-A879 PolarHBondContact O-N 2.75Å; L876-A879 VanDerWaalsContact O-N 3.17Å
877	A	29.7	Very low	30.5	Very low	73 Å²	73	129.4 Å²	129.4	60%	0.603	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-16.7	-178.4	0	0	0	0	0	114.6
878	Q	30.1	Very low	30.7	Very low	159 Å²	159	124.3 Å²	124.3	74%	0.743	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-7.5	-178.9	-146.9	164.8	23.9	0	0	113.6	L876	L876-Q878 PolarHBondContact O-N 3.07Å; L876-Q878 VanDerWaalsContact O-N 3.08Å
879	A	31.5	Very low	30.7	Very low	67 Å²	67	125.8 Å²	125.8	55%	0.554	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-39.9	175.2	0	0	0	0	0	112.6	L876 A881 S882	L876-A879 PolarHBondContact O-N 2.75Å; L876-A879 VanDerWaalsContact O-N 3.17Å; A879-A881 VanDerWaalsContact C-N 3.33Å; A879-A881 PolarHBondContact O-N 3.48Å; A879-S882 PolarHBondContact O-N 3.17Å
880	E	31.2	Very low	30.3	Very low	155 Å²	155	124 Å²	124	72%	0.724	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-71.4	-25.6	-174.4	-63.2	-172.5	130.3	0	0	113.3	S882 S883	E880-S882 PolarHBondContact O-N 3.06Å; E880-S882 VanDerWaalsContact O-N 3.14Å; E880-S883 PolarHBondContact O-N 3.45Å; E880-S883 PolarHBondContact O-OG 2.95Å
881	A	29.8	Very low	30	Very low	77 Å²	77	123.9 Å²	123.9	64%	0.636	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-64.4	-15.7	176.2	0	0	0	0	0	114.1	A879	A879-A881 VanDerWaalsContact C-N 3.33Å; A879-A881 PolarHBondContact O-N 3.48Å
882	S	29.2	Very low	29.9	Very low	95 Å²	95	119.5 Å²	119.5	66%	0.664	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-87.3	-14.4	-176.1	-64.1	0	0	0	0	115.1	A879 E880	A879-S882 PolarHBondContact O-N 3.17Å; E880-S882 PolarHBondContact O-N 3.06Å; E880-S882 VanDerWaalsContact O-N 3.14Å
883	S	30.4	Very low	29.7	Very low	100 Å²	100	115.7 Å²	115.7	70%	0.699	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-23.7	-178.5	63.7	0	0	0	0	113.8	E880 A885	E880-S883 PolarHBondContact O-N 3.45Å; E880-S883 PolarHBondContact O-OG 2.95Å; S883-A885 VanDerWaalsContact C-N 3.28Å; S883-A885 PolarHBondContact O-N 3.22Å
884	A	29.5	Very low	29.5	Very low	78 Å²	78	121.4 Å²	121.4	65%	0.645	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-73.3	-12	-173.1	0	0	0	0	0	115	W886	A884-W886 VanDerWaalsContact C-N 3.35Å; A884-W886 PolarHBondContact O-N 3.5Å
885	A	30.1	Very low	29.4	Very low	78 Å²	78	122.2 Å²	122.2	65%	0.645	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-79	-2.9	-165.3	0	0	0	0	0	116.4	S883	S883-A885 VanDerWaalsContact C-N 3.28Å; S883-A885 PolarHBondContact O-N 3.22Å
886	W	31.8	Very low	29.1	Very low	234 Å²	234	121.6 Å²	121.6	89%	0.886	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-121.3	2	-171.6	-77.5	85.3	0	0	0	116.4	A884 G888	A884-W886 VanDerWaalsContact C-N 3.35Å; A884-W886 PolarHBondContact O-N 3.5Å; W886-G888 PolarHBondContact O-N 2.83Å
887	N	28.1	Very low	28.9	Very low	170 Å²	170	119.8 Å²	119.8	91%	0.909	76%	0.759	S	S	*	*			trans	-82.9	52	169.2	-76.7	-16.7	0	0	0	111.3
