A0A096NS77_PAPAN Loading...

Transmembrane protein 63C

AlphaFold DB (A0A2K6BEJ5), UniProt , Accession A0A096NS77, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM63C, Length 806 aa.

						>A0A096NS77_PAPAN|A0A096NS77|TMEM63C
MSASPEELSTGGRLKNMTVDECFQSRSTVLQGQPFGGVPTVLCLNIALWVLVLVVYSFLRKAAWDYGRLALLIHNDSLTSLIYGEQSEKTSPSETSLEMERRDKGFCSWFFNSITMKDEDLINKCGDDARIYIVFQYHLIIFVLIICIPSLGIILPINYTGSVLDWSSHFARTTIVNVSTESKLLWLHSLLSFFYFITNFVFMAHHCLRFAPRNSQKVTRTLMITYVPKDIEDPEIIIKHFHEAYPGSVVTRVHFCYDVRNLIDLDDQRRHAMRGRLFYTAKAKKTGKVMIRIHPCARLCFCKCWTCFKEVDAEQYYSELEEQLTDEFNAELNRVPLKRLDLIFVTFQDSRMAKRVRKDYKYIHCGVQPQQSSVTTIVKSYYWRVTMAPHPKDIIWKHLSVRRFFWWARFIAINTFLFFLFFFLTTPAIIMNTIDMYNVTRPIEKLQSPIVTQFFPSVMLWGFTVILPLIVYFSAFLEAHWTRSSQNLVMVHKCYIFLVFMVVILPSMGLTSLDVFLRWLFDIYYLEQASIRFQCVFLPDNGAFFVNYVITAALLGTGMELLRLGSLFCYSTRLFFSRSEPERVNIRKNQAIDFQFGREYAWMMNVFSVVMAYSITCPIIVPFGLLYLCMKHLTDRYNMYYSFAPTKLNEQIHMAAVSQAIFAPLLGLFWMLFFSLLRLGSLHAITMFSLSTLLIAMLIAFAGIFLGKLRMVADYEPEEEEIQTVFDMEPSSTSSTPTSLLYVATVLQEPELNLTPASSPARHTYGTMNNQPEEGEEESGLRGFARELDSAQFQEGLELEGQNQYH
					

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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	35.9	Very low	27.3	Very low	248 Å²	248	139.5 Å²	139.5	100%	1.222	84%	0.843	S	S	*	*				0	109.1	0	-84.1	169.7	164.9	0	0	107.2
2	S	31.9	Very low	27.1	Very low	127 Å²	127	134.3 Å²	134.3	89%	0.888	84%	0.838	S	S	*	*			trans	-72.7	133.7	-175.7	45.8	0	0	0	0	111.8
3	A	26.3	Very low	26.9	Very low	102 Å²	102	142.4 Å²	142.4	84%	0.843	84%	0.843	S	S	*	*			trans	-138.8	120.9	154	0	0	0	0	0	108.2
4	S	25.9	Very low	27.1	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	83%	0.833	S	S	*	*			trans	-73	160.5	-178.7	41.5	0	0	0	0	112.7
5	P	32.7	Very low	27.4	Very low	128 Å²	128	145.5 Å²	145.5	83%	0.831	84%	0.835	S	S	*	*			trans	-95.1	116.4	174.4	34.1	-24.1	0	0	0	110.4
6	E	25.2	Very low	28.1	Very low	172 Å²	172	144.3 Å²	144.3	80%	0.804	83%	0.825	S	S	*	*			trans	-133.2	111.8	167.5	-90.6	-178.9	171	0	0	111.3
7	E	25.3	Very low	29	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	80%	0.798	S	S	*	*			trans	64.5	92.7	135	-59.4	-167.6	157	0	0	120.4	S9	E7-S9 PolarHBondContact O-N 3.03Å; E7-S9 VanDerWaalsContact O-N 3.12Å
8	L	25.6	Very low	30.1	Very low	181 Å²	181	136.7 Å²	136.7	95%	0.948	78%	0.78	S	S	*	*			trans	-62.4	88.3	149.1	-165.1	86	0	0	0	110.4
9	S	23.4	Very low	31.1	Very low	92 Å²	92	132.8 Å²	132.8	64%	0.643	76%	0.759	S	S	*	*			trans	-141	71.6	164.2	79.3	0	0	0	0	112.3	E7 G11	E7-S9 PolarHBondContact O-N 3.03Å; E7-S9 VanDerWaalsContact O-N 3.12Å; S9-G11 PolarHBondContact O-N 3.25Å
10	T	25.1	Very low	31.8	Very low	147 Å²	147	132.1 Å²	132.1	90%	0.902	75%	0.753	S	S	*	*			trans	-79.8	62.3	164.2	49.2	0	0	0	0	110.4
11	G	23	Very low	32.5	Very low	66 Å²	66	130.8 Å²	130.8	68%	0.68	74%	0.74	S	S	*	*			trans	-90.3	89.2	156	0	0	0	0	0	107.3	S9 R13	S9-G11 PolarHBondContact O-N 3.25Å; G11-R13 PolarHBondContact O-N 3.47Å
12	G	25.1	Very low	33.1	Very low	76 Å²	76	119 Å²	119	78%	0.784	68%	0.682	S	S	*	*			trans	-59.5	103.2	174.2	0	0	0	0	0	109.5	L14	G12-L14 PolarHBondContact O-N 3.22Å; G12-L14 VanDerWaalsContact O-N 3.1Å
13	R	25.1	Very low	33.9	Very low	240 Å²	240	115.7 Å²	115.7	91%	0.906	65%	0.652	S	S	*	*			trans	-49.4	117.9	165	-89.2	-178.7	-178.2	-178.2	1.1	107.8	G11 K15	G11-R13 PolarHBondContact O-N 3.47Å; R13-K15 PolarHBondContact O-N 3.36Å
14	L	28.6	Very low	34.6	Very low	134 Å²	134	117.3 Å²	117.3	70%	0.702	64%	0.642	S	S	*	*			trans	-49.3	110	161.8	-130.5	86.1	0	0	0	106.7	G12 N16	G12-L14 PolarHBondContact O-N 3.22Å; G12-L14 VanDerWaalsContact O-N 3.1Å; L14-N16 PolarHBondContact O-N 2.97Å
15	K	32.5	Very low	35.2	Very low	198 Å²	198	115.1 Å²	115.1	86%	0.861	63%	0.626	S	S	*	*			trans	-61.8	122.8	167.1	-91.5	-178.7	172.7	-177.9	0	106.7	R13 M17	R13-K15 PolarHBondContact O-N 3.36Å; K15-M17 PolarHBondContact O-N 3.02Å
16	N	38.4	Very low	35.7	Very low	125 Å²	125	115.3 Å²	115.3	67%	0.668	61%	0.611	S	S	*	*			trans	-63.6	99.3	167.4	-76.2	-13.9	0	0	0	107.6	L14 T18	L14-N16 PolarHBondContact O-N 2.97Å; N16-T18 PolarHBondContact O-N 3.35Å
17	M	42.8	Very low	36.5	Very low	77 Å²	77	109.1 Å²	109.1	38%	0.379	59%	0.586	S	S	.	*			trans	-64.9	126.5	172.5	-168.4	161.7	69.1	0	0	108.1	K15 E21 C22	K15-M17 PolarHBondContact O-N 3.02Å; M17-E21 HydrophobicContact CG-CB 3.82Å; M17-C22 HydrophobicContact CE-CB 4.22Å
18	T	48.3	Very low	37.1	Very low	76 Å²	76	106.7 Å²	106.7	47%	0.466	58%	0.583	S	S	.	*			trans	-75.9	158	177.6	57.4	0	0	0	0	110.4	N16 D20 E21 C22	N16-T18 PolarHBondContact O-N 3.35Å; T18-D20 PolarHBondContact O-N 3.38Å; T18-E21 PolarHBondContact N-OE2 2.84Å; T18-E21 PolarHBondContact O-N 3.11Å; T18-E21 VanDerWaalsContact O-N 3.12Å; T18-E21 WeakPolarHBondContact OG1-CG 3.2Å; T18-C22 PolarHBondContact O-N 2.97Å; T18-C22 VanDerWaalsContact O-N 3.09Å
19	V	49.6	Very low	37.7	Very low	63 Å²	63	103.6 Å²	103.6	38%	0.382	57%	0.571	S	S	.	*	H	α-helix	trans	-57.2	-35.1	179.7	176.2	0	0	0	0	111.3	C22 F23	V19-C22 WeakPolarHBondContact O-CB 3.44Å; V19-C22 PolarHBondContact O-N 3.48Å; V19-F23 HydrophobicContact CG1-CD2 3.99Å; V19-F23 HydrophobicContact CG1-CE2 3.58Å; V19-F23 WeakPolarHBondContact O-CD2 3.31Å; V19-F23 PolarHBondContact O-N 3.2Å
20	D	45.6	Very low	38.6	Very low	118 Å²	118	101.6 Å²	101.6	63%	0.631	55%	0.553	S	S	*	*	H	α-helix	trans	-70.6	-37.6	177.6	-61.9	-37.1	0	0	0	112.8	T18 C22 F23 Q24	T18-D20 PolarHBondContact O-N 3.38Å; D20-C22 VanDerWaalsContact C-N 3.31Å; D20-C22 PolarHBondContact O-N 3.37Å; D20-F23 PolarHBondContact O-N 2.78Å; D20-Q24 WeakPolarHBondContact O-CG 3.37Å; D20-Q24 PolarHBondContact O-N 2.89Å
21	E	46.6	Very low	39.4	Very low	105 Å²	105	100.8 Å²	100.8	49%	0.491	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-31.8	174	-74.6	176.2	163.1	0	0	112.1	M17 T18 Q24 S25	M17-E21 HydrophobicContact CG-CB 3.82Å; T18-E21 PolarHBondContact N-OE2 2.84Å; T18-E21 PolarHBondContact O-N 3.11Å; T18-E21 VanDerWaalsContact O-N 3.12Å; T18-E21 WeakPolarHBondContact OG1-CG 3.2Å; E21-Q24 PolarHBondContact O-N 2.08Å; E21-S25 WeakPolarHBondContact O-CB 3.44Å; E21-S25 PolarHBondContact O-N 3.46Å
22	C	48.7	Very low	40.7	Very low	1 Å²	1	101 Å²	101	1%	0.007	54%	0.542	C	S	.	.	H	α-helix	trans	-66.1	-41.2	174.6	161.8	0	0	0	0	112.9	M17 T18 V19 D20 Q24 S25 C535	M17-C22 HydrophobicContact CE-CB 4.22Å; T18-C22 PolarHBondContact O-N 2.97Å; T18-C22 VanDerWaalsContact O-N 3.09Å; V19-C22 WeakPolarHBondContact O-CB 3.44Å; V19-C22 PolarHBondContact O-N 3.48Å; D20-C22 VanDerWaalsContact C-N 3.31Å; D20-C22 PolarHBondContact O-N 3.37Å; C22-Q24 VanDerWaalsContact C-N 3.29Å; C22-Q24 PolarHBondContact O-N 2.96Å; C22-S25 PolarHBondContact O-N 2.84Å; C22-C535 HydrophobicContact CB-CB 4.45Å; C22-C535 WeakPolarHBondContact CB-SG 3.45Å; C22-C535 WeakPolarHBondContact SG-CA 3.44Å; C22-C535 WeakPolarHBondContact SG-CB 3.2Å; C22-C535 CovalentContact SG-SG 2.01Å; C22-C535 PolarHBondContact SG-SG 3.42Å
23	F	47.5	Very low	42.1	Very low	57 Å²	57	101.8 Å²	101.8	25%	0.25	53%	0.525	C	S	.	.	H	α-helix	trans	-73.6	-19.7	175.6	-73.3	-66	0	0	0	113.3	V19 D20 V176	V19-F23 HydrophobicContact CG1-CD2 3.99Å; V19-F23 HydrophobicContact CG1-CE2 3.58Å; V19-F23 WeakPolarHBondContact O-CD2 3.31Å; V19-F23 PolarHBondContact O-N 3.2Å; D20-F23 PolarHBondContact O-N 2.78Å; F23-V176 HydrophobicContact CD1-CG1 4.08Å; F23-V176 HydrophobicContact CE1-CG1 3.48Å; F23-V176 VanDerWaalsContact CE1-CG1 3.48Å; F23-V176 HydrophobicContact CZ-CG1 4.3Å
24	Q	41.8	Very low	43.9	Very low	135 Å²	135	94.5 Å²	94.5	63%	0.631	51%	0.509	S	S	*	.	H	α-helix	trans	-89.5	-18.7	174.3	-70.9	-179.3	-8.5	0	0	113.7	D20 E21 C22 R26	D20-Q24 WeakPolarHBondContact O-CG 3.37Å; D20-Q24 PolarHBondContact O-N 2.89Å; E21-Q24 PolarHBondContact O-N 2.08Å; C22-Q24 VanDerWaalsContact C-N 3.29Å; C22-Q24 PolarHBondContact O-N 2.96Å; Q24-R26 PolarHBondContact O-N 3.32Å
25	S	39.4	Very low	46	Very low	58 Å²	58	91 Å²	91	41%	0.406	49%	0.488	S	S	.	.			trans	-66.2	91.8	175.3	158.7	0	0	0	0	111.2	E21 C22 L538	E21-S25 WeakPolarHBondContact O-CB 3.44Å; E21-S25 PolarHBondContact O-N 3.46Å; C22-S25 PolarHBondContact O-N 2.84Å; S25-L538 WeakPolarHBondContact O-CD2 3.42Å
26	R	43.3	Very low	47.5	Very low	133 Å²	133	82.3 Å²	82.3	50%	0.502	45%	0.454	S	S	.	.			trans	-73.3	140.6	172.9	-71	-180	173.4	-179.9	-3.6	111.4	Q24 T28 S167	Q24-R26 PolarHBondContact O-N 3.32Å; R26-T28 PolarHBondContact O-N 2.97Å; R26-S167 PolarHBondContact NH2-O 3.33Å
27	S	40.7	Very low	49.1	Very low	41 Å²	41	76.4 Å²	76.4	29%	0.287	42%	0.423	S	S	.	.			trans	-56.9	130.7	166.7	56.3	0	0	0	0	111	V29 L30 D540	S27-V29 PolarHBondContact O-N 3.45Å; S27-L30 PolarHBondContact O-N 3.12Å; S27-D540 WeakPolarHBondContact CB-OD2 3.3Å; S27-D540 PolarHBondContact N-OD2 2.94Å; S27-D540 PolarHBondContact OG-OD2 3.47Å
28	T	37.3	Very low	50.9	Low	117 Å²	117	73 Å²	73	72%	0.718	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.6	-177	49.2	0	0	0	0	113.6	R26	R26-T28 PolarHBondContact O-N 2.97Å
29	V	38.3	Very low	52.7	Low	116 Å²	116	72.4 Å²	72.4	70%	0.703	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-25.7	-175.5	-178.8	0	0	0	0	112.9	S27	S27-V29 PolarHBondContact O-N 3.45Å
30	L	42.7	Very low	54.1	Low	50 Å²	50	72.4 Å²	72.4	26%	0.262	40%	0.404	S	S	.	.	S	Bend	trans	-110	10.7	179.6	-66.9	170.7	0	0	0	112.6	S27 G32 Q33	S27-L30 PolarHBondContact O-N 3.12Å; L30-G32 PolarHBondContact O-N 2.83Å; L30-G32 VanDerWaalsContact O-N 3.11Å; L30-Q33 PolarHBondContact O-N 2.9Å
31	Q	41.3	Very low	55.7	Low	130 Å²	130	68.6 Å²	68.6	61%	0.607	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	112.7	-176.4	-134.1	173.2	-0.6	0	0	110.2
32	G	50.4	Low	57.6	Low	72 Å²	72	65.6 Å²	65.6	74%	0.742	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.4	-5.3	175.1	0	0	0	0	0	116.3	L30	L30-G32 PolarHBondContact O-N 2.83Å; L30-G32 VanDerWaalsContact O-N 3.11Å
33	Q	54.8	Low	59.4	Low	91 Å²	91	69.8 Å²	69.8	43%	0.425	40%	0.4	S	S	.	.			trans	-96.7	131.9	177.5	-69.4	-95.9	-39.3	0	0	111.4	L30 T40	L30-Q33 PolarHBondContact O-N 2.9Å; Q33-T40 PolarHBondContact OE1-OG1 3.19Å
34	P	63.7	Low	61.2	Low	87 Å²	87	71.6 Å²	71.6	57%	0.565	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-63.5	142.8	174.6	26.7	-32.8	0	0	0	110.8	G36 G37	P34-G36 PolarHBondContact O-N 3.46Å; P34-G37 PolarHBondContact O-N 3.04Å
35	F	72.2	Confident	63.4	Low	62 Å²	62	65.4 Å²	65.4	27%	0.272	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	55.5	40	174.6	-157.5	-101.6	0	0	0	115	G37 V38 P39 H169 F170 T173 I619	F35-G37 PolarHBondContact O-N 3.49Å; F35-V38 HydrophobicContact CD1-CB 4.07Å; F35-V38 HydrophobicContact CD1-CG2 4.41Å; F35-V38 HydrophobicContact CE1-CB 4.47Å; F35-V38 PolarHBondContact O-N 2.91Å; F35-P39 HydrophobicContact CB-CG 4.42Å; F35-P39 HydrophobicContact CD1-CG 4.44Å; F35-H169 HydrophobicContact CD2-CB 3.93Å; F35-F170 AromaticContact CD1-CD2 3.81Å; F35-F170 HydrophobicContact CD1-CD2 3.81Å; F35-F170 HydrophobicContact CD2-CB 4.14Å; F35-F170 HydrophobicContact CD2-CD2 4.47Å; F35-F170 AromaticContact CE1-CD2 3.58Å; F35-F170 HydrophobicContact CE1-CD2 3.58Å; F35-F170 HydrophobicContact CE1-CE2 4.1Å; F35-F170 HydrophobicContact CE2-CB 4.37Å; F35-F170 HydrophobicContact CE2-CD2 4.28Å; F35-F170 HydrophobicContact CG-CB 4.29Å; F35-F170 HydrophobicContact CG-CD2 4.26Å; F35-F170 AromaticContact CZ-CD2 3.83Å; F35-F170 HydrophobicContact CZ-CD2 3.83Å; F35-F170 HydrophobicContact CZ-CE2 4.44Å; F35-T173 HydrophobicContact CE2-CG2 3.89Å; F35-T173 HydrophobicContact CZ-CG2 3.99Å; F35-I619 HydrophobicContact CE1-CD1 4.22Å; F35-I619 HydrophobicContact CZ-CD1 3.63Å
36	G	65.3	Low	65.9	Low	14 Å²	14	66.2 Å²	66.2	14%	0.144	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	66.3	18.7	176.9	0	0	0	0	0	114.2	P34 V38 N547	P34-G36 PolarHBondContact O-N 3.46Å; G36-V38 PolarHBondContact O-N 2.73Å; G36-N547 PolarHBondContact O-ND2 3.11Å
37	G	72	Confident	68.1	Low	1 Å²	1	62.9 Å²	62.9	1%	0.01	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	76.5	0.2	-179.7	0	0	0	0	0	115.1	P34 F35 T40 V41	P34-G37 PolarHBondContact O-N 3.04Å; F35-G37 PolarHBondContact O-N 3.49Å; G37-T40 PolarHBondContact O-N 2.93Å; G37-V41 WeakPolarHBondContact O-CB 3.35Å; G37-V41 VanDerWaalsContact O-CG2 3.28Å; G37-V41 WeakPolarHBondContact O-CG2 3.32Å; G37-V41 PolarHBondContact O-N 3.13Å
38	V	80.4	Confident	70.4	Confident	6 Å²	6	64 Å²	64	4%	0.036	39%	0.386	C	S	.	.	H	α-helix	trans	-56.3	-47.7	-174.7	177.8	0	0	0	0	113.3	F35 G36 T40 V41 L42 F170 V546 N547 I550 F623	F35-V38 HydrophobicContact CD1-CB 4.07Å; F35-V38 HydrophobicContact CD1-CG2 4.41Å; F35-V38 HydrophobicContact CE1-CB 4.47Å; F35-V38 PolarHBondContact O-N 2.91Å; G36-V38 PolarHBondContact O-N 2.73Å; V38-T40 PolarHBondContact O-N 3.47Å; V38-V41 PolarHBondContact O-N 2.7Å; V38-L42 VanDerWaalsContact O-CB 3.25Å; V38-L42 WeakPolarHBondContact O-CB 3.2Å; V38-L42 PolarHBondContact O-N 3.48Å; V38-F170 HydrophobicContact CG2-CD2 4.22Å; V38-F170 HydrophobicContact CG2-CE2 3.97Å; V38-V546 HydrophobicContact CG1-CG1 3.81Å; V38-V546 HydrophobicContact CG2-CB 4.42Å; V38-V546 HydrophobicContact CG2-CG1 3.96Å; V38-N547 WeakPolarHBondContact CA-OD1 3.29Å; V38-I550 HydrophobicContact CG1-CD1 3.72Å; V38-F623 HydrophobicContact CG1-CE2 4.36Å; V38-F623 HydrophobicContact CG1-CZ 4.46Å
39	P	85.4	Confident	72.9	Confident	64 Å²	64	60.9 Å²	60.9	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-64.4	-41.1	178.6	-21.2	34.8	0	0	0	112.4	F35 L42 C43	F35-P39 HydrophobicContact CB-CG 4.42Å; F35-P39 HydrophobicContact CD1-CG 4.44Å; P39-L42 PolarHBondContact O-N 3.13Å; P39-C43 PolarHBondContact O-N 3.49Å; P39-C43 PolarHBondContact O-SG 3.32Å; P39-C43 VanDerWaalsContact O-SG 3.36Å
40	T	78.4	Confident	75.4	Confident	63 Å²	63	58.8 Å²	58.8	39%	0.387	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-48.7	177.6	-48.1	0	0	0	0	111.2	Q33 G37 V38 L42 C43 L44	Q33-T40 PolarHBondContact OE1-OG1 3.19Å; G37-T40 PolarHBondContact O-N 2.93Å; V38-T40 PolarHBondContact O-N 3.47Å; T40-L42 VanDerWaalsContact C-N 3.32Å; T40-L42 PolarHBondContact O-N 3.29Å; T40-C43 PolarHBondContact O-N 2.98Å; T40-L44 WeakPolarHBondContact O-CB 3.07Å; T40-L44 PolarHBondContact O-N 2.66Å
41	V	80.1	Confident	77.7	Confident	37 Å²	37	61.1 Å²	61.1	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-41.1	178.2	171.3	0	0	0	0	110.3	G37 V38 N45 N547	G37-V41 WeakPolarHBondContact O-CB 3.35Å; G37-V41 VanDerWaalsContact O-CG2 3.28Å; G37-V41 WeakPolarHBondContact O-CG2 3.32Å; G37-V41 PolarHBondContact O-N 3.13Å; V38-V41 PolarHBondContact O-N 2.7Å; V41-N45 WeakPolarHBondContact CG1-ND2 3.31Å; V41-N45 VanDerWaalsContact O-CB 3.27Å; V41-N45 WeakPolarHBondContact O-CB 3.41Å; V41-N45 PolarHBondContact O-N 2.63Å; V41-N45 PolarHBondContact O-ND2 3.45Å; V41-N547 WeakPolarHBondContact CB-OD1 2.97Å; V41-N547 HydrophobicContact CG1-CB 4.08Å
42	L	86	Confident	80	Confident	43 Å²	43	55.8 Å²	55.8	23%	0.225	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-51.8	175.7	-179	63.5	0	0	0	111.7	V38 P39 T40 L44 N45 I46 I550 L554 F623	V38-L42 VanDerWaalsContact O-CB 3.25Å; V38-L42 WeakPolarHBondContact O-CB 3.2Å; V38-L42 PolarHBondContact O-N 3.48Å; P39-L42 PolarHBondContact O-N 3.13Å; T40-L42 VanDerWaalsContact C-N 3.32Å; T40-L42 PolarHBondContact O-N 3.29Å; L42-L44 VanDerWaalsContact C-N 3.33Å; L42-L44 PolarHBondContact O-N 2.74Å; L42-N45 PolarHBondContact O-N 2.96Å; L42-I46 HydrophobicContact CD1-CD1 4Å; L42-I46 HydrophobicContact CD1-CG1 4.31Å; L42-I46 HydrophobicContact CG-CD1 3.91Å; L42-I46 VanDerWaalsContact O-CG1 3.27Å; L42-I46 WeakPolarHBondContact O-CG1 3.32Å; L42-I46 PolarHBondContact O-N 3.34Å; L42-I550 HydrophobicContact CB-CD1 4.47Å; L42-I550 HydrophobicContact CB-CG2 4.43Å; L42-I550 HydrophobicContact CD1-CG2 3.8Å; L42-L554 HydrophobicContact CD1-CD1 4.14Å; L42-F623 HydrophobicContact CD1-CE1 4.1Å; L42-F623 HydrophobicContact CD2-CE1 4.16Å; L42-F623 HydrophobicContact CD2-CZ 4.39Å
43	C	87.3	Confident	81.8	Confident	88 Å²	88	53.6 Å²	53.6	60%	0.595	31%	0.308	S	S	*	.	H	α-helix	trans	-59.2	-44.1	178.5	-71.8	0	0	0	0	112	P39 T40 I46 A47	P39-C43 PolarHBondContact O-N 3.49Å; P39-C43 PolarHBondContact O-SG 3.32Å; P39-C43 VanDerWaalsContact O-SG 3.36Å; T40-C43 PolarHBondContact O-N 2.98Å; C43-I46 PolarHBondContact O-N 3.03Å; C43-A47 WeakPolarHBondContact O-CB 3.47Å; C43-A47 PolarHBondContact O-N 3.05Å
44	L	85	Confident	83.4	Confident	95 Å²	95	52.6 Å²	52.6	50%	0.497	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-45.6	177.9	-173.9	155	0	0	0	111.3	T40 L42 I46 A47 L48	T40-L44 WeakPolarHBondContact O-CB 3.07Å; T40-L44 PolarHBondContact O-N 2.66Å; L42-L44 VanDerWaalsContact C-N 3.33Å; L42-L44 PolarHBondContact O-N 2.74Å; L44-I46 VanDerWaalsContact C-N 3.34Å; L44-I46 PolarHBondContact O-N 3.45Å; L44-A47 PolarHBondContact O-N 3.11Å; L44-L48 HydrophobicContact CD2-CD1 3.4Å; L44-L48 VanDerWaalsContact CD2-CD1 3.4Å; L44-L48 HydrophobicContact CD2-CG 4.02Å; L44-L48 HydrophobicContact CG-CD1 4.48Å; L44-L48 WeakPolarHBondContact O-CG 3.47Å; L44-L48 PolarHBondContact O-N 3.33Å
45	N	86.8	Confident	84.5	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.027	30%	0.298	C	S	.	.	H	α-helix	trans	-64.9	-36.5	177.7	-85.9	-82.1	0	0	0	112.2	V41 L42 W49 I550 T551 L554 L555	V41-N45 WeakPolarHBondContact CG1-ND2 3.31Å; V41-N45 VanDerWaalsContact O-CB 3.27Å; V41-N45 WeakPolarHBondContact O-CB 3.41Å; V41-N45 PolarHBondContact O-N 2.63Å; V41-N45 PolarHBondContact O-ND2 3.45Å; L42-N45 PolarHBondContact O-N 2.96Å; N45-W49 WeakPolarHBondContact O-CB 3.39Å; N45-W49 PolarHBondContact O-N 2.92Å; N45-I550 HydrophobicContact CB-CG2 4.19Å; N45-T551 PolarHBondContact ND2-OG1 3.02Å; N45-T551 WeakPolarHBondContact OD1-CA 3.19Å; N45-L554 HydrophobicContact CB-CB 4.16Å; N45-L554 HydrophobicContact CB-CD1 3.71Å; N45-L555 WeakPolarHBondContact OD1-CD1 3.25Å; N45-L555 VanDerWaalsContact OD1-CG 3.23Å; N45-L555 WeakPolarHBondContact OD1-CG 3.2Å
46	I	91.7	Very high	85.1	Confident	75 Å²	75	49.4 Å²	49.4	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-47.4	173.6	-70.1	168.5	0	0	0	110	L42 C43 L44 L48 W49 V50 L554	L42-I46 HydrophobicContact CD1-CD1 4Å; L42-I46 HydrophobicContact CD1-CG1 4.31Å; L42-I46 HydrophobicContact CG-CD1 3.91Å; L42-I46 VanDerWaalsContact O-CG1 3.27Å; L42-I46 WeakPolarHBondContact O-CG1 3.32Å; L42-I46 PolarHBondContact O-N 3.34Å; C43-I46 PolarHBondContact O-N 3.03Å; L44-I46 VanDerWaalsContact C-N 3.34Å; L44-I46 PolarHBondContact O-N 3.45Å; I46-L48 PolarHBondContact O-N 3.48Å; I46-W49 PolarHBondContact O-N 3.4Å; I46-V50 WeakPolarHBondContact O-CG2 3.38Å; I46-V50 PolarHBondContact O-N 3.04Å; I46-L554 HydrophobicContact CG1-CD1 3.67Å
47	A	90.1	Very high	86	Confident	63 Å²	63	48.9 Å²	48.9	52%	0.521	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-45.7	178.9	0	0	0	0	0	111.9	C43 L44 V50 L51	C43-A47 WeakPolarHBondContact O-CB 3.47Å; C43-A47 PolarHBondContact O-N 3.05Å; L44-A47 PolarHBondContact O-N 3.11Å; A47-V50 PolarHBondContact O-N 2.78Å; A47-L51 PolarHBondContact O-N 3.22Å
48	L	88.4	Confident	86.5	Confident	66 Å²	66	55.1 Å²	55.1	35%	0.346	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-35.8	176.2	-68.7	179.3	0	0	0	112.5	L44 I46 L51 V52 L555	L44-L48 HydrophobicContact CD2-CD1 3.4Å; L44-L48 VanDerWaalsContact CD2-CD1 3.4Å; L44-L48 HydrophobicContact CD2-CG 4.02Å; L44-L48 HydrophobicContact CG-CD1 4.48Å; L44-L48 WeakPolarHBondContact O-CG 3.47Å; L44-L48 PolarHBondContact O-N 3.33Å; I46-L48 PolarHBondContact O-N 3.48Å; L48-L51 HydrophobicContact CD2-CD2 4.37Å; L48-L51 WeakPolarHBondContact O-CB 3.48Å; L48-L51 PolarHBondContact O-N 3.14Å; L48-V52 WeakPolarHBondContact O-CB 3.38Å; L48-V52 WeakPolarHBondContact O-CG2 3.43Å; L48-V52 PolarHBondContact O-N 2.96Å; L48-L555 HydrophobicContact CB-CD2 3.6Å; L48-L555 HydrophobicContact CB-CG 4.4Å; L48-L555 HydrophobicContact CD1-CD1 3.89Å; L48-L555 HydrophobicContact CD1-CD2 4.28Å
49	W	90.9	Very high	86.4	Confident	51 Å²	51	57.6 Å²	57.6	19%	0.193	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-43.2	175.2	175.2	76.8	0	0	0	111.5	N45 I46 L51 V52 L53 L554 M630	N45-W49 WeakPolarHBondContact O-CB 3.39Å; N45-W49 PolarHBondContact O-N 2.92Å; I46-W49 PolarHBondContact O-N 3.4Å; W49-L51 VanDerWaalsContact C-N 3.32Å; W49-L51 PolarHBondContact O-N 3.18Å; W49-V52 WeakPolarHBondContact O-CB 3.44Å; W49-V52 PolarHBondContact O-N 3.42Å; W49-L53 HydrophobicContact CD2-CD1 4.12Å; W49-L53 HydrophobicContact CD2-CG 4.27Å; W49-L53 HydrophobicContact CE3-CD1 4.16Å; W49-L53 HydrophobicContact CH2-CD1 3.41Å; W49-L53 VanDerWaalsContact CH2-CD1 3.41Å; W49-L53 HydrophobicContact CH2-CG 4.5Å; W49-L53 HydrophobicContact CZ2-CD1 3.33Å; W49-L53 HydrophobicContact CZ2-CD2 4.43Å; W49-L53 HydrophobicContact CZ2-CG 4.07Å; W49-L53 HydrophobicContact CZ3-CD1 3.83Å; W49-L53 WeakPolarHBondContact O-CG 3.17Å; W49-L53 PolarHBondContact O-N 2.88Å; W49-L554 HydrophobicContact CB-CB 4.12Å; W49-L554 HydrophobicContact CD2-CD2 4.43Å; W49-L554 HydrophobicContact CG-CB 4.35Å; W49-L554 HydrophobicContact CG-CD2 4.31Å; W49-M630 HydrophobicContact CH2-CE 4.46Å; W49-M630 HydrophobicContact CZ2-CE 3.41Å; W49-M630 VanDerWaalsContact CZ2-CE 3.41Å
50	V	91.1	Very high	85.9	Confident	71 Å²	71	56 Å²	56	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-60	-43.7	172.5	171.8	0	0	0	0	110.9	I46 A47 V52 L53 V54	I46-V50 WeakPolarHBondContact O-CG2 3.38Å; I46-V50 PolarHBondContact O-N 3.04Å; A47-V50 PolarHBondContact O-N 2.78Å; V50-V52 VanDerWaalsContact C-N 3.34Å; V50-V52 PolarHBondContact O-N 2.97Å; V50-L53 PolarHBondContact O-N 3.21Å; V50-V54 HydrophobicContact CG1-CG2 4.49Å; V50-V54 WeakPolarHBondContact O-CG2 3.44Å; V50-V54 PolarHBondContact O-N 3.48Å
51	L	91	Very high	85.7	Confident	100 Å²	100	60.7 Å²	60.7	52%	0.524	32%	0.324	S	S	.	.	H	α-helix	trans	-58.7	-46.3	174.7	177.9	66.6	0	0	0	111.5	A47 L48 W49 L53 V54 V55	A47-L51 PolarHBondContact O-N 3.22Å; L48-L51 HydrophobicContact CD2-CD2 4.37Å; L48-L51 WeakPolarHBondContact O-CB 3.48Å; L48-L51 PolarHBondContact O-N 3.14Å; W49-L51 VanDerWaalsContact C-N 3.32Å; W49-L51 PolarHBondContact O-N 3.18Å; L51-L53 VanDerWaalsContact C-N 3.32Å; L51-L53 PolarHBondContact O-N 2.91Å; L51-V54 PolarHBondContact O-N 3.33Å; L51-V55 HydrophobicContact CD1-CG2 4.43Å; L51-V55 VanDerWaalsContact O-CG2 3.31Å; L51-V55 WeakPolarHBondContact O-CG2 3.2Å; L51-V55 PolarHBondContact O-N 2.97Å
52	V	89	Confident	85.1	Confident	18 Å²	18	62.1 Å²	62.1	11%	0.109	34%	0.34	C	S	.	.	H	α-helix	trans	-59	-42.4	176.2	159.7	0	0	0	0	111.3	L48 W49 V50 V55 Y56 L555 G558 M559 L562	L48-V52 WeakPolarHBondContact O-CB 3.38Å; L48-V52 WeakPolarHBondContact O-CG2 3.43Å; L48-V52 PolarHBondContact O-N 2.96Å; W49-V52 WeakPolarHBondContact O-CB 3.44Å; W49-V52 PolarHBondContact O-N 3.42Å; V50-V52 VanDerWaalsContact C-N 3.34Å; V50-V52 PolarHBondContact O-N 2.97Å; V52-V55 PolarHBondContact O-N 2.7Å; V52-Y56 VanDerWaalsContact O-CB 3.28Å; V52-Y56 WeakPolarHBondContact O-CB 3.32Å; V52-Y56 PolarHBondContact O-N 3.06Å; V52-L555 HydrophobicContact CG2-CD2 4.44Å; V52-G558 WeakPolarHBondContact CG1-O 3.4Å; V52-M559 HydrophobicContact CG2-SD 4.06Å; V52-L562 HydrophobicContact CB-CD1 4.37Å; V52-L562 HydrophobicContact CG1-CD1 3.6Å; V52-L562 HydrophobicContact CG1-CG 4.08Å; V52-L562 HydrophobicContact CG2-CD1 4.36Å