888	G	31.1	Very low	28.7	Very low	63 Å²	63	120.7 Å²	120.7	65%	0.649	77%	0.767	S	S	*	*			trans	-127.8	0.5	-157.5	0	0	0	0	0	117.9	W886	W886-G888 PolarHBondContact O-N 2.83Å
889	M	27.6	Very low	28.5	Very low	188 Å²	188	121.1 Å²	121.1	93%	0.926	77%	0.773	S	S	*	*			trans	-169.5	113.9	164.9	-113	178.9	-169.6	0	0	112.8
890	L	26.6	Very low	28.3	Very low	170 Å²	170	122 Å²	122	89%	0.89	78%	0.779	S	S	*	*			trans	-154.6	133.3	155.3	-122.8	121.7	0	0	0	108.8
891	P	29	Very low	28.1	Very low	120 Å²	120	123.4 Å²	123.4	78%	0.779	79%	0.786	S	S	*	*			trans	-76.4	151.5	176.3	32	-34.2	0	0	0	111.3
892	S	27.7	Very low	27.8	Very low	117 Å²	117	127.5 Å²	127.5	82%	0.818	79%	0.792	S	S	*	*			trans	-71.9	143.9	176.9	-169.9	0	0	0	0	112.1
893	A	26.9	Very low	27.6	Very low	100 Å²	100	128.4 Å²	128.4	83%	0.826	80%	0.798	S	S	*	*			trans	-147.4	113.6	166.4	0	0	0	0	0	109.9
894	E	26.5	Very low	27.4	Very low	197 Å²	197	133 Å²	133	92%	0.921	80%	0.801	S	S	*	*			trans	-87.1	138.3	172.1	-59.3	173.6	119.1	0	0	109.4
895	G	26.8	Very low	27.1	Very low	78 Å²	78	136.2 Å²	136.2	80%	0.804	81%	0.808	S	S	*	*			trans	173.6	57.5	-176.2	0	0	0	0	0	119.6
896	A	25.8	Very low	27	Very low	100 Å²	100	143.2 Å²	143.2	83%	0.826	82%	0.819	S	S	*	*			trans	35.8	134.3	148.8	0	0	0	0	0	124.2
897	A	27.3	Very low	26.8	Very low	96 Å²	96	141.3 Å²	141.3	79%	0.793	82%	0.818	S	S	*	*			trans	84.8	102.3	136.7	0	0	0	0	0	122.8
898	A	26	Very low	26.6	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	81%	0.81	S	S	*	*				52.9	134	126.4	0	0	0	0	0	123.2
899	I	26.3	Very low	26.3	Very low	168 Å²	168	140.7 Å²	140.7	86%	0.862	82%	0.817	S	S	*	*				-174.2	142.3	109.6	-95.7	161.2	0	0	0	112.7
900	A	26.6	Very low	26.3	Very low	84 Å²	84	138.8 Å²	138.8	69%	0.694	81%	0.81	S	S	*	*			trans	29.1	129.4	160.3	0	0	0	0	0	123.4
901	E	27.3	Very low	26.3	Very low	185 Å²	185	138 Å²	138	86%	0.864	81%	0.807	S	S	*	*			trans	-73.6	146.3	149.8	-53.4	169.4	119.7	0	0	110.6
902	H	24.1	Very low	26.3	Very low	163 Å²	163	139 Å²	139	76%	0.755	81%	0.806	S	S	*	*			trans	-144	125.4	160.3	-102.6	27.6	0	0	0	111.5
903	S	24.5	Very low	26.3	Very low	115 Å²	115	142 Å²	142	80%	0.804	81%	0.807	S	S	*	*			trans	-89.8	143.5	176.7	-55.7	0	0	0	0	111.1
904	Y	25.9	Very low	26.2	Very low	195 Å²	195	140.6 Å²	140.6	77%	0.765	80%	0.802	S	S	*	*			trans	-117.1	109.1	172.3	-81.4	-82.9	0	0	0	111.8
905	N	24.2	Very low	26.4	Very low	146 Å²	146	140.6 Å²	140.6	78%	0.781	80%	0.802	S	S	*	*			trans	-82.2	146.8	157.4	-69.9	-32.4	0	0	0	108.8
906	Y	26.5	Very low	26.4	Very low	225 Å²	225	142.5 Å²	142.5	88%	0.882	79%	0.793	S	S	*	*			trans	-109.7	143.9	162.7	-103.2	-90.8	0	0	0	110.4
907	F	28.1	Very low	26.5	Very low	195 Å²	195	147.2 Å²	147.2	86%	0.855	79%	0.79	S	S	*	*			trans	-100.6	157.3	-171.6	-116.4	-94.4	0	0	0	112.4
908	S	23.1	Very low	26.4	Very low	107 Å²	107	148.3 Å²	148.3	75%	0.748	79%	0.787	S	S	*	*			trans	-63.5	150.8	167.5	-179.6	0	0	0	0	111.5