53	L	87.8	Confident	84	Confident	26 Å²	26	62 Å²	62	14%	0.136	35%	0.345	C	S	.	.	H	α-helix	trans	-65.5	-40.2	175.7	-70.6	-167.2	0	0	0	112.8	W49 V50 L51 Y56 S57 W109 L561	W49-L53 HydrophobicContact CD2-CD1 4.12Å; W49-L53 HydrophobicContact CD2-CG 4.27Å; W49-L53 HydrophobicContact CE3-CD1 4.16Å; W49-L53 HydrophobicContact CH2-CD1 3.41Å; W49-L53 VanDerWaalsContact CH2-CD1 3.41Å; W49-L53 HydrophobicContact CH2-CG 4.5Å; W49-L53 HydrophobicContact CZ2-CD1 3.33Å; W49-L53 HydrophobicContact CZ2-CD2 4.43Å; W49-L53 HydrophobicContact CZ2-CG 4.07Å; W49-L53 HydrophobicContact CZ3-CD1 3.83Å; W49-L53 WeakPolarHBondContact O-CG 3.17Å; W49-L53 PolarHBondContact O-N 2.88Å; V50-L53 PolarHBondContact O-N 3.21Å; L51-L53 VanDerWaalsContact C-N 3.32Å; L51-L53 PolarHBondContact O-N 2.91Å; L53-Y56 PolarHBondContact O-N 3.06Å; L53-S57 WeakPolarHBondContact O-CB 3.45Å; L53-S57 PolarHBondContact O-N 3.16Å; L53-S57 PolarHBondContact O-OG 3.39Å; L53-W109 HydrophobicContact CD1-CH2 4.47Å; L53-W109 HydrophobicContact CD1-CZ2 3.95Å; L53-W109 HydrophobicContact CD2-CH2 3.75Å; L53-W109 HydrophobicContact CD2-CZ2 3.45Å; L53-W109 VanDerWaalsContact CD2-CZ2 3.45Å; L53-W109 HydrophobicContact CG-CZ2 4.24Å; L53-L561 HydrophobicContact CD2-CD2 3.64Å
54	V	88	Confident	82.3	Confident	70 Å²	70	62.6 Å²	62.6	42%	0.424	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-45.8	175.6	168.6	0	0	0	0	110.4	V50 L51 Y56 S57 F58 F106	V50-V54 HydrophobicContact CG1-CG2 4.49Å; V50-V54 WeakPolarHBondContact O-CG2 3.44Å; V50-V54 PolarHBondContact O-N 3.48Å; L51-V54 PolarHBondContact O-N 3.33Å; V54-Y56 VanDerWaalsContact C-N 3.32Å; V54-Y56 PolarHBondContact O-N 3.42Å; V54-S57 PolarHBondContact O-N 2.97Å; V54-F58 WeakPolarHBondContact O-CB 3.5Å; V54-F58 PolarHBondContact O-N 2.72Å; V54-F106 HydrophobicContact CG1-CZ 4.32Å
55	V	87.6	Confident	80.7	Confident	59 Å²	59	60.9 Å²	60.9	36%	0.358	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-42.9	175.1	171.1	0	0	0	0	110.5	L51 V52 F58 L59 L562	L51-V55 HydrophobicContact CD1-CG2 4.43Å; L51-V55 VanDerWaalsContact O-CG2 3.31Å; L51-V55 WeakPolarHBondContact O-CG2 3.2Å; L51-V55 PolarHBondContact O-N 2.97Å; V52-V55 PolarHBondContact O-N 2.7Å; V55-F58 PolarHBondContact O-N 3.24Å; V55-L59 HydrophobicContact CG1-CD1 3.67Å; V55-L59 HydrophobicContact CG1-CG 4.13Å; V55-L59 VanDerWaalsContact O-CB 3.31Å; V55-L59 WeakPolarHBondContact O-CB 3.28Å; V55-L59 VanDerWaalsContact O-CG 3.29Å; V55-L59 WeakPolarHBondContact O-CG 3.43Å; V55-L59 PolarHBondContact O-N 3.49Å; V55-L562 HydrophobicContact CG1-CD2 4.27Å
56	Y	85.8	Confident	79	Confident	22 Å²	22	61.9 Å²	61.9	9%	0.086	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-50.5	176.4	171.5	-103.2	0	0	0	111.6	V52 L53 V54 F58 L59 R60 W109 L561 L562 Y637	V52-Y56 VanDerWaalsContact O-CB 3.28Å; V52-Y56 WeakPolarHBondContact O-CB 3.32Å; V52-Y56 PolarHBondContact O-N 3.06Å; L53-Y56 PolarHBondContact O-N 3.06Å; V54-Y56 VanDerWaalsContact C-N 3.32Å; V54-Y56 PolarHBondContact O-N 3.42Å; Y56-F58 VanDerWaalsContact C-N 3.28Å; Y56-F58 PolarHBondContact O-N 3.14Å; Y56-L59 PolarHBondContact O-N 3.1Å; Y56-R60 WeakPolarHBondContact O-CB 3.27Å; Y56-R60 PolarHBondContact O-N 2.91Å; Y56-W109 HydrophobicContact CD1-CD2 4.44Å; Y56-W109 HydrophobicContact CD1-CG 4.49Å; Y56-W109 AromaticContact CD1-NE1 3.98Å; Y56-W109 HydrophobicContact CE1-CB 4.29Å; Y56-W109 AromaticContact CE1-CD1 3.78Å; Y56-W109 AromaticContact CE1-CD2 3.88Å; Y56-W109 HydrophobicContact CE1-CD2 3.88Å; Y56-W109 AromaticContact CE1-CG 3.74Å; Y56-W109 HydrophobicContact CE1-CG 3.74Å; Y56-W109 AromaticContact CE1-NE1 3.97Å; Y56-L561 HydrophobicContact CD1-CD2 3.86Å; Y56-L561 HydrophobicContact CD1-CG 4.26Å; Y56-L561 HydrophobicContact CD2-CG 4.13Å; Y56-L561 HydrophobicContact CE1-CD1 4.49Å; Y56-L561 HydrophobicContact CE1-CD2 4.06Å; Y56-L561 HydrophobicContact CE1-CG 4.2Å; Y56-L561 HydrophobicContact CE2-CG 4.08Å; Y56-L561 HydrophobicContact CG-CD2 4.1Å; Y56-L561 HydrophobicContact CG-CG 4.23Å; Y56-L562 VanDerWaalsContact CA-CD2 3.49Å; Y56-L562 HydrophobicContact CD2-CD2 4.01Å; Y56-L562 HydrophobicContact CG-CD2 4.3Å; Y56-Y637 WeakPolarHBondContact OH-CE1 3.3Å; Y56-Y637 PolarHBondContact OH-OH 3.27Å
57	S	82.8	Confident	77	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.028	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-36.2	178.8	-72	0	0	0	0	112.3	L53 V54 K61 F106	L53-S57 WeakPolarHBondContact O-CB 3.45Å; L53-S57 PolarHBondContact O-N 3.16Å; L53-S57 PolarHBondContact O-OG 3.39Å; V54-S57 PolarHBondContact O-N 2.97Å; S57-K61 PolarHBondContact O-N 3.43Å; S57-F106 VanDerWaalsContact CB-CE2 3.41Å; S57-F106 VanDerWaalsContact CB-CZ 3.43Å; S57-F106 WeakPolarHBondContact CB-O 3.5Å; S57-F106 PolarHBondContact OG-O 2.97Å
58	F	82.3	Confident	75.6	Confident	131 Å²	131	57 Å²	57	58%	0.575	29%	0.294	S	S	*	.	H	α-helix	trans	-67.2	-54.2	173	178.4	-95.8	0	0	0	111.8	V54 V55 Y56 R60 K61 A62	V54-F58 WeakPolarHBondContact O-CB 3.5Å; V54-F58 PolarHBondContact O-N 2.72Å; V55-F58 PolarHBondContact O-N 3.24Å; Y56-F58 VanDerWaalsContact C-N 3.28Å; Y56-F58 PolarHBondContact O-N 3.14Å; F58-R60 VanDerWaalsContact C-N 3.26Å; F58-R60 PolarHBondContact O-N 2.82Å; F58-K61 PolarHBondContact O-N 3.05Å; F58-A62 HydrophobicContact CD1-CB 4.36Å; F58-A62 HydrophobicContact CE1-CB 3.95Å; F58-A62 HydrophobicContact CZ-CB 4.06Å; F58-A62 WeakPolarHBondContact O-CB 3.48Å; F58-A62 PolarHBondContact O-N 3.26Å
59	L	78.6	Confident	73.8	Confident	58 Å²	58	56.8 Å²	56.8	30%	0.304	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-36.8	179.9	-74.7	175.6	0	0	0	111.7	V55 Y56 K61 A63 L562 L567	V55-L59 HydrophobicContact CG1-CD1 3.67Å; V55-L59 HydrophobicContact CG1-CG 4.13Å; V55-L59 VanDerWaalsContact O-CB 3.31Å; V55-L59 WeakPolarHBondContact O-CB 3.28Å; V55-L59 VanDerWaalsContact O-CG 3.29Å; V55-L59 WeakPolarHBondContact O-CG 3.43Å; V55-L59 PolarHBondContact O-N 3.49Å; Y56-L59 PolarHBondContact O-N 3.1Å; L59-K61 VanDerWaalsContact C-N 3.26Å; L59-K61 PolarHBondContact O-N 3.28Å; L59-A63 CarbonylContact O-C 3.45Å; L59-A63 VanDerWaalsContact O-CA 3.29Å; L59-A63 WeakPolarHBondContact O-CA 3.3Å; L59-A63 VanDerWaalsContact O-CB 3.25Å; L59-A63 WeakPolarHBondContact O-CB 3.36Å; L59-A63 PolarHBondContact O-N 3.34Å; L59-L562 HydrophobicContact CD1-CD2 4.03Å; L59-L567 HydrophobicContact CD1-CD2 3.87Å
60	R	76	Confident	71.7	Confident	31 Å²	31	54.4 Å²	54.4	12%	0.117	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-35.9	175.1	-170.3	-176.9	80.1	140.7	3.5	112.1	Y56 F58 W64 D103 G105 S108 Y637	Y56-R60 WeakPolarHBondContact O-CB 3.27Å; Y56-R60 PolarHBondContact O-N 2.91Å; F58-R60 VanDerWaalsContact C-N 3.26Å; F58-R60 PolarHBondContact O-N 2.82Å; R60-W64 WeakPolarHBondContact O-CA 3.47Å; R60-D103 IonicContact CZ-OD1 3.9Å; R60-D103 PolarHBondContact NH1-O 2.83Å; R60-D103 IonicContact NH1-OD1 3.83Å; R60-D103 PolarHBondContact NH1-OD1 3.33Å; R60-D103 IonicContact NH1-OD2 2.73Å; R60-D103 PolarHBondContact NH1-OD2 3.42Å; R60-D103 PolarHBondContact NH2-O 2.98Å; R60-D103 IonicContact NH2-OD1 3.49Å; R60-G105 PolarHBondContact NH2-O 3.38Å; R60-S108 PolarHBondContact NH2-OG 3.04Å; R60-Y637 PolarHBondContact NH1-OH 3.11Å
61	K	72.6	Confident	69.8	Low	161 Å²	161	52.4 Å²	52.4	70%	0.7	27%	0.271	S	S	*	.	H	α-helix	trans	-82.6	-40.8	178.9	-166.3	178.3	-179.4	-175	0	112.4	S57 F58 L59	S57-K61 PolarHBondContact O-N 3.43Å; F58-K61 PolarHBondContact O-N 3.05Å; L59-K61 VanDerWaalsContact C-N 3.26Å; L59-K61 PolarHBondContact O-N 3.28Å
62	A	68.6	Low	67.8	Low	67 Å²	67	51.3 Å²	51.3	55%	0.554	27%	0.265	S	S	*	.	H	α-helix	trans	-81	-28.8	-177.4	0	0	0	0	0	113.3	F58	F58-A62 HydrophobicContact CD1-CB 4.36Å; F58-A62 HydrophobicContact CE1-CB 3.95Å; F58-A62 HydrophobicContact CZ-CB 4.06Å; F58-A62 WeakPolarHBondContact O-CB 3.48Å; F58-A62 PolarHBondContact O-N 3.26Å
63	A	62.5	Low	65.6	Low	41 Å²	41	52 Å²	52	34%	0.339	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	49.5	175.6	0	0	0	0	0	109.7	L59 D65 Y66	L59-A63 CarbonylContact O-C 3.45Å; L59-A63 VanDerWaalsContact O-CA 3.29Å; L59-A63 WeakPolarHBondContact O-CA 3.3Å; L59-A63 VanDerWaalsContact O-CB 3.25Å; L59-A63 WeakPolarHBondContact O-CB 3.36Å; L59-A63 PolarHBondContact O-N 3.34Å; A63-D65 PolarHBondContact O-N 2.97Å; A63-Y66 VanDerWaalsContact O-CB 3.25Å; A63-Y66 WeakPolarHBondContact O-CB 3.44Å; A63-Y66 PolarHBondContact O-N 3.43Å
64	W	52.7	Low	63.4	Low	100 Å²	100	57.3 Å²	57.3	38%	0.379	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-25.8	180	-169.5	-96.9	0	0	0	112.7	R60 Y66 K104	R60-W64 WeakPolarHBondContact O-CA 3.47Å; W64-Y66 VanDerWaalsContact C-N 3.32Å; W64-Y66 PolarHBondContact O-N 3.34Å; W64-K104 HydrophobicContact CH2-CG 4.46Å
65	D	51.3	Low	61.2	Low	60 Å²	60	60.7 Å²	60.7	32%	0.321	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-7.7	175.2	-67.9	-18	0	0	0	115.5	A63 G67	A63-D65 PolarHBondContact O-N 2.97Å; D65-G67 PolarHBondContact O-N 2.94Å
66	Y	50.2	Low	58.9	Low	26 Å²	26	61.8 Å²	61.8	10%	0.102	31%	0.311	C	S	.	.	S	Bend	trans	-77.6	91	-172	-171.4	-108.1	0	0	0	112.7	A63 W64 R68 R563 S566 L567 Y570 Q590	A63-Y66 VanDerWaalsContact O-CB 3.25Å; A63-Y66 WeakPolarHBondContact O-CB 3.44Å; A63-Y66 PolarHBondContact O-N 3.43Å; W64-Y66 VanDerWaalsContact C-N 3.32Å; W64-Y66 PolarHBondContact O-N 3.34Å; Y66-R68 PolarHBondContact O-N 2.9Å; Y66-R563 PolarHBondContact O-NH2 3.33Å; Y66-R563 VanDerWaalsContact O-NH2 3.11Å; Y66-S566 PolarHBondContact OH-O 3.39Å; Y66-S566 PolarHBondContact OH-OG 2.96Å; Y66-L567 HydrophobicContact CD1-CD1 4.05Å; Y66-L567 HydrophobicContact CD2-CD1 4.1Å; Y66-L567 HydrophobicContact CE1-CB 4.36Å; Y66-L567 HydrophobicContact CE1-CD1 3.79Å; Y66-L567 HydrophobicContact CE2-CD1 3.86Å; Y66-L567 HydrophobicContact CG-CD1 4.21Å; Y66-L567 WeakPolarHBondContact OH-CA 3.38Å; Y66-L567 PolarHBondContact OH-N 2.01Å; Y66-Y570 AromaticContact CD2-CD1 3.71Å; Y66-Y570 HydrophobicContact CD2-CD1 3.71Å; Y66-Y570 HydrophobicContact CD2-CD2 4.39Å; Y66-Y570 AromaticContact CD2-CE1 3.77Å; Y66-Y570 HydrophobicContact CD2-CE1 3.77Å; Y66-Y570 HydrophobicContact CD2-CE2 4.43Å; Y66-Y570 HydrophobicContact CD2-CG 4.05Å; Y66-Y570 AromaticContact CE2-CD1 3.46Å; Y66-Y570 HydrophobicContact CE2-CD1 3.46Å; Y66-Y570 VanDerWaalsContact CE2-CD1 3.46Å; Y66-Y570 AromaticContact CE2-CD2 3.97Å; Y66-Y570 HydrophobicContact CE2-CD2 3.97Å; Y66-Y570 HydrophobicContact CE2-CE1 4.02Å; Y66-Y570 HydrophobicContact CE2-CE2 4.46Å; Y66-Y570 AromaticContact CE2-CG 3.45Å; Y66-Y570 HydrophobicContact CE2-CG 3.45Å; Y66-Y570 VanDerWaalsContact CE2-CG 3.45Å; Y66-Q590 HydrophobicContact CE2-CG 3.95Å; Y66-Q590 PolarHBondContact OH-NE2 3.4Å
67	G	50.6	Low	56.5	Low	2 Å²	2	63.8 Å²	63.8	2%	0.021	33%	0.328	C	S	.	.	S	Bend	trans	92	-23.1	167.2	0	0	0	0	0	115.9	D65 L71	D65-G67 PolarHBondContact O-N 2.94Å; G67-L71 WeakPolarHBondContact O-CG 3.42Å
68	R	59.2	Low	54.3	Low	34 Å²	34	67 Å²	67	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-75.1	-41.8	173.5	-78.5	-170.1	178.6	-179.3	5.1	112.7	Y66 A70 L71 L72 D103 Y637 Y641	Y66-R68 PolarHBondContact O-N 2.9Å; R68-A70 VanDerWaalsContact C-N 3.27Å; R68-A70 PolarHBondContact O-N 3.03Å; R68-L71 PolarHBondContact O-N 3.38Å; R68-L71 VanDerWaalsContact O-N 3.13Å; R68-L72 PolarHBondContact O-N 2.68Å; R68-D103 IonicContact CZ-OD2 3.05Å; R68-D103 IonicContact NH1-OD2 2.75Å; R68-D103 PolarHBondContact NH1-OD2 2.88Å; R68-D103 IonicContact NH2-OD2 3Å; R68-D103 PolarHBondContact NH2-OD2 2.81Å; R68-Y637 PolarHBondContact NH2-OH 3.03Å; R68-Y637 VanDerWaalsContact NH2-OH 3.09Å; R68-Y641 VanDerWaalsContact NH2-CE1 3.33Å
69	L	51.2	Low	52.1	Low	61 Å²	61	64.6 Å²	64.6	32%	0.319	34%	0.341	S	S	.	.	H	α-helix	trans	-61.2	-37.6	176.3	-166.3	72.9	0	0	0	111.7	L71 L72 I73	L69-L71 VanDerWaalsContact C-N 3.31Å; L69-L71 PolarHBondContact O-N 3.27Å; L69-L72 PolarHBondContact O-N 3.46Å; L69-I73 HydrophobicContact CD1-CD1 4.43Å; L69-I73 HydrophobicContact CD2-CD1 4.18Å; L69-I73 HydrophobicContact CG-CD1 3.76Å; L69-I73 HydrophobicContact CG-CG1 4.48Å; L69-I73 VanDerWaalsContact O-CG1 3.26Å; L69-I73 WeakPolarHBondContact O-CG1 3.48Å; L69-I73 PolarHBondContact O-N 3.21Å
70	A	47.7	Very low	50.2	Low	1 Å²	1	63.5 Å²	63.5	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-34.2	175.8	0	0	0	0	0	113.2	R68 H74 R587 K588 Q590 A591	R68-A70 VanDerWaalsContact C-N 3.27Å; R68-A70 PolarHBondContact O-N 3.03Å; A70-H74 WeakPolarHBondContact O-CB 3.22Å; A70-H74 PolarHBondContact O-N 2.76Å; A70-H74 VanDerWaalsContact O-N 3.12Å; A70-R587 WeakPolarHBondContact CB-O 3.49Å; A70-K588 WeakPolarHBondContact CB-O 3.42Å; A70-Q590 HydrophobicContact CB-CB 4.38Å; A70-A591 HydrophobicContact CB-CB 3.94Å
71	L	50.4	Low	48.4	Very low	29 Å²	29	63.6 Å²	63.6	15%	0.152	34%	0.341	C	S	.	.	H	α-helix	trans	-74.3	-34.8	177.8	-68.7	171.5	0	0	0	112.4	G67 R68 L69 A591 Y641 A644	G67-L71 WeakPolarHBondContact O-CG 3.42Å; R68-L71 PolarHBondContact O-N 3.38Å; R68-L71 VanDerWaalsContact O-N 3.13Å; L69-L71 VanDerWaalsContact C-N 3.31Å; L69-L71 PolarHBondContact O-N 3.27Å; L71-A591 HydrophobicContact CD2-CB 4.03Å; L71-Y641 WeakPolarHBondContact CD1-O 3.2Å; L71-A644 HydrophobicContact CD2-CB 4.11Å
72	L	48.5	Very low	46.6	Very low	76 Å²	76	58.2 Å²	58.2	40%	0.398	32%	0.319	S	S	.	.	H	α-helix	trans	-68.1	-47	174.6	-69.3	171.1	0	0	0	110.9	R68 L69 H74 N75 D76	R68-L72 PolarHBondContact O-N 2.68Å; L69-L72 PolarHBondContact O-N 3.46Å; L72-H74 VanDerWaalsContact C-N 3.31Å; L72-H74 PolarHBondContact O-N 2.97Å; L72-N75 PolarHBondContact O-N 2.87Å; L72-D76 PolarHBondContact O-N 2.74Å
73	I	43.7	Very low	44.9	Very low	34 Å²	34	61 Å²	61	17%	0.174	32%	0.316	C	S	.	.	H	α-helix	trans	-70.6	-24.4	-178.3	-62.1	168.1	0	0	0	112.6	L69 L81 K588	L69-I73 HydrophobicContact CD1-CD1 4.43Å; L69-I73 HydrophobicContact CD2-CD1 4.18Å; L69-I73 HydrophobicContact CG-CD1 3.76Å; L69-I73 HydrophobicContact CG-CG1 4.48Å; L69-I73 VanDerWaalsContact O-CG1 3.26Å; L69-I73 WeakPolarHBondContact O-CG1 3.48Å; L69-I73 PolarHBondContact O-N 3.21Å; I73-L81 HydrophobicContact CG2-CD1 4.28Å; I73-K588 HydrophobicContact CG2-CD 3.62Å; I73-K588 HydrophobicContact CG2-CG 3.88Å
74	H	41.4	Very low	43.5	Very low	137 Å²	137	60.6 Å²	60.6	63%	0.634	32%	0.316	S	S	*	.	H	α-helix	trans	-74.3	-28.7	175.4	-163.3	-17.7	0	0	0	112.2	A70 L72	A70-H74 WeakPolarHBondContact O-CB 3.22Å; A70-H74 PolarHBondContact O-N 2.76Å; A70-H74 VanDerWaalsContact O-N 3.12Å; L72-H74 VanDerWaalsContact C-N 3.31Å; L72-H74 PolarHBondContact O-N 2.97Å
75	N	41.3	Very low	42.3	Very low	140 Å²	140	62.7 Å²	62.7	75%	0.749	33%	0.33	S	S	*	.	H	α-helix	trans	-75.5	-31.5	176.2	-81.1	-12.8	0	0	0	112.2	L72 S77	L72-N75 PolarHBondContact O-N 2.87Å; N75-S77 PolarHBondContact O-N 3.36Å
76	D	38.9	Very low	41.3	Very low	83 Å²	83	67.2 Å²	67.2	44%	0.444	35%	0.349	S	S	.	.	S	Bend	trans	-79.1	104.6	171.6	-69.4	-25.4	0	0	0	109.6	L72 L78 L81	L72-D76 PolarHBondContact O-N 2.74Å; D76-L78 PolarHBondContact O-N 2.88Å; D76-L81 HydrophobicContact CB-CD1 4.06Å
77	S	35.8	Very low	40.3	Very low	64 Å²	64	69.4 Å²	69.4	45%	0.448	37%	0.368	S	S	.	.			trans	-48.9	140.2	174.1	179.3	0	0	0	0	110.9	N75 T79 S80 L81	N75-S77 PolarHBondContact O-N 3.36Å; S77-T79 WeakPolarHBondContact CB-OG1 3.36Å; S77-T79 PolarHBondContact O-N 3.4Å; S77-T79 PolarHBondContact OG-N 2.89Å; S77-T79 PolarHBondContact OG-OG1 3.11Å; S77-S80 PolarHBondContact O-N 2.91Å; S77-S80 PolarHBondContact O-OG 3.06Å; S77-L81 PolarHBondContact O-N 3.33Å
78	L	37.2	Very low	39.4	Very low	70 Å²	70	77 Å²	77	37%	0.366	40%	0.404	S	S	.	.	H	α-helix	trans	-48.6	-29	172.9	-167.6	112	0	0	0	112.1	D76 I82 R274	D76-L78 PolarHBondContact O-N 2.88Å; L78-I82 HydrophobicContact CD1-CD1 4.47Å; L78-I82 HydrophobicContact CD2-CD1 3.5Å; L78-I82 VanDerWaalsContact CD2-CD1 3.5Å; L78-I82 HydrophobicContact CG-CD1 3.6Å; L78-I82 HydrophobicContact CG-CG1 4.44Å; L78-I82 VanDerWaalsContact O-CB 3.3Å; L78-I82 WeakPolarHBondContact O-CB 3.35Å; L78-I82 WeakPolarHBondContact O-CD1 3.27Å; L78-I82 WeakPolarHBondContact O-CG1 3.4Å; L78-I82 PolarHBondContact O-N 3.03Å; L78-R274 VanDerWaalsContact CD1-NH2 3.28Å
79	T	35.9	Very low	38	Very low	81 Å²	81	83.9 Å²	83.9	50%	0.497	43%	0.434	S	S	.	.	H	α-helix	trans	-71.4	-39.6	175.2	41.1	0	0	0	0	114.8	S77 L81 Y83	S77-T79 WeakPolarHBondContact CB-OG1 3.36Å; S77-T79 PolarHBondContact O-N 3.4Å; S77-T79 PolarHBondContact OG-N 2.89Å; S77-T79 PolarHBondContact OG-OG1 3.11Å; T79-L81 VanDerWaalsContact C-N 3.29Å; T79-L81 PolarHBondContact O-N 3.25Å; T79-Y83 WeakPolarHBondContact O-CB 3.05Å; T79-Y83 PolarHBondContact O-N 3.13Å
80	S	37.9	Very low	37	Very low	35 Å²	35	86.5 Å²	86.5	25%	0.245	45%	0.453	C	S	.	.	H	α-helix	trans	-70.7	-31.2	177.8	61.3	0	0	0	0	111.7	S77 G84	S77-S80 PolarHBondContact O-N 2.91Å; S77-S80 PolarHBondContact O-OG 3.06Å; S80-G84 PolarHBondContact O-N 3.19Å; S80-G84 VanDerWaalsContact O-N 3.13Å
81	L	38.3	Very low	36.2	Very low	34 Å²	34	90.7 Å²	90.7	18%	0.178	48%	0.482	C	S	.	.	H	α-helix	trans	-76.5	-35.8	179.1	-112.7	159.7	0	0	0	113.6	I73 D76 S77 T79 E787	I73-L81 HydrophobicContact CG2-CD1 4.28Å; D76-L81 HydrophobicContact CB-CD1 4.06Å; S77-L81 PolarHBondContact O-N 3.33Å; T79-L81 VanDerWaalsContact C-N 3.29Å; T79-L81 PolarHBondContact O-N 3.25Å; L81-E787 HydrophobicContact CD2-CB 4.45Å; L81-E787 HydrophobicContact CD2-CG 3.67Å; L81-E787 WeakPolarHBondContact CD2-OE1 3.46Å
82	I	34.6	Very low	35.5	Very low	48 Å²	48	92.2 Å²	92.2	25%	0.246	49%	0.494	C	S	.	.	H	α-helix	trans	-82.5	-37.9	178.6	-69.3	172.2	0	0	0	111.8	L78	L78-I82 HydrophobicContact CD1-CD1 4.47Å; L78-I82 HydrophobicContact CD2-CD1 3.5Å; L78-I82 VanDerWaalsContact CD2-CD1 3.5Å; L78-I82 HydrophobicContact CG-CD1 3.6Å; L78-I82 HydrophobicContact CG-CG1 4.44Å; L78-I82 VanDerWaalsContact O-CB 3.3Å; L78-I82 WeakPolarHBondContact O-CB 3.35Å; L78-I82 WeakPolarHBondContact O-CD1 3.27Å; L78-I82 WeakPolarHBondContact O-CG1 3.4Å; L78-I82 PolarHBondContact O-N 3.03Å
83	Y	34.5	Very low	35	Very low	125 Å²	125	92 Å²	92	49%	0.49	50%	0.498	S	S	.	.	H	α-helix	trans	-99.6	-4.7	-174.5	-74.1	-77	0	0	0	115.1	T79 E85	T79-Y83 WeakPolarHBondContact O-CB 3.05Å; T79-Y83 PolarHBondContact O-N 3.13Å; Y83-E85 PolarHBondContact O-N 3.24Å
84	G	32.7	Very low	34.7	Very low	33 Å²	33	98.1 Å²	98.1	34%	0.34	53%	0.526	S	S	.	.			trans	57.2	26.2	179.4	0	0	0	0	0	113	S80 Q86	S80-G84 PolarHBondContact O-N 3.19Å; S80-G84 VanDerWaalsContact O-N 3.13Å; G84-Q86 PolarHBondContact O-N 2.64Å
85	E	27.5	Very low	34.6	Very low	143 Å²	143	95.1 Å²	95.1	67%	0.668	52%	0.518	S	S	*	.			trans	-63	105.4	165	-100.7	-176	156.2	0	0	106.2	Y83 S87	Y83-E85 PolarHBondContact O-N 3.24Å; E85-S87 PolarHBondContact O-N 3.13Å
86	Q	30.8	Very low	34.8	Very low	155 Å²	155	89.9 Å²	89.9	72%	0.724	49%	0.492	S	S	*	.			trans	-58.7	84	159.3	-77.9	178.4	-56.5	0	0	106.7	G84 E88	G84-Q86 PolarHBondContact O-N 2.64Å; Q86-E88 PolarHBondContact O-N 3.41Å
87	S	28.6	Very low	35.2	Very low	72 Å²	72	89.4 Å²	89.4	50%	0.503	49%	0.489	S	S	.	.			trans	-66.5	88.8	157.6	-177.2	0	0	0	0	105.7	E85 K89	E85-S87 PolarHBondContact O-N 3.13Å; S87-K89 PolarHBondContact O-N 3.05Å
88	E	30.5	Very low	35.6	Very low	163 Å²	163	91.8 Å²	91.8	76%	0.762	49%	0.493	S	S	*	.	S	Bend	trans	-60.6	10.5	170.1	-79.2	-172	144.5	0	0	112.8	Q86	Q86-E88 PolarHBondContact O-N 3.41Å
89	K	31.1	Very low	36.2	Very low	178 Å²	178	89.5 Å²	89.5	77%	0.774	48%	0.481	S	S	*	.	S	Bend	trans	-136.9	56.2	179.5	-66	-174.3	-177.7	175.5	0	112.2	S87	S87-K89 PolarHBondContact O-N 3.05Å
90	T	28.8	Very low	36.9	Very low	116 Å²	116	88.2 Å²	88.2	71%	0.712	47%	0.469	S	S	*	.			trans	-161.1	63.1	138.7	6.9	0	0	0	0	107.8
91	S	31.3	Very low	37.6	Very low	88 Å²	88	95.5 Å²	95.5	62%	0.615	49%	0.491	S	S	*	.			trans	-47.2	128.2	155.6	-33.9	0	0	0	0	106.4	S93	S91-S93 PolarHBondContact O-N 3.36Å
92	P	36.9	Very low	38.3	Very low	62 Å²	62	102.1 Å²	102.1	40%	0.403	51%	0.514	S	S	.	.			trans	-50	125.4	170.3	8.1	-11.4	0	0	0	105.5	E94 S96 L97	P92-E94 PolarHBondContact O-N 3.44Å; P92-E94 VanDerWaalsContact O-N 3.14Å; P92-S96 WeakPolarHBondContact CB-OG 3.26Å; P92-L97 HydrophobicContact CB-CD1 4.37Å; P92-L97 HydrophobicContact CB-CG 4.09Å; P92-L97 HydrophobicContact CG-CD1 3.84Å; P92-L97 HydrophobicContact CG-CD2 4.12Å; P92-L97 HydrophobicContact CG-CG 3.91Å
93	S	38	Very low	39.5	Very low	70 Å²	70	99.9 Å²	99.9	49%	0.49	50%	0.502	S	S	.	.			trans	-43	129.7	-172.7	50.9	0	0	0	0	108.1	S91 T95 S96 L97	S91-S93 PolarHBondContact O-N 3.36Å; S93-T95 CarbonylContact O-C 3.58Å; S93-T95 PolarHBondContact O-N 3.27Å; S93-S96 PolarHBondContact N-OG 3.43Å; S93-S96 WeakPolarHBondContact O-CA 3.32Å; S93-S96 WeakPolarHBondContact O-CB 3.33Å; S93-S96 PolarHBondContact O-N 2.85Å; S93-S96 PolarHBondContact O-OG 3.06Å; S93-S96 PolarHBondContact OG-OG 3.05Å; S93-L97 PolarHBondContact O-N 3.48Å
94	E	36.1	Very low	40.8	Very low	163 Å²	163	101.2 Å²	101.2	76%	0.762	51%	0.511	S	S	*	.	H	α-helix	trans	-50.4	-29	-172.1	-68	179.6	147.9	0	0	111.8	P92 L97 E98	P92-E94 PolarHBondContact O-N 3.44Å; P92-E94 VanDerWaalsContact O-N 3.14Å; E94-L97 PolarHBondContact O-N 2.94Å; E94-E98 WeakPolarHBondContact O-CB 3.27Å; E94-E98 WeakPolarHBondContact O-CG 3.19Å; E94-E98 PolarHBondContact O-N 3.28Å
95	T	39.7	Very low	42.5	Very low	74 Å²	74	101.3 Å²	101.3	45%	0.454	51%	0.512	S	S	.	.	H	α-helix	trans	-58.9	-40.9	169	21.6	0	0	0	0	115.7	S93 M99	S93-T95 CarbonylContact O-C 3.58Å; S93-T95 PolarHBondContact O-N 3.27Å; T95-M99 WeakPolarHBondContact O-CB 3.3Å; T95-M99 PolarHBondContact O-N 3.47Å
96	S	45.9	Very low	44.5	Very low	31 Å²	31	100 Å²	100	22%	0.217	50%	0.504	C	S	.	.	H	α-helix	trans	-67.1	-42	176.2	65.8	0	0	0	0	112	P92 S93 E100	P92-S96 WeakPolarHBondContact CB-OG 3.26Å; S93-S96 PolarHBondContact N-OG 3.43Å; S93-S96 WeakPolarHBondContact O-CA 3.32Å; S93-S96 WeakPolarHBondContact O-CB 3.33Å; S93-S96 PolarHBondContact O-N 2.85Å; S93-S96 PolarHBondContact O-OG 3.06Å; S93-S96 PolarHBondContact OG-OG 3.05Å; S96-E100 WeakPolarHBondContact O-CB 3.45Å; S96-E100 PolarHBondContact O-N 3.33Å; S96-E100 VanDerWaalsContact O-N 3.08Å
97	L	46.3	Very low	46.4	Very low	73 Å²	73	95.9 Å²	95.9	38%	0.382	49%	0.492	S	S	.	.	H	α-helix	trans	-69.9	-35.9	175.5	-74.6	171.4	0	0	0	112.6	P92 S93 E94 R101	P92-L97 HydrophobicContact CB-CD1 4.37Å; P92-L97 HydrophobicContact CB-CG 4.09Å; P92-L97 HydrophobicContact CG-CD1 3.84Å; P92-L97 HydrophobicContact CG-CD2 4.12Å; P92-L97 HydrophobicContact CG-CG 3.91Å; S93-L97 PolarHBondContact O-N 3.48Å; E94-L97 PolarHBondContact O-N 2.94Å; L97-R101 PolarHBondContact O-N 3.24Å
98	E	45.5	Very low	48.7	Very low	113 Å²	113	93.1 Å²	93.1	53%	0.528	47%	0.473	S	S	.	.	H	α-helix	trans	-69.6	-43.2	175.7	-81.7	-163.4	149.4	0	0	112.9	E94 E100 R101 R102	E94-E98 WeakPolarHBondContact O-CB 3.27Å; E94-E98 WeakPolarHBondContact O-CG 3.19Å; E94-E98 PolarHBondContact O-N 3.28Å; E98-E100 VanDerWaalsContact C-N 3.25Å; E98-E100 PolarHBondContact O-N 2.86Å; E98-R101 PolarHBondContact O-N 3.41Å; E98-R102 PolarHBondContact O-N 3.04Å
99	M	48.3	Very low	50.9	Low	23 Å²	23	85.8 Å²	85.8	11%	0.113	44%	0.438	C	S	.	.	H	α-helix	trans	-64.8	-34.2	175.3	-163.7	87.6	86	0	0	110.9	T95 R102 D103 M116 Y640 Y641	T95-M99 WeakPolarHBondContact O-CB 3.3Å; T95-M99 PolarHBondContact O-N 3.47Å; M99-R102 PolarHBondContact O-N 3.2Å; M99-D103 PolarHBondContact O-N 3.31Å; M99-M116 HydrophobicContact CE-CB 4.44Å; M99-M116 HydrophobicContact CE-CG 4.07Å; M99-Y640 HydrophobicContact CG-CE1 4.4Å; M99-Y641 WeakPolarHBondContact CG-OH 3.5Å
100	E	52.5	Low	53.3	Low	54 Å²	54	80.7 Å²	80.7	25%	0.252	42%	0.416	S	S	.	.	H	α-helix	trans	-68.9	-36.7	176.7	-168.4	163.7	-140.4	0	0	112.9	S96 E98 R102 D103	S96-E100 WeakPolarHBondContact O-CB 3.45Å; S96-E100 PolarHBondContact O-N 3.33Å; S96-E100 VanDerWaalsContact O-N 3.08Å; E98-E100 VanDerWaalsContact C-N 3.25Å; E98-E100 PolarHBondContact O-N 2.86Å; E100-R102 VanDerWaalsContact C-N 3.33Å; E100-R102 PolarHBondContact O-N 3.24Å; E100-D103 PolarHBondContact O-N 3.07Å