909	S	26.3	Very low	26.3	Very low	113 Å²	113	152.1 Å²	152.1	79%	0.79	79%	0.789	S	S	*	*			trans	-121	138.9	167.1	-176.6	0	0	0	0	108.8
910	N	26.1	Very low	26.2	Very low	148 Å²	148	152.5 Å²	152.5	79%	0.791	79%	0.789	S	S	*	*			trans	-143.5	148.2	171.1	-146.5	-11.7	0	0	0	109
911	N	27.7	Very low	26.1	Very low	153 Å²	153	159.8 Å²	159.8	82%	0.818	80%	0.798	S	S	*	*			trans	-69.3	147.8	-171.2	-56.3	-58.9	0	0	0	112.3
912	D	28.1	Very low	26	Very low	142 Å²	142	159.2 Å²	159.2	76%	0.759	80%	0.795	S	S	*	*				-161.1	176.8	109.3	-148.1	-9	0	0	0	112.5
913	H	28.2	Very low	26	Very low	179 Å²	179	158.9 Å²	158.9	83%	0.829	80%	0.796	S	S	*	*			trans	103.8	101.9	165.1	-58.6	-40.5	0	0	0	116.8
914	G	26	Very low	26.1	Very low	70 Å²	70	157.2 Å²	157.2	72%	0.722	78%	0.784	S	S	*	*			trans	-106.7	131.1	142.9	0	0	0	0	0	110.1
915	E	28.8	Very low	26.1	Very low	198 Å²	198	155.8 Å²	155.8	93%	0.925	79%	0.785	S	S	*	*				-160.8	141.2	121.8	-113.5	-178.8	-173.9	0	0	113.4
916	D	28.6	Very low	26.2	Very low	117 Å²	117	154.1 Å²	154.1	63%	0.626	78%	0.779	S	S	*	*			trans	42.9	119.6	155.6	-127.6	20.7	0	0	0	123.7
917	R	27	Very low	26.2	Very low	200 Å²	200	148.9 Å²	148.9	76%	0.755	77%	0.771	S	S	*	*				87.6	112.2	123	-105.1	-177.5	-161.8	139.3	-7.1	124.6
918	T	24.6	Very low	26.3	Very low	118 Å²	118	152.8 Å²	152.8	72%	0.724	79%	0.788	S	S	*	*				90.6	143.9	127.5	19.9	0	0	0	0	123.9
919	Q	25.6	Very low	26.5	Very low	174 Å²	174	155.1 Å²	155.1	81%	0.813	79%	0.79	S	S	*	*			trans	80.1	95	154.3	-71.5	-178.3	16.3	0	0	121.3
920	M	23.6	Very low	26.5	Very low	176 Å²	176	157.3 Å²	157.3	87%	0.867	79%	0.79	S	S	*	*				30	115.6	121	-71.7	-174.2	162.2	0	0	119.4
921	R	24.9	Very low	26.5	Very low	237 Å²	237	157.8 Å²	157.8	89%	0.894	79%	0.79	S	S	*	*				-175.2	159.9	95.3	-104.5	178.2	177.5	175.3	-0.9	114.6
922	H	24.6	Very low	26.5	Very low	172 Å²	172	158.1 Å²	158.1	80%	0.796	79%	0.788	S	S	*	*			trans	-32.3	157.7	151.7	-74.8	-96.3	0	0	0	114.3
923	M	25	Very low	26.4	Very low	156 Å²	156	159.1 Å²	159.1	77%	0.768	79%	0.79	S	S	*	*			cis	-171.1	161.9	37.9	-143.4	167	82.4	0	0	111.8
924	S	26.2	Very low	26.2	Very low	80 Å²	80	157.7 Å²	157.7	56%	0.559	79%	0.788	S	S	*	*			trans	57.2	159.7	145.4	-74	0	0	0	0	120.5
925	E	25.6	Very low	26.3	Very low	165 Å²	165	164 Å²	164	77%	0.771	79%	0.792	S	S	*	*			cis	-178	173.3	-31.3	-127.1	167.2	139.3	0	0	108.7
926	V	25.3	Very low	26.1	Very low	111 Å²	111	161.4 Å²	161.4	67%	0.673	78%	0.782	S	S	*	*			trans	68.8	103.7	148.4	169.1	0	0	0	0	120
927	T	26.1	Very low	25.9	Very low	115 Å²	115	165.1 Å²	165.1	71%	0.706	80%	0.795	S	S	*	*			trans	62.6	151.3	146	61.2	0	0	0	0	120.2
928	F	31.8	Very low	25.8	Very low	277 Å²	277	161.9 Å²	161.9	100%	1.215	80%	0.799	S	S	*	*			cis	-109.8	0	9.6	-95.9	-104.4	0	0	0	113.5

Retrieved 928 of 928 residues in 2036.4 ms (Link to these results)

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