101	R	52.7	Low	55.8	Low	187 Å²	187	81.4 Å²	81.4	71%	0.706	41%	0.409	S	S	*	.	H	α-helix	trans	-65.9	-32.5	170.9	-77.7	-179.9	-177.5	157.3	1.9	113.1	L97 E98 D103	L97-R101 PolarHBondContact O-N 3.24Å; E98-R101 PolarHBondContact O-N 3.41Å; R101-D103 PolarHBondContact O-N 3.36Å
102	R	52.5	Low	58	Low	174 Å²	174	77.9 Å²	77.9	66%	0.657	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.4	176.4	-72	-175.9	-177.7	178.5	4.1	113.6	E98 M99 E100 N112	E98-R102 PolarHBondContact O-N 3.04Å; M99-R102 PolarHBondContact O-N 3.2Å; E100-R102 VanDerWaalsContact C-N 3.33Å; E100-R102 PolarHBondContact O-N 3.24Å; R102-N112 PolarHBondContact O-ND2 3.23Å
103	D	59.7	Low	60	Low	0 Å²	0	75 Å²	75	0%	0	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	21.2	-172.3	-152.8	21.1	0	0	0	115.6	R60 R68 M99 E100 R101 S108 W109 N112 Y637	R60-D103 IonicContact CZ-OD1 3.9Å; R60-D103 PolarHBondContact NH1-O 2.83Å; R60-D103 IonicContact NH1-OD1 3.83Å; R60-D103 PolarHBondContact NH1-OD1 3.33Å; R60-D103 IonicContact NH1-OD2 2.73Å; R60-D103 PolarHBondContact NH1-OD2 3.42Å; R60-D103 PolarHBondContact NH2-O 2.98Å; R60-D103 IonicContact NH2-OD1 3.49Å; R68-D103 IonicContact CZ-OD2 3.05Å; R68-D103 IonicContact NH1-OD2 2.75Å; R68-D103 PolarHBondContact NH1-OD2 2.88Å; R68-D103 IonicContact NH2-OD2 3Å; R68-D103 PolarHBondContact NH2-OD2 2.81Å; M99-D103 PolarHBondContact O-N 3.31Å; E100-D103 PolarHBondContact O-N 3.07Å; R101-D103 PolarHBondContact O-N 3.36Å; D103-S108 WeakPolarHBondContact CA-OG 3.37Å; D103-S108 PolarHBondContact O-OG 2.96Å; D103-S108 VanDerWaalsContact O-OG 3.1Å; D103-S108 PolarHBondContact OD1-OG 3.34Å; D103-W109 PolarHBondContact OD1-N 2.77Å; D103-N112 WeakPolarHBondContact CA-ND2 3.44Å; D103-N112 PolarHBondContact OD1-ND2 3.5Å; D103-Y637 PolarHBondContact OD2-OH 3.19Å
104	K	62.1	Low	62	Low	154 Å²	154	76.6 Å²	76.6	67%	0.67	37%	0.367	S	S	*	.			trans	-84.8	-13	-177.7	-65.4	-175	177.2	-173.3	0	115.5	W64	W64-K104 HydrophobicContact CH2-CG 4.46Å
105	G	67.2	Low	64.2	Low	35 Å²	35	73.2 Å²	73.2	36%	0.361	36%	0.357	S	S	.	.	S	Bend	trans	-79.9	156.3	-176.3	0	0	0	0	0	113.7	R60 C107 S108	R60-G105 PolarHBondContact NH2-O 3.38Å; G105-C107 VanDerWaalsContact C-N 3.3Å; G105-C107 PolarHBondContact O-N 3.41Å; G105-S108 PolarHBondContact N-OG 2.77Å; G105-S108 PolarHBondContact O-N 3Å; G105-S108 PolarHBondContact O-OG 2.96Å
106	F	69.1	Low	66.2	Low	115 Å²	115	70 Å²	70	50%	0.504	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-36.7	-177.8	-169.5	-99.1	0	0	0	113.6	V54 S57	V54-F106 HydrophobicContact CG1-CZ 4.32Å; S57-F106 VanDerWaalsContact CB-CE2 3.41Å; S57-F106 VanDerWaalsContact CB-CZ 3.43Å; S57-F106 WeakPolarHBondContact CB-O 3.5Å; S57-F106 PolarHBondContact OG-O 2.97Å
107	C	71.8	Confident	68	Low	68 Å²	68	75 Å²	75	46%	0.459	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	16.3	176	-62.6	0	0	0	0	113.2	G105 W109 F110	G105-C107 VanDerWaalsContact C-N 3.3Å; G105-C107 PolarHBondContact O-N 3.41Å; C107-W109 PolarHBondContact O-N 2.85Å; C107-F110 PolarHBondContact O-N 2.95Å
108	S	76.8	Confident	69.8	Low	15 Å²	15	75.6 Å²	75.6	11%	0.105	36%	0.359	C	S	.	.	H	α-helix	trans	-61.9	-31	-178.1	62.2	0	0	0	0	112.1	R60 D103 G105 F110 F111 N112	R60-S108 PolarHBondContact NH2-OG 3.04Å; D103-S108 WeakPolarHBondContact CA-OG 3.37Å; D103-S108 PolarHBondContact O-OG 2.96Å; D103-S108 VanDerWaalsContact O-OG 3.1Å; D103-S108 PolarHBondContact OD1-OG 3.34Å; G105-S108 PolarHBondContact N-OG 2.77Å; G105-S108 PolarHBondContact O-N 3Å; G105-S108 PolarHBondContact O-OG 2.96Å; S108-F110 VanDerWaalsContact C-N 3.25Å; S108-F110 PolarHBondContact O-N 3.25Å; S108-F111 PolarHBondContact O-N 3.33Å; S108-N112 WeakPolarHBondContact O-CB 3.23Å; S108-N112 PolarHBondContact O-N 3.45Å; S108-N112 PolarHBondContact O-ND2 2.96Å
109	W	77.8	Confident	71.6	Confident	9 Å²	9	76.8 Å²	76.8	3%	0.034	36%	0.364	C	S	.	.	H	α-helix	trans	-56.4	-39.9	179.1	70.8	-92.2	0	0	0	112.6	L53 Y56 D103 C107 S113 L561 Y637	L53-W109 HydrophobicContact CD1-CH2 4.47Å; L53-W109 HydrophobicContact CD1-CZ2 3.95Å; L53-W109 HydrophobicContact CD2-CH2 3.75Å; L53-W109 HydrophobicContact CD2-CZ2 3.45Å; L53-W109 VanDerWaalsContact CD2-CZ2 3.45Å; L53-W109 HydrophobicContact CG-CZ2 4.24Å; Y56-W109 HydrophobicContact CD1-CD2 4.44Å; Y56-W109 HydrophobicContact CD1-CG 4.49Å; Y56-W109 AromaticContact CD1-NE1 3.98Å; Y56-W109 HydrophobicContact CE1-CB 4.29Å; Y56-W109 AromaticContact CE1-CD1 3.78Å; Y56-W109 AromaticContact CE1-CD2 3.88Å; Y56-W109 HydrophobicContact CE1-CD2 3.88Å; Y56-W109 AromaticContact CE1-CG 3.74Å; Y56-W109 HydrophobicContact CE1-CG 3.74Å; Y56-W109 AromaticContact CE1-NE1 3.97Å; D103-W109 PolarHBondContact OD1-N 2.77Å; C107-W109 PolarHBondContact O-N 2.85Å; W109-S113 VanDerWaalsContact O-CB 3.29Å; W109-S113 WeakPolarHBondContact O-CB 3.44Å; W109-S113 PolarHBondContact O-N 2.95Å; W109-L561 HydrophobicContact CD2-CD2 4.48Å; W109-L561 HydrophobicContact CE3-CD1 4.24Å; W109-L561 HydrophobicContact CE3-CD2 4.13Å; W109-L561 HydrophobicContact CH2-CD2 3.51Å; W109-L561 HydrophobicContact CZ2-CD2 3.91Å; W109-L561 HydrophobicContact CZ3-CD1 4.1Å; W109-L561 HydrophobicContact CZ3-CD2 3.63Å; W109-Y637 HydrophobicContact CB-CD2 4.28Å; W109-Y637 HydrophobicContact CB-CE2 3.53Å
110	F	80.6	Confident	73.2	Confident	70 Å²	70	77.8 Å²	77.8	31%	0.307	37%	0.37	S	S	.	.	H	α-helix	trans	-68.9	-50.6	-177.5	-179.3	-96.6	0	0	0	110.4	C107 S108 S113 I114 L633	C107-F110 PolarHBondContact O-N 2.95Å; S108-F110 VanDerWaalsContact C-N 3.25Å; S108-F110 PolarHBondContact O-N 3.25Å; F110-S113 PolarHBondContact O-N 3.08Å; F110-I114 HydrophobicContact CD1-CD1 4.01Å; F110-I114 HydrophobicContact CE1-CD1 3.5Å; F110-I114 HydrophobicContact CE2-CD1 4.44Å; F110-I114 HydrophobicContact CZ-CD1 3.75Å; F110-I114 WeakPolarHBondContact O-CG1 3.42Å; F110-I114 PolarHBondContact O-N 3.12Å; F110-L633 HydrophobicContact CD2-CD2 3.72Å; F110-L633 HydrophobicContact CE2-CD2 3.42Å; F110-L633 VanDerWaalsContact CE2-CD2 3.42Å; F110-L633 HydrophobicContact CZ-CD2 4.4Å
111	F	80.5	Confident	74.6	Confident	131 Å²	131	75.3 Å²	75.3	58%	0.575	36%	0.359	S	S	*	.	H	α-helix	trans	-64.1	-44.5	177.3	-70.4	-74.6	0	0	0	111.7	S108 S113 I114 T115	S108-F111 PolarHBondContact O-N 3.33Å; F111-S113 VanDerWaalsContact C-N 3.28Å; F111-S113 PolarHBondContact O-N 2.87Å; F111-I114 PolarHBondContact O-N 3.46Å; F111-I114 VanDerWaalsContact O-N 3.07Å; F111-T115 WeakPolarHBondContact O-CG2 3.37Å; F111-T115 PolarHBondContact O-N 2.86Å; F111-T115 PolarHBondContact O-OG1 3.35Å
112	N	77.4	Confident	76	Confident	14 Å²	14	68.3 Å²	68.3	8%	0.075	34%	0.335	C	S	.	.	H	α-helix	trans	-60	-38.6	177.6	-72	-19.9	0	0	0	111.7	R102 D103 S108 I114 T115 M116	R102-N112 PolarHBondContact O-ND2 3.23Å; D103-N112 WeakPolarHBondContact CA-ND2 3.44Å; D103-N112 PolarHBondContact OD1-ND2 3.5Å; S108-N112 WeakPolarHBondContact O-CB 3.23Å; S108-N112 PolarHBondContact O-N 3.45Å; S108-N112 PolarHBondContact O-ND2 2.96Å; N112-I114 VanDerWaalsContact C-N 3.28Å; N112-I114 PolarHBondContact O-N 3.32Å; N112-T115 WeakPolarHBondContact CA-OG1 3.13Å; N112-T115 PolarHBondContact O-N 3.49Å; N112-T115 PolarHBondContact O-OG1 3.23Å; N112-M116 VanDerWaalsContact O-CB 3.26Å; N112-M116 WeakPolarHBondContact O-CB 3.24Å; N112-M116 PolarHBondContact O-N 3.47Å
113	S	79.3	Confident	77.3	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.014	34%	0.339	C	S	.	.	H	α-helix	trans	-65.4	-30.7	177.2	-168.2	0	0	0	0	113.3	W109 F110 F111 L633	W109-S113 VanDerWaalsContact O-CB 3.29Å; W109-S113 WeakPolarHBondContact O-CB 3.44Å; W109-S113 PolarHBondContact O-N 2.95Å; F110-S113 PolarHBondContact O-N 3.08Å; F111-S113 VanDerWaalsContact C-N 3.28Å; F111-S113 PolarHBondContact O-N 2.87Å; S113-L633 WeakPolarHBondContact OG-CD1 3.21Å; S113-L633 PolarHBondContact OG-O 2.71Å
114	I	81	Confident	78.3	Confident	103 Å²	103	70.9 Å²	70.9	53%	0.528	36%	0.357	S	S	.	.	H	α-helix	trans	-82.3	-38.7	177.6	-63.4	170.7	0	0	0	110.6	F110 F111 N112 L633	F110-I114 HydrophobicContact CD1-CD1 4.01Å; F110-I114 HydrophobicContact CE1-CD1 3.5Å; F110-I114 HydrophobicContact CE2-CD1 4.44Å; F110-I114 HydrophobicContact CZ-CD1 3.75Å; F110-I114 WeakPolarHBondContact O-CG1 3.42Å; F110-I114 PolarHBondContact O-N 3.12Å; F111-I114 PolarHBondContact O-N 3.46Å; F111-I114 VanDerWaalsContact O-N 3.07Å; N112-I114 VanDerWaalsContact C-N 3.28Å; N112-I114 PolarHBondContact O-N 3.32Å; I114-L633 HydrophobicContact CG1-CD1 3.7Å
115	T	82	Confident	79.1	Confident	92 Å²	92	64.1 Å²	64.1	56%	0.564	33%	0.329	S	S	*	.	H	α-helix	trans	-81.3	-14.7	-177.5	55.8	0	0	0	0	114.1	F111 N112 K117	F111-T115 WeakPolarHBondContact O-CG2 3.37Å; F111-T115 PolarHBondContact O-N 2.86Å; F111-T115 PolarHBondContact O-OG1 3.35Å; N112-T115 WeakPolarHBondContact CA-OG1 3.13Å; N112-T115 PolarHBondContact O-N 3.49Å; N112-T115 PolarHBondContact O-OG1 3.23Å; T115-K117 PolarHBondContact O-N 3.37Å
116	M	81.5	Confident	79.7	Confident	6 Å²	6	64 Å²	64	3%	0.03	33%	0.327	C	S	.	.			trans	-64.8	124.2	-179	-177.4	177.2	70.5	0	0	111.2	M99 N112 L121 R636 Y640	M99-M116 HydrophobicContact CE-CB 4.44Å; M99-M116 HydrophobicContact CE-CG 4.07Å; N112-M116 VanDerWaalsContact O-CB 3.26Å; N112-M116 WeakPolarHBondContact O-CB 3.24Å; N112-M116 PolarHBondContact O-N 3.47Å; M116-L121 HydrophobicContact CE-CB 4.12Å; M116-L121 HydrophobicContact CE-CD1 3.85Å; M116-L121 HydrophobicContact CE-CD2 3.76Å; M116-L121 HydrophobicContact CE-CG 4.16Å; M116-L121 HydrophobicContact SD-CD1 4.44Å; M116-R636 HydrophobicContact CE-CB 4.19Å; M116-R636 PolarHBondContact O-NH2 3.47Å; M116-Y640 HydrophobicContact CE-CD2 4.41Å; M116-Y640 HydrophobicContact CE-CG 4.39Å; M116-Y640 HydrophobicContact SD-CD1 3.95Å; M116-Y640 HydrophobicContact SD-CD2 3.33Å; M116-Y640 WeakPolarHBondContact SD-CD2 3.48Å; M116-Y640 HydrophobicContact SD-CE1 4.42Å; M116-Y640 HydrophobicContact SD-CE2 3.87Å; M116-Y640 HydrophobicContact SD-CG 3.36Å
117	K	84.3	Confident	80.2	Confident	138 Å²	138	63.5 Å²	63.5	60%	0.6	33%	0.33	S	S	*	.			trans	-70.6	145	178	-65.4	178.5	179.1	-179.4	0	111	T115 E119 D120 L121	T115-K117 PolarHBondContact O-N 3.37Å; K117-E119 VanDerWaalsContact C-N 3.26Å; K117-E119 PolarHBondContact O-N 2.77Å; K117-D120 PolarHBondContact O-N 3.48Å; K117-L121 PolarHBondContact O-N 3.07Å
118	D	83	Confident	80.8	Confident	84 Å²	84	61 Å²	61	45%	0.449	31%	0.313	S	S	.	.	H	α-helix	trans	-60.5	-37.4	176.7	-69.6	-8.2	0	0	0	111.5	D120 L121 I122 R636	D118-D120 PolarHBondContact O-N 3.12Å; D118-L121 WeakPolarHBondContact O-CB 3.37Å; D118-L121 PolarHBondContact O-N 2.86Å; D118-I122 HydrophobicContact CB-CD1 4.35Å; D118-I122 VanDerWaalsContact O-CD1 3.28Å; D118-I122 WeakPolarHBondContact O-CD1 3.2Å; D118-I122 WeakPolarHBondContact O-CG1 3.46Å; D118-I122 PolarHBondContact O-N 3.32Å; D118-R636 IonicContact OD1-CZ 2.82Å; D118-R636 IonicContact OD1-NH1 2.64Å; D118-R636 PolarHBondContact OD1-NH1 3.49Å; D118-R636 IonicContact OD1-NH2 3.02Å; D118-R636 PolarHBondContact OD1-NH2 3.39Å
119	E	83.8	Confident	81.2	Confident	138 Å²	138	60.4 Å²	60.4	65%	0.645	31%	0.308	S	S	*	.	H	α-helix	trans	-60.2	-45.7	179.9	-65.4	176.8	179.6	0	0	112.5	K117 L121 I122 N123	K117-E119 VanDerWaalsContact C-N 3.26Å; K117-E119 PolarHBondContact O-N 2.77Å; E119-L121 VanDerWaalsContact C-N 3.27Å; E119-L121 PolarHBondContact O-N 2.79Å; E119-I122 PolarHBondContact O-N 3.46Å; E119-N123 WeakPolarHBondContact O-CB 3.35Å; E119-N123 PolarHBondContact O-N 3.02Å; E119-N123 PolarHBondContact O-ND2 2.91Å
120	D	82.3	Confident	81.6	Confident	44 Å²	44	64.3 Å²	64.3	24%	0.235	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-37.3	178.9	-63	-32.6	0	0	0	111.5	K117 D118 K124	K117-D120 PolarHBondContact O-N 3.48Å; D118-D120 PolarHBondContact O-N 3.12Å; D120-K124 PolarHBondContact O-N 3.41Å
121	L	81.7	Confident	82	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.016	31%	0.313	C	S	.	.	H	α-helix	trans	-68.9	-43.3	177.9	-179.1	61.9	0	0	0	112	M116 K117 D118 E119 K124 C125 I133 R636 Y640	M116-L121 HydrophobicContact CE-CB 4.12Å; M116-L121 HydrophobicContact CE-CD1 3.85Å; M116-L121 HydrophobicContact CE-CD2 3.76Å; M116-L121 HydrophobicContact CE-CG 4.16Å; M116-L121 HydrophobicContact SD-CD1 4.44Å; K117-L121 PolarHBondContact O-N 3.07Å; D118-L121 WeakPolarHBondContact O-CB 3.37Å; D118-L121 PolarHBondContact O-N 2.86Å; E119-L121 VanDerWaalsContact C-N 3.27Å; E119-L121 PolarHBondContact O-N 2.79Å; L121-K124 PolarHBondContact O-N 3.26Å; L121-C125 VanDerWaalsContact CD1-SG 3.58Å; L121-C125 VanDerWaalsContact O-CB 3.28Å; L121-C125 WeakPolarHBondContact O-CB 3.37Å; L121-C125 PolarHBondContact O-N 3.32Å; L121-C125 PolarHBondContact O-SG 3.47Å; L121-I133 HydrophobicContact CD2-CD1 3.11Å; L121-I133 HydrophobicContact CG-CD1 4.05Å; L121-R636 HydrophobicContact CD2-CG 4.32Å; L121-Y640 HydrophobicContact CD1-CD2 3.85Å; L121-Y640 HydrophobicContact CD1-CG 4.33Å
122	I	81.3	Confident	82.4	Confident	40 Å²	40	55.6 Å²	55.6	21%	0.205	29%	0.285	C	S	.	.	H	α-helix	trans	-66.1	-44.4	179.3	-64.4	159.6	0	0	0	110.2	D118 E119 K124 C125 G126 R130	D118-I122 HydrophobicContact CB-CD1 4.35Å; D118-I122 VanDerWaalsContact O-CD1 3.28Å; D118-I122 WeakPolarHBondContact O-CD1 3.2Å; D118-I122 WeakPolarHBondContact O-CG1 3.46Å; D118-I122 PolarHBondContact O-N 3.32Å; E119-I122 PolarHBondContact O-N 3.46Å; I122-K124 PolarHBondContact O-N 2.93Å; I122-C125 PolarHBondContact O-N 3.43Å; I122-G126 WeakPolarHBondContact O-CA 3.43Å; I122-G126 PolarHBondContact O-N 2.94Å; I122-R130 HydrophobicContact CD1-CB 4.27Å; I122-R130 HydrophobicContact CD1-CG 3.71Å; I122-R130 HydrophobicContact CG1-CB 3.88Å; I122-R130 HydrophobicContact CG1-CG 3.9Å; I122-R130 HydrophobicContact CG2-CB 4.43Å
123	N	80.3	Confident	83	Confident	137 Å²	137	55.4 Å²	55.4	73%	0.733	28%	0.284	S	S	*	.	H	α-helix	trans	-60.7	-34.5	178.7	-71.7	-20.7	0	0	0	112.2	E119	E119-N123 WeakPolarHBondContact O-CB 3.35Å; E119-N123 PolarHBondContact O-N 3.02Å; E119-N123 PolarHBondContact O-ND2 2.91Å
124	K	79.9	Confident	83.5	Confident	90 Å²	90	56.8 Å²	56.8	39%	0.391	29%	0.292	S	S	.	.	H	α-helix	trans	-81.8	-44.4	178.2	-171	175.4	-173.2	177	0	113.5	D120 L121 I122 Y640	D120-K124 PolarHBondContact O-N 3.41Å; L121-K124 PolarHBondContact O-N 3.26Å; I122-K124 PolarHBondContact O-N 2.93Å; K124-Y640 HydrophobicContact CB-CE2 4.35Å; K124-Y640 HydrophobicContact CD-CD2 3.79Å; K124-Y640 HydrophobicContact CD-CE1 4.44Å; K124-Y640 HydrophobicContact CD-CE2 3.71Å; K124-Y640 HydrophobicContact CD-CG 4.23Å; K124-Y640 WeakPolarHBondContact CE-O 3.41Å; K124-Y640 PolarHBondContact NZ-O 3.2Å
125	C	78.8	Confident	84.1	Confident	13 Å²	13	51.9 Å²	51.9	9%	0.088	27%	0.267	C	S	.	.	H	α-helix	trans	-98.3	-16.5	-167.8	-57.9	0	0	0	0	114	L121 I122 A129	L121-C125 VanDerWaalsContact CD1-SG 3.58Å; L121-C125 VanDerWaalsContact O-CB 3.28Å; L121-C125 WeakPolarHBondContact O-CB 3.37Å; L121-C125 PolarHBondContact O-N 3.32Å; L121-C125 PolarHBondContact O-SG 3.47Å; I122-C125 PolarHBondContact O-N 3.43Å; C125-A129 HydrophobicContact CB-CB 3.39Å
126	G	80.3	Confident	84.6	Confident	31 Å²	31	47.7 Å²	47.7	32%	0.32	24%	0.241	S	C	.	.			trans	88.7	-177.6	-178.2	0	0	0	0	0	114.7	I122 A129	I122-G126 WeakPolarHBondContact O-CA 3.43Å; I122-G126 PolarHBondContact O-N 2.94Å; G126-A129 WeakPolarHBondContact O-CB 3.38Å; G126-A129 PolarHBondContact O-N 2.8Å
127	D	79.7	Confident	85.1	Confident	105 Å²	105	53.6 Å²	53.6	56%	0.561	26%	0.264	S	S	*	.	H	α-helix	trans	-69.6	-34.1	-173.8	-68.5	-45.2	0	0	0	113.9	A129 R130 I131	D127-A129 PolarHBondContact O-N 3.1Å; D127-R130 WeakPolarHBondContact O-CA 3.44Å; D127-R130 WeakPolarHBondContact O-CB 3.5Å; D127-R130 PolarHBondContact O-N 3.48Å; D127-I131 WeakPolarHBondContact O-CG1 3.29Å; D127-I131 PolarHBondContact O-N 2.86Å
128	D	84.3	Confident	85.5	Confident	17 Å²	17	47.6 Å²	47.6	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-61.3	-36.7	178.7	-65.3	-36.9	0	0	0	111.4	I131 Y132 F596 K647 L648 H653	D128-I131 PolarHBondContact O-N 3.36Å; D128-Y132 WeakPolarHBondContact O-CB 3.42Å; D128-Y132 PolarHBondContact O-N 3.42Å; D128-F596 HydrophobicContact CB-CE2 4.25Å; D128-F596 HydrophobicContact CB-CZ 3.96Å; D128-K647 WeakPolarHBondContact OD2-CA 3.22Å; D128-L648 PolarHBondContact OD2-N 3Å; D128-H653 PolarHBondContact O-CE1 3.3Å; D128-H653 VanDerWaalsContact O-CE1 3.31Å; D128-H653 IonicContact OD1-NE2 2.59Å; D128-H653 PolarHBondContact OD1-NE2 2.94Å
129	A	86.1	Confident	86	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-41.1	174.4	0	0	0	0	0	112.1	C125 G126 D127 Y132 I133 M639	C125-A129 HydrophobicContact CB-CB 3.39Å; G126-A129 WeakPolarHBondContact O-CB 3.38Å; G126-A129 PolarHBondContact O-N 2.8Å; D127-A129 PolarHBondContact O-N 3.1Å; A129-Y132 PolarHBondContact O-N 2.75Å; A129-I133 WeakPolarHBondContact O-CB 3.45Å; A129-I133 VanDerWaalsContact O-CG1 3.26Å; A129-I133 WeakPolarHBondContact O-CG1 3.5Å; A129-I133 PolarHBondContact O-N 2.96Å; A129-M639 HydrophobicContact CB-CE 3.21Å
130	R	86.4	Confident	86.6	Confident	91 Å²	91	38 Å²	38	34%	0.343	19%	0.191	S	C	.	.	H	α-helix	trans	-58.3	-51	174.8	-171.1	179.7	166.5	-99	-2.8	111.1	I122 D127 Y132 I133 V134	I122-R130 HydrophobicContact CD1-CB 4.27Å; I122-R130 HydrophobicContact CD1-CG 3.71Å; I122-R130 HydrophobicContact CG1-CB 3.88Å; I122-R130 HydrophobicContact CG1-CG 3.9Å; I122-R130 HydrophobicContact CG2-CB 4.43Å; D127-R130 WeakPolarHBondContact O-CA 3.44Å; D127-R130 WeakPolarHBondContact O-CB 3.5Å; D127-R130 PolarHBondContact O-N 3.48Å; R130-Y132 VanDerWaalsContact C-N 3.31Å; R130-Y132 PolarHBondContact O-N 3.4Å; R130-I133 PolarHBondContact O-N 3.25Å; R130-V134 HydrophobicContact CG-CG2 4.43Å; R130-V134 WeakPolarHBondContact O-CB 3.02Å; R130-V134 VanDerWaalsContact O-CG2 3.26Å; R130-V134 WeakPolarHBondContact O-CG2 3.48Å; R130-V134 PolarHBondContact O-N 2.99Å
131	I	87.4	Confident	87.2	Confident	19 Å²	19	38.4 Å²	38.4	10%	0.097	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-43	-177.7	-62	167.2	0	0	0	110.2	D127 D128 F135 F210 H653	D127-I131 WeakPolarHBondContact O-CG1 3.29Å; D127-I131 PolarHBondContact O-N 2.86Å; D128-I131 PolarHBondContact O-N 3.36Å; I131-F135 VanDerWaalsContact O-CB 3.25Å; I131-F135 WeakPolarHBondContact O-CB 3.43Å; I131-F135 PolarHBondContact O-N 3.35Å; I131-F210 HydrophobicContact CG1-CD1 4.44Å; I131-H653 HydrophobicContact CG2-CB 3.7Å; I131-H653 VanDerWaalsContact CG2-CG 3.47Å
132	Y	90.4	Very high	87.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-48.9	177.2	179.9	-98.2	0	0	0	113.4	D128 A129 R130 F135 Q136 F594 F596 E599 Y600 M603 D635 M639	D128-Y132 WeakPolarHBondContact O-CB 3.42Å; D128-Y132 PolarHBondContact O-N 3.42Å; A129-Y132 PolarHBondContact O-N 2.75Å; R130-Y132 VanDerWaalsContact C-N 3.31Å; R130-Y132 PolarHBondContact O-N 3.4Å; Y132-F135 WeakPolarHBondContact O-CB 3.31Å; Y132-F135 PolarHBondContact O-N 3.44Å; Y132-Q136 HydrophobicContact CE1-CG 4.35Å; Y132-Q136 WeakPolarHBondContact O-CG 3.29Å; Y132-Q136 PolarHBondContact O-N 2.8Å; Y132-Q136 PolarHBondContact OH-NE2 3.46Å; Y132-F594 HydrophobicContact CD1-CE1 4.36Å; Y132-F594 HydrophobicContact CE1-CE1 4.16Å; Y132-F594 HydrophobicContact CE1-CZ 4.01Å; Y132-F596 AromaticContact CD2-CD1 3.83Å; Y132-F596 HydrophobicContact CD2-CD1 3.83Å; Y132-F596 HydrophobicContact CD2-CE1 4.17Å; Y132-F596 HydrophobicContact CG-CD1 4.02Å; Y132-F596 AromaticContact CG-CE1 3.86Å; Y132-F596 HydrophobicContact CG-CE1 3.86Å; Y132-E599 HydrophobicContact CE2-CB 4.32Å; Y132-E599 WeakPolarHBondContact OH-CB 3.26Å; Y132-Y600 WeakPolarHBondContact CA-OH 3.46Å; Y132-Y600 HydrophobicContact CD2-CD1 4.19Å; Y132-Y600 HydrophobicContact CD2-CD2 4.14Å; Y132-Y600 AromaticContact CD2-CE1 3.67Å; Y132-Y600 HydrophobicContact CD2-CE1 3.67Å; Y132-Y600 AromaticContact CD2-CE2 3.61Å; Y132-Y600 HydrophobicContact CD2-CE2 3.61Å; Y132-Y600 HydrophobicContact CD2-CG 4.41Å; Y132-Y600 AromaticContact CD2-CZ 3.36Å; Y132-Y600 HydrophobicContact CE2-CD1 4.02Å; Y132-Y600 HydrophobicContact CE2-CD2 4.26Å; Y132-Y600 AromaticContact CE2-CE1 3.94Å; Y132-Y600 HydrophobicContact CE2-CE1 3.94Å; Y132-Y600 HydrophobicContact CE2-CE2 4.18Å; Y132-Y600 HydrophobicContact CE2-CG 4.19Å; Y132-M603 HydrophobicContact CE2-CE 4.18Å; Y132-D635 HydrophobicContact CE1-CB 4.06Å; Y132-D635 WeakPolarHBondContact CE1-OD2 3.39Å; Y132-D635 PolarHBondContact OH-OD2 3.42Å; Y132-M639 HydrophobicContact CD1-CE 4.5Å; Y132-M639 HydrophobicContact CD1-SD 3.9Å; Y132-M639 HydrophobicContact CE1-SD 4.16Å
133	I	90.3	Very high	88.6	Confident	10 Å²	10	36.4 Å²	36.4	5%	0.051	18%	0.182	C	C	.	.	H	α-helix	trans	-70.3	-40	-176.2	-68.9	172.5	0	0	0	111.2	L121 A129 R130 F135 Q136 Y137 H632 R636 M639	L121-I133 HydrophobicContact CD2-CD1 3.11Å; L121-I133 HydrophobicContact CG-CD1 4.05Å; A129-I133 WeakPolarHBondContact O-CB 3.45Å; A129-I133 VanDerWaalsContact O-CG1 3.26Å; A129-I133 WeakPolarHBondContact O-CG1 3.5Å; A129-I133 PolarHBondContact O-N 2.96Å; R130-I133 PolarHBondContact O-N 3.25Å; I133-F135 VanDerWaalsContact C-N 3.3Å; I133-F135 PolarHBondContact O-N 3.37Å; I133-Q136 WeakPolarHBondContact O-CB 3.17Å; I133-Q136 PolarHBondContact O-N 2.84Å; I133-Y137 PolarHBondContact O-N 2.87Å; I133-H632 VanDerWaalsContact CG2-CE1 3.48Å; I133-H632 WeakPolarHBondContact CG2-CE1 3.38Å; I133-R636 HydrophobicContact CD1-CG 4.11Å; I133-R636 HydrophobicContact CG1-CG 4.47Å; I133-R636 HydrophobicContact CG2-CG 4.33Å; I133-M639 HydrophobicContact CD1-CE 4.24Å; I133-M639 HydrophobicContact CD1-SD 4.39Å; I133-M639 HydrophobicContact CG1-SD 4.48Å
134	V	89.4	Confident	89.3	Confident	30 Å²	30	34.2 Å²	34.2	18%	0.182	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-37.2	175.8	177.4	0	0	0	0	110.8	R130 Y137 H138 F210	R130-V134 HydrophobicContact CG-CG2 4.43Å; R130-V134 WeakPolarHBondContact O-CB 3.02Å; R130-V134 VanDerWaalsContact O-CG2 3.26Å; R130-V134 WeakPolarHBondContact O-CG2 3.48Å; R130-V134 PolarHBondContact O-N 2.99Å; V134-Y137 WeakPolarHBondContact O-CB 3.37Å; V134-Y137 PolarHBondContact O-N 2.93Å; V134-H138 WeakPolarHBondContact CG1-CE1 3.35Å; V134-H138 WeakPolarHBondContact CG1-ND1 3.44Å; V134-H138 PolarHBondContact O-N 3.39Å; V134-H138 PolarHBondContact O-ND1 3.28Å; V134-F210 HydrophobicContact CB-CE2 4.35Å; V134-F210 HydrophobicContact CB-CZ 3.98Å; V134-F210 HydrophobicContact CG1-CE1 4.39Å; V134-F210 HydrophobicContact CG1-CE2 3.5Å; V134-F210 HydrophobicContact CG1-CZ 3.37Å; V134-F210 HydrophobicContact CG2-CZ 4.26Å
135	F	92	Very high	90	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-46.2	173.9	174.3	-104.5	0	0	0	112.1	I131 Y132 I133 Y137 H138 L139 M203 H206 Y600 M603 M604 A656 V657 A660	I131-F135 VanDerWaalsContact O-CB 3.25Å; I131-F135 WeakPolarHBondContact O-CB 3.43Å; I131-F135 PolarHBondContact O-N 3.35Å; Y132-F135 WeakPolarHBondContact O-CB 3.31Å; Y132-F135 PolarHBondContact O-N 3.44Å; I133-F135 VanDerWaalsContact C-N 3.3Å; I133-F135 PolarHBondContact O-N 3.37Å; F135-Y137 VanDerWaalsContact C-N 3.3Å; F135-Y137 PolarHBondContact O-N 3.13Å; F135-H138 PolarHBondContact O-N 3.14Å; F135-L139 HydrophobicContact CD1-CD1 4.09Å; F135-L139 HydrophobicContact CE1-CD1 3.6Å; F135-L139 HydrophobicContact CE1-CG 4.47Å; F135-L139 HydrophobicContact CE2-CD1 4.4Å; F135-L139 HydrophobicContact CZ-CD1 3.77Å; F135-L139 HydrophobicContact CZ-CG 4.36Å; F135-L139 PolarHBondContact O-N 2.95Å; F135-L139 VanDerWaalsContact O-N 3.12Å; F135-M203 HydrophobicContact CE2-SD 3.94Å; F135-H206 WeakPolarHBondContact CA-NE2 3.43Å; F135-H206 AromaticContact CD2-CE1 3.99Å; F135-Y600 HydrophobicContact CD1-CD1 4.28Å; F135-Y600 AromaticContact CD1-CE1 3.52Å; F135-Y600 HydrophobicContact CD1-CE1 3.52Å; F135-Y600 AromaticContact CE1-CD1 4Å; F135-Y600 HydrophobicContact CE1-CD1 4Å; F135-Y600 AromaticContact CE1-CE1 3.64Å; F135-Y600 HydrophobicContact CE1-CE1 3.64Å; F135-Y600 HydrophobicContact CG-CE1 4.33Å; F135-M603 HydrophobicContact CD1-CE 3.83Å; F135-M603 HydrophobicContact CE1-CE 3.62Å; F135-M604 HydrophobicContact CE1-CE 3.69Å; F135-M604 HydrophobicContact CE1-SD 4.03Å; F135-M604 HydrophobicContact CZ-CE 3.91Å; F135-M604 HydrophobicContact CZ-SD 3.74Å; F135-A656 HydrophobicContact CE1-CB 4.27Å; F135-A656 HydrophobicContact CZ-CB 4.19Å; F135-V657 HydrophobicContact CD2-CG2 4.03Å; F135-V657 HydrophobicContact CE2-CG2 3.88Å; F135-A660 HydrophobicContact CE2-CB 4.32Å; F135-A660 HydrophobicContact CZ-CB 4.13Å
136	Q	93.9	Very high	90.8	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.014	16%	0.163	C	C	.	.	H	α-helix	trans	-56.6	-44.9	173.6	-70.1	-176.2	-24.8	0	0	112.1	Y132 I133 H138 L139 I140 M603 H632 D635	Y132-Q136 HydrophobicContact CE1-CG 4.35Å; Y132-Q136 WeakPolarHBondContact O-CG 3.29Å; Y132-Q136 PolarHBondContact O-N 2.8Å; Y132-Q136 PolarHBondContact OH-NE2 3.46Å; I133-Q136 WeakPolarHBondContact O-CB 3.17Å; I133-Q136 PolarHBondContact O-N 2.84Å; Q136-H138 VanDerWaalsContact C-N 3.34Å; Q136-H138 PolarHBondContact O-N 3.06Å; Q136-L139 WeakPolarHBondContact O-CB 3.34Å; Q136-L139 PolarHBondContact O-N 2.96Å; Q136-L139 VanDerWaalsContact O-N 3.15Å; Q136-I140 WeakPolarHBondContact O-CG1 3.3Å; Q136-I140 PolarHBondContact O-N 3.07Å; Q136-M603 HydrophobicContact CG-CE 4.2Å; Q136-M603 HydrophobicContact CG-SD 3.64Å; Q136-H632 PolarHBondContact OE1-ND1 3.03Å; Q136-H632 VanDerWaalsContact OE1-ND1 3.12Å; Q136-D635 PolarHBondContact NE2-OD2 3.07Å
137	Y	91.8	Very high	91.5	Very high	130 Å²	130	31.6 Å²	31.6	51%	0.51	15%	0.153	S	C	.	.	H	α-helix	trans	-61.2	-41.2	179.2	-174.9	-104.5	0	0	0	112.5	I133 V134 F135 L139 I140 I141	I133-Y137 PolarHBondContact O-N 2.87Å; V134-Y137 WeakPolarHBondContact O-CB 3.37Å; V134-Y137 PolarHBondContact O-N 2.93Å; F135-Y137 VanDerWaalsContact C-N 3.3Å; F135-Y137 PolarHBondContact O-N 3.13Å; Y137-L139 VanDerWaalsContact C-N 3.33Å; Y137-L139 PolarHBondContact O-N 3.09Å; Y137-I140 PolarHBondContact O-N 3.3Å; Y137-I141 HydrophobicContact CD1-CD1 3.75Å; Y137-I141 HydrophobicContact CE1-CD1 3.24Å; Y137-I141 HydrophobicContact CE1-CG1 4.23Å; Y137-I141 HydrophobicContact CE2-CD1 4.47Å; Y137-I141 WeakPolarHBondContact O-CG1 3.31Å; Y137-I141 PolarHBondContact O-N 3.04Å
138	H	92	Very high	92.2	Very high	13 Å²	13	32.6 Å²	32.6	6%	0.06	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-38.1	174.8	-75.1	75.8	0	0	0	112.1	V134 F135 Q136 F142 H205 H206	V134-H138 WeakPolarHBondContact CG1-CE1 3.35Å; V134-H138 WeakPolarHBondContact CG1-ND1 3.44Å; V134-H138 PolarHBondContact O-N 3.39Å; V134-H138 PolarHBondContact O-ND1 3.28Å; F135-H138 PolarHBondContact O-N 3.14Å; Q136-H138 VanDerWaalsContact C-N 3.34Å; Q136-H138 PolarHBondContact O-N 3.06Å; H138-F142 WeakPolarHBondContact O-CB 3.45Å; H138-F142 PolarHBondContact O-N 3.47Å; H138-H205 AromaticContact NE2-ND1 3.95Å; H138-H206 AromaticContact CE1-CD2 3.96Å; H138-H206 AromaticContact CG-CD2 3.93Å; H138-H206 AromaticContact ND1-CD2 3.69Å
139	L	94.8	Very high	92.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-39.8	175.1	-66.9	176.6	0	0	0	112.3	F135 Q136 Y137 F142 V143 M203 M603 M604 F607 L628	F135-L139 HydrophobicContact CD1-CD1 4.09Å; F135-L139 HydrophobicContact CE1-CD1 3.6Å; F135-L139 HydrophobicContact CE1-CG 4.47Å; F135-L139 HydrophobicContact CE2-CD1 4.4Å; F135-L139 HydrophobicContact CZ-CD1 3.77Å; F135-L139 HydrophobicContact CZ-CG 4.36Å; F135-L139 PolarHBondContact O-N 2.95Å; F135-L139 VanDerWaalsContact O-N 3.12Å; Q136-L139 WeakPolarHBondContact O-CB 3.34Å; Q136-L139 PolarHBondContact O-N 2.96Å; Q136-L139 VanDerWaalsContact O-N 3.15Å; Y137-L139 VanDerWaalsContact C-N 3.33Å; Y137-L139 PolarHBondContact O-N 3.09Å; L139-F142 PolarHBondContact O-N 3.39Å; L139-V143 WeakPolarHBondContact O-CB 3.28Å; L139-V143 WeakPolarHBondContact O-CG2 3.31Å; L139-V143 PolarHBondContact O-N 3.28Å; L139-M203 HydrophobicContact CD2-CE 3.87Å; L139-M203 HydrophobicContact CD2-SD 4.46Å; L139-M603 HydrophobicContact CD1-SD 4.33Å; L139-M604 HydrophobicContact CD1-CE 3.32Å; L139-M604 HydrophobicContact CD1-SD 4.47Å; L139-F607 HydrophobicContact CD2-CD2 4.4Å; L139-F607 HydrophobicContact CD2-CE1 4.27Å; L139-F607 HydrophobicContact CD2-CE2 4.04Å; L139-F607 HydrophobicContact CD2-CZ 3.97Å; L139-L628 HydrophobicContact CB-CD1 4.09Å
140	I	95.9	Very high	93.1	Very high	21 Å²	21	32.5 Å²	32.5	11%	0.108	16%	0.157	C	C	.	.	H	α-helix	trans	-59.2	-49.9	175.2	-69.7	166.5	0	0	0	110.3	Q136 Y137 F142 V143 L144 L625 L628 H632	Q136-I140 WeakPolarHBondContact O-CG1 3.3Å; Q136-I140 PolarHBondContact O-N 3.07Å; Y137-I140 PolarHBondContact O-N 3.3Å; I140-F142 VanDerWaalsContact C-N 3.33Å; I140-F142 PolarHBondContact O-N 3.15Å; I140-V143 PolarHBondContact O-N 2.84Å; I140-L144 VanDerWaalsContact O-CB 3.31Å; I140-L144 WeakPolarHBondContact O-CB 3.39Å; I140-L144 PolarHBondContact O-N 2.69Å; I140-L625 HydrophobicContact CG2-CD1 3.99Å; I140-L628 HydrophobicContact CG1-CB 3.66Å; I140-H632 HydrophobicContact CD1-CB 3.74Å
141	I	95.3	Very high	93.4	Very high	52 Å²	52	31.1 Å²	31.1	27%	0.267	16%	0.156	S	C	.	.	H	α-helix	trans	-60.2	-45.4	178.1	-67.8	171.3	0	0	0	110.6	Y137 L144 I145 F202	Y137-I141 HydrophobicContact CD1-CD1 3.75Å; Y137-I141 HydrophobicContact CE1-CD1 3.24Å; Y137-I141 HydrophobicContact CE1-CG1 4.23Å; Y137-I141 HydrophobicContact CE2-CD1 4.47Å; Y137-I141 WeakPolarHBondContact O-CG1 3.31Å; Y137-I141 PolarHBondContact O-N 3.04Å; I141-L144 WeakPolarHBondContact O-CB 3.49Å; I141-L144 PolarHBondContact O-N 3.08Å; I141-I145 HydrophobicContact CG2-CD1 3.85Å; I141-I145 HydrophobicContact CG2-CG1 4.48Å; I141-I145 WeakPolarHBondContact O-CG1 3.31Å; I141-I145 PolarHBondContact O-N 3.14Å; I141-F202 HydrophobicContact CB-CE1 4.23Å; I141-F202 HydrophobicContact CG2-CE1 3.64Å; I141-F202 HydrophobicContact CG2-CZ 3.86Å
142	F	95.1	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-48	178.8	168.1	-103.9	0	0	0	112	H138 L139 I140 L144 I145 I146 T198 N199 F202 F607 M611	H138-F142 WeakPolarHBondContact O-CB 3.45Å; H138-F142 PolarHBondContact O-N 3.47Å; L139-F142 PolarHBondContact O-N 3.39Å; I140-F142 VanDerWaalsContact C-N 3.33Å; I140-F142 PolarHBondContact O-N 3.15Å; F142-L144 VanDerWaalsContact C-N 3.31Å; F142-L144 PolarHBondContact O-N 2.59Å; F142-I145 PolarHBondContact O-N 3.11Å; F142-I146 HydrophobicContact CD2-CG2 4.42Å; F142-I146 HydrophobicContact CE1-CD1 4.04Å; F142-I146 HydrophobicContact CE2-CG2 3.78Å; F142-I146 HydrophobicContact CZ-CD1 4.22Å; F142-I146 HydrophobicContact CZ-CG2 3.85Å; F142-I146 PolarHBondContact O-N 3.24Å; F142-I146 VanDerWaalsContact O-N 3.11Å; F142-T198 HydrophobicContact CD2-CG2 4.11Å; F142-T198 HydrophobicContact CE2-CG2 4.09Å; F142-N199 HydrophobicContact CD2-CB 4.39Å; F142-N199 HydrophobicContact CE1-CB 4.28Å; F142-N199 WeakPolarHBondContact CE1-ND2 3.11Å; F142-N199 HydrophobicContact CE2-CB 3.64Å; F142-N199 HydrophobicContact CZ-CB 3.58Å; F142-F202 HydrophobicContact CB-CD1 4.27Å; F142-F202 HydrophobicContact CB-CG 4.42Å; F142-F607 AromaticContact CD1-CE2 3.8Å; F142-F607 HydrophobicContact CD1-CE2 3.8Å; F142-F607 AromaticContact CD1-CZ 3.88Å; F142-F607 HydrophobicContact CD1-CZ 3.88Å; F142-F607 AromaticContact CE1-CE2 3.76Å; F142-F607 HydrophobicContact CE1-CE2 3.76Å; F142-F607 AromaticContact CE1-CZ 3.62Å; F142-F607 HydrophobicContact CE1-CZ 3.62Å; F142-M611 HydrophobicContact CE1-CE 4Å; F142-M611 HydrophobicContact CE1-SD 3.58Å; F142-M611 VanDerWaalsContact CE1-SD 3.58Å; F142-M611 HydrophobicContact CZ-CE 3.81Å; F142-M611 HydrophobicContact CZ-SD 4.02Å
143	V	96	Very high	93.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.7	-36.8	178.7	176.4	0	0	0	0	111.4	L139 I140 I145 I146 C147 F607 V621 L625 L628	L139-V143 WeakPolarHBondContact O-CB 3.28Å; L139-V143 WeakPolarHBondContact O-CG2 3.31Å; L139-V143 PolarHBondContact O-N 3.28Å; I140-V143 PolarHBondContact O-N 2.84Å; V143-I145 VanDerWaalsContact C-N 3.35Å; V143-I145 PolarHBondContact O-N 3.21Å; V143-I146 WeakPolarHBondContact O-CG1 3.29Å; V143-I146 PolarHBondContact O-N 2.9Å; V143-C147 WeakPolarHBondContact O-CB 3.16Å; V143-C147 PolarHBondContact O-N 2.93Å; V143-F607 HydrophobicContact CG2-CD2 4.17Å; V143-F607 HydrophobicContact CG2-CE2 3.85Å; V143-V621 HydrophobicContact CG1-CG1 4.09Å; V143-L625 HydrophobicContact CB-CD1 4.45Å; V143-L625 HydrophobicContact CG1-CB 3.94Å; V143-L625 HydrophobicContact CG1-CD1 4.36Å; V143-L628 HydrophobicContact CB-CD1 4.05Å; V143-L628 HydrophobicContact CG2-CD1 3.55Å
144	L	95.9	Very high	94	Very high	92 Å²	92	35.8 Å²	35.8	48%	0.482	19%	0.193	S	C	.	.	H	α-helix	trans	-60.5	-43.7	173.4	-177.9	70.8	0	0	0	111.6	I140 I141 F142 C147 L625	I140-L144 VanDerWaalsContact O-CB 3.31Å; I140-L144 WeakPolarHBondContact O-CB 3.39Å; I140-L144 PolarHBondContact O-N 2.69Å; I141-L144 WeakPolarHBondContact O-CB 3.49Å; I141-L144 PolarHBondContact O-N 3.08Å; F142-L144 VanDerWaalsContact C-N 3.31Å; F142-L144 PolarHBondContact O-N 2.59Å; L144-C147 WeakPolarHBondContact O-CB 3.45Å; L144-C147 PolarHBondContact O-N 3.22Å; L144-L625 HydrophobicContact CB-CD1 4.21Å; L144-L625 HydrophobicContact CB-CD2 4.49Å; L144-L625 HydrophobicContact CD1-CD2 3.7Å
145	I	95.1	Very high	94.2	Very high	62 Å²	62	36.2 Å²	36.2	32%	0.318	19%	0.194	S	C	.	.	H	α-helix	trans	-63.4	-44.3	178.7	-70.9	166.3	0	0	0	111.4	I141 F142 V143 C147 P149 F202	I141-I145 HydrophobicContact CG2-CD1 3.85Å; I141-I145 HydrophobicContact CG2-CG1 4.48Å; I141-I145 WeakPolarHBondContact O-CG1 3.31Å; I141-I145 PolarHBondContact O-N 3.14Å; F142-I145 PolarHBondContact O-N 3.11Å; V143-I145 VanDerWaalsContact C-N 3.35Å; V143-I145 PolarHBondContact O-N 3.21Å; I145-C147 VanDerWaalsContact C-N 3.32Å; I145-P149 WeakPolarHBondContact O-CD 3.35Å; I145-F202 HydrophobicContact CD1-CE1 4.43Å; I145-F202 HydrophobicContact CD1-CE2 3.8Å; I145-F202 HydrophobicContact CD1-CZ 3.43Å; I145-F202 VanDerWaalsContact CD1-CZ 3.43Å
146	I	95.1	Very high	94.2	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-74.8	-21.3	179.3	65.3	173	0	0	0	113	F142 V143 I148 P149 S150 Y195 M611 V621	F142-I146 HydrophobicContact CD2-CG2 4.42Å; F142-I146 HydrophobicContact CE1-CD1 4.04Å; F142-I146 HydrophobicContact CE2-CG2 3.78Å; F142-I146 HydrophobicContact CZ-CD1 4.22Å; F142-I146 HydrophobicContact CZ-CG2 3.85Å; F142-I146 PolarHBondContact O-N 3.24Å; F142-I146 VanDerWaalsContact O-N 3.11Å; V143-I146 WeakPolarHBondContact O-CG1 3.29Å; V143-I146 PolarHBondContact O-N 2.9Å; I146-I148 VanDerWaalsContact C-N 3.26Å; I146-I148 PolarHBondContact O-N 2.64Å; I146-P149 VanDerWaalsContact O-CD 3.26Å; I146-P149 WeakPolarHBondContact O-CD 3.46Å; I146-P149 WeakPolarHBondContact O-CG 3.27Å; I146-S150 VanDerWaalsContact O-CB 3.31Å; I146-S150 WeakPolarHBondContact O-CB 3.41Å; I146-S150 PolarHBondContact O-N 3.24Å; I146-S150 PolarHBondContact O-OG 3.49Å; I146-Y195 HydrophobicContact CB-CD1 4.28Å; I146-Y195 HydrophobicContact CB-CD2 4.37Å; I146-Y195 HydrophobicContact CB-CE1 4.06Å; I146-Y195 HydrophobicContact CB-CE2 4.12Å; I146-Y195 HydrophobicContact CB-CG 4.46Å; I146-Y195 HydrophobicContact CG2-CD1 3.83Å; I146-Y195 HydrophobicContact CG2-CD2 4.36Å; I146-Y195 HydrophobicContact CG2-CE1 4.08Å; I146-Y195 HydrophobicContact CG2-CG 4.02Å; I146-Y195 PolarHBondContact O-OH 3.38Å; I146-M611 HydrophobicContact CD1-CE 4.2Å; I146-M611 HydrophobicContact CD1-SD 3.68Å; I146-V621 HydrophobicContact CD1-CG1 4.3Å; I146-V621 HydrophobicContact CG1-CG1 4.01Å
147	C	95.5	Very high	94.2	Very high	16 Å²	16	40 Å²	40	11%	0.108	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-37.9	175.9	-167.8	0	0	0	0	111.6	V143 L144 I145 S150 L151 V621	V143-C147 WeakPolarHBondContact O-CB 3.16Å; V143-C147 PolarHBondContact O-N 2.93Å; L144-C147 WeakPolarHBondContact O-CB 3.45Å; L144-C147 PolarHBondContact O-N 3.22Å; I145-C147 VanDerWaalsContact C-N 3.32Å; C147-S150 PolarHBondContact O-N 3.39Å; C147-L151 PolarHBondContact O-N 2.82Å; C147-V621 HydrophobicContact CB-CG1 3.83Å
148	I	94.3	Very high	94.1	Very high	125 Å²	125	33.8 Å²	33.8	64%	0.641	19%	0.193	S	C	*	.	H	α-helix	trans	-59.2	-58.3	179.8	-59.8	169.8	0	0	0	111.9	I146 S150 G152	I146-I148 VanDerWaalsContact C-N 3.26Å; I146-I148 PolarHBondContact O-N 2.64Å; I148-S150 VanDerWaalsContact C-N 3.34Å; I148-S150 PolarHBondContact O-N 3.22Å; I148-G152 WeakPolarHBondContact O-CA 3.15Å; I148-G152 PolarHBondContact O-N 3.45Å
149	P	94.6	Very high	93.9	Very high	17 Å²	17	38.6 Å²	38.6	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-30.1	176.3	24.2	-31.9	0	0	0	113.2	I145 I146 I153 I154 L191 Y195	I145-P149 WeakPolarHBondContact O-CD 3.35Å; I146-P149 VanDerWaalsContact O-CD 3.26Å; I146-P149 WeakPolarHBondContact O-CD 3.46Å; I146-P149 WeakPolarHBondContact O-CG 3.27Å; P149-I153 HydrophobicContact CB-CD1 4.24Å; P149-I153 WeakPolarHBondContact O-CA 3.36Å; P149-I153 VanDerWaalsContact O-CB 3.32Å; P149-I153 WeakPolarHBondContact O-CB 3.3Å; P149-I153 PolarHBondContact O-N 2.91Å; P149-I154 PolarHBondContact O-N 3.23Å; P149-I154 VanDerWaalsContact O-N 3.09Å; P149-L191 HydrophobicContact CB-CD2 4.33Å; P149-Y195 HydrophobicContact CB-CE1 4.42Å; P149-Y195 HydrophobicContact CG-CE1 3.77Å; P149-Y195 WeakPolarHBondContact CG-OH 3.3Å
150	S	93.4	Very high	93.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.242	C	C	.	.	I	π-helix	trans	-62.5	-48.1	177.3	-63.3	0	0	0	0	111.7	I146 C147 I148 I154 L155 Y195 P618	I146-S150 VanDerWaalsContact O-CB 3.31Å; I146-S150 WeakPolarHBondContact O-CB 3.41Å; I146-S150 PolarHBondContact O-N 3.24Å; I146-S150 PolarHBondContact O-OG 3.49Å; C147-S150 PolarHBondContact O-N 3.39Å; I148-S150 VanDerWaalsContact C-N 3.34Å; I148-S150 PolarHBondContact O-N 3.22Å; S150-I154 WeakPolarHBondContact O-CB 3.39Å; S150-L155 WeakPolarHBondContact O-CB 3.03Å; S150-L155 PolarHBondContact O-N 2.75Å; S150-Y195 PolarHBondContact N-OH 2.98Å; S150-Y195 PolarHBondContact OG-OH 3.39Å; S150-P618 WeakPolarHBondContact O-CB 3.34Å
151	L	93.7	Very high	93.1	Very high	62 Å²	62	43.3 Å²	43.3	33%	0.325	25%	0.245	S	C	.	.	I	π-helix	trans	-86.9	-33.1	-178.5	-61.7	-177.9	0	0	0	113.2	C147 L155 P156 P622	C147-L151 PolarHBondContact O-N 2.82Å; L151-L155 HydrophobicContact CD2-CD2 3.93Å; L151-P156 VanDerWaalsContact O-CD 3.24Å; L151-P156 WeakPolarHBondContact O-CD 3.41Å; L151-P622 HydrophobicContact CD1-CB 4.35Å; L151-P622 HydrophobicContact CD1-CG 4.17Å; L151-P622 HydrophobicContact CD2-CG 4.23Å
152	G	93.5	Very high	92.4	Very high	53 Å²	53	45.8 Å²	45.8	55%	0.546	27%	0.266	S	S	.	.	I	π-helix	trans	-83.8	-24.8	-176.3	0	0	0	0	0	114.5	I148	I148-G152 WeakPolarHBondContact O-CA 3.15Å; I148-G152 PolarHBondContact O-N 3.45Å
153	I	93.8	Very high	91.5	Very high	72 Å²	72	48.8 Å²	48.8	37%	0.369	29%	0.285	S	S	.	.	I	π-helix	trans	-122.2	-59.2	-174.3	-56.9	176.8	0	0	0	111	P149 P156 I157 L187 L191	P149-I153 HydrophobicContact CB-CD1 4.24Å; P149-I153 WeakPolarHBondContact O-CA 3.36Å; P149-I153 VanDerWaalsContact O-CB 3.32Å; P149-I153 WeakPolarHBondContact O-CB 3.3Å; P149-I153 PolarHBondContact O-N 2.91Å; I153-P156 WeakPolarHBondContact O-CD 3.3Å; I153-I157 HydrophobicContact CG2-CD1 3.9Å; I153-I157 WeakPolarHBondContact O-CD1 3.27Å; I153-I157 VanDerWaalsContact O-CG1 3.25Å; I153-I157 WeakPolarHBondContact O-CG1 3.41Å; I153-I157 PolarHBondContact O-N 2.84Å; I153-L187 HydrophobicContact CG2-CD2 3.26Å; I153-L187 HydrophobicContact CG2-CG 4.2Å; I153-L191 HydrophobicContact CG2-CD1 4.19Å
154	I	93.3	Very high	90.6	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	29%	0.29	C	S	.	.	I	π-helix	trans	-66.4	-48.7	-172.3	-59.2	179.8	0	0	0	111.1	P149 S150 I157 N158 L191 I615 P618	P149-I154 PolarHBondContact O-N 3.23Å; P149-I154 VanDerWaalsContact O-N 3.09Å; S150-I154 WeakPolarHBondContact O-CB 3.39Å; I154-I157 PolarHBondContact O-N 3.46Å; I154-N158 PolarHBondContact O-N 3.41Å; I154-L191 HydrophobicContact CD1-CB 4.35Å; I154-L191 HydrophobicContact CD1-CD1 3.79Å; I154-L191 HydrophobicContact CG1-CD1 3.52Å; I154-I615 HydrophobicContact CD1-CD1 3.5Å; I154-I615 VanDerWaalsContact CD1-CD1 3.5Å; I154-P618 HydrophobicContact CB-CB 4.33Å; I154-P618 HydrophobicContact CB-CG 4.38Å; I154-P618 HydrophobicContact CG2-CB 4.14Å; I154-P618 HydrophobicContact CG2-CG 3.87Å
155	L	92.4	Very high	89.4	Confident	40 Å²	40	50.3 Å²	50.3	21%	0.209	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-47.9	-176.9	176.1	67.6	0	0	0	113.4	S150 L151 I157 N158 Y159 T173 P618 I619	S150-L155 WeakPolarHBondContact O-CB 3.03Å; S150-L155 PolarHBondContact O-N 2.75Å; L151-L155 HydrophobicContact CD2-CD2 3.93Å; L155-I157 VanDerWaalsContact C-N 3.31Å; L155-I157 PolarHBondContact O-N 3.23Å; L155-N158 PolarHBondContact O-N 2.63Å; L155-Y159 WeakPolarHBondContact O-CB 3.43Å; L155-Y159 PolarHBondContact O-N 3.43Å; L155-T173 HydrophobicContact CD1-CG2 4.16Å; L155-P618 HydrophobicContact CB-CB 4.34Å; L155-P618 HydrophobicContact CB-CG 3.8Å; L155-P618 HydrophobicContact CD1-CG 4.12Å; L155-I619 HydrophobicContact CD1-CD1 4.14Å; L155-I619 HydrophobicContact CD1-CG1 3.94Å
156	P	93.8	Very high	88.2	Confident	60 Å²	60	56.6 Å²	56.6	39%	0.39	31%	0.313	S	S	.	.	H	α-helix	trans	-59.3	-39.3	174.4	-27.5	35	0	0	0	113.4	L151 I153 Y159 T160	L151-P156 VanDerWaalsContact O-CD 3.24Å; L151-P156 WeakPolarHBondContact O-CD 3.41Å; I153-P156 WeakPolarHBondContact O-CD 3.3Å; P156-Y159 PolarHBondContact O-N 2.74Å; P156-T160 WeakPolarHBondContact O-CB 3.45Å; P156-T160 WeakPolarHBondContact O-CG2 3.44Å; P156-T160 PolarHBondContact O-N 2.83Å; P156-T160 PolarHBondContact O-OG1 3.45Å
157	I	92	Very high	86.8	Confident	23 Å²	23	59.8 Å²	59.8	12%	0.118	34%	0.335	C	S	.	.	H	α-helix	trans	-64.5	-43.6	177.8	-70.7	169.1	0	0	0	110.9	I153 I154 L155 T160 G161 V178 L184 L187	I153-I157 HydrophobicContact CG2-CD1 3.9Å; I153-I157 WeakPolarHBondContact O-CD1 3.27Å; I153-I157 VanDerWaalsContact O-CG1 3.25Å; I153-I157 WeakPolarHBondContact O-CG1 3.41Å; I153-I157 PolarHBondContact O-N 2.84Å; I154-I157 PolarHBondContact O-N 3.46Å; L155-I157 VanDerWaalsContact C-N 3.31Å; L155-I157 PolarHBondContact O-N 3.23Å; I157-T160 WeakPolarHBondContact CA-OG1 3.49Å; I157-T160 PolarHBondContact O-OG1 3.34Å; I157-G161 PolarHBondContact O-N 3.48Å; I157-V178 HydrophobicContact CG2-CG2 4.22Å; I157-L184 HydrophobicContact CG2-CB 3.84Å; I157-L184 HydrophobicContact CG2-CD1 4.06Å; I157-L184 HydrophobicContact CG2-CG 4.45Å; I157-L187 HydrophobicContact CD1-CD2 3.29Å
158	N	90.3	Very high	85.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.3	-46.7	175	-70.7	-12.3	0	0	0	111	I154 L155 T160 G161 R172 T173 T174 I175 N177 H188	I154-N158 PolarHBondContact O-N 3.41Å; L155-N158 PolarHBondContact O-N 2.63Å; N158-T160 VanDerWaalsContact C-N 3.31Å; N158-T160 PolarHBondContact O-N 2.91Å; N158-G161 PolarHBondContact O-N 2.83Å; N158-G161 VanDerWaalsContact O-N 3.11Å; N158-R172 CarbonylContact C-O 3.53Å; N158-T173 WeakPolarHBondContact CB-O 3.38Å; N158-T173 PolarHBondContact ND2-O 3.02Å; N158-T174 VanDerWaalsContact CG-C 3.48Å; N158-I175 PolarHBondContact ND2-N 3.47Å; N158-N177 WeakPolarHBondContact O-CB 3.36Å; N158-N177 PolarHBondContact O-ND2 3.05Å; N158-H188 PolarHBondContact OD1-NE2 2.72Å
159	Y	89.1	Confident	84.6	Confident	114 Å²	114	59.7 Å²	59.7	45%	0.447	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-33.2	-176.2	-166	-102.7	0	0	0	113.8	L155 P156 G161 R172 T173	L155-Y159 WeakPolarHBondContact O-CB 3.43Å; L155-Y159 PolarHBondContact O-N 3.43Å; P156-Y159 PolarHBondContact O-N 2.74Å; Y159-G161 VanDerWaalsContact C-N 3.28Å; Y159-G161 PolarHBondContact O-N 3.1Å; Y159-R172 VanDerWaalsContact CA-O 3.28Å; Y159-R172 WeakPolarHBondContact CA-O 3.12Å; Y159-R172 HydrophobicContact CD2-CB 4.36Å; Y159-R172 PolarHBondContact N-O 2.75Å; Y159-R172 PolarHBondContact O-NH2 3.37Å; Y159-T173 HydrophobicContact CD2-CG2 4.46Å
160	T	88.6	Confident	83.9	Confident	105 Å²	105	59.3 Å²	59.3	64%	0.644	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-6.5	177.1	50.2	0	0	0	0	114.1	P156 I157 N158	P156-T160 WeakPolarHBondContact O-CB 3.45Å; P156-T160 WeakPolarHBondContact O-CG2 3.44Å; P156-T160 PolarHBondContact O-N 2.83Å; P156-T160 PolarHBondContact O-OG1 3.45Å; I157-T160 WeakPolarHBondContact CA-OG1 3.49Å; I157-T160 PolarHBondContact O-OG1 3.34Å; N158-T160 VanDerWaalsContact C-N 3.31Å; N158-T160 PolarHBondContact O-N 2.91Å
161	G	84	Confident	83.1	Confident	15 Å²	15	59.9 Å²	59.9	16%	0.155	34%	0.335	C	S	.	.			trans	-59.9	153.1	174	0	0	0	0	0	113.4	I157 N158 Y159 N177	I157-G161 PolarHBondContact O-N 3.48Å; N158-G161 PolarHBondContact O-N 2.83Å; N158-G161 VanDerWaalsContact O-N 3.11Å; Y159-G161 VanDerWaalsContact C-N 3.28Å; Y159-G161 PolarHBondContact O-N 3.1Å; G161-N177 VanDerWaalsContact C-ND2 3.31Å; G161-N177 CarbonylContact C-O 3.59Å; G161-N177 WeakPolarHBondContact CA-ND2 3.24Å; G161-N177 WeakPolarHBondContact CA-O 3.2Å; G161-N177 PolarHBondContact O-ND2 3.28Å; G161-N177 PolarHBondContact O-OD1 3.32Å
162	S	81.1	Confident	82.6	Confident	103 Å²	103	57.6 Å²	57.6	72%	0.72	32%	0.322	S	S	*	.	S	Bend	trans	-112.1	5.4	-170.9	62.3	0	0	0	0	114.7	N177	S162-N177 PolarHBondContact N-O 3.34Å
163	V	77.1	Confident	82.3	Confident	63 Å²	63	55.4 Å²	55.4	38%	0.382	30%	0.298	S	S	.	.	S	Bend	trans	-81	-33.7	-172	178.4	0	0	0	0	112.5	N177	V163-N177 WeakPolarHBondContact CG2-O 3.36Å; V163-N177 PolarHBondContact N-O 3.37Å; V163-N177 PolarHBondContact N-OD1 3.47Å
164	L	75.2	Confident	82	Confident	24 Å²	24	52.3 Å²	52.3	13%	0.126	28%	0.282	C	S	.	.	S	Bend	trans	-104.9	145.6	-174.5	-72.3	153.1	0	0	0	112.6	A171 R172 V176 N177	L164-A171 HydrophobicContact CD1-CB 3.71Å; L164-A171 HydrophobicContact CD2-CB 4.32Å; L164-R172 HydrophobicContact CB-CG 4.14Å; L164-V176 HydrophobicContact CD1-CG1 4.22Å; L164-N177 WeakPolarHBondContact CB-OD1 3.38Å; L164-N177 HydrophobicContact CD1-CB 3.84Å; L164-N177 PolarHBondContact N-OD1 3.37Å
165	D	72.5	Confident	81.6	Confident	101 Å²	101	52.3 Å²	52.3	54%	0.54	28%	0.283	S	S	.	.			trans	-62.9	153.3	174.7	-73.3	-29.6	0	0	0	113.3	S167 S168	D165-S167 PolarHBondContact O-N 2.94Å; D165-S167 VanDerWaalsContact O-N 3.11Å; D165-S168 PolarHBondContact O-N 2.67Å
166	W	68.9	Low	81.1	Confident	194 Å²	194	50.7 Å²	50.7	74%	0.735	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24	178.9	-71.2	88.2	0	0	0	113.8	S168	W166-S168 VanDerWaalsContact C-N 3.25Å; W166-S168 PolarHBondContact O-N 3.33Å
167	S	66.7	Low	80.7	Confident	67 Å²	67	47.9 Å²	47.9	47%	0.469	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-12.6	176.3	51.3	0	0	0	0	114.3	R26 D165 H169	R26-S167 PolarHBondContact NH2-O 3.33Å; D165-S167 PolarHBondContact O-N 2.94Å; D165-S167 VanDerWaalsContact O-N 3.11Å; S167-H169 PolarHBondContact O-N 3.07Å
168	S	66.4	Low	80.4	Confident	28 Å²	28	47 Å²	47	20%	0.196	25%	0.251	C	S	.	.			trans	-96.5	65.2	-177.3	-62.7	0	0	0	0	110.8	D165 W166 F170 A171 R172	D165-S168 PolarHBondContact O-N 2.67Å; W166-S168 VanDerWaalsContact C-N 3.25Å; W166-S168 PolarHBondContact O-N 3.33Å; S168-F170 PolarHBondContact O-N 3.32Å; S168-A171 PolarHBondContact O-N 3Å; S168-R172 WeakPolarHBondContact O-CG 3.42Å; S168-R172 PolarHBondContact O-N 2.8Å
169	H	76.8	Confident	80.1	Confident	112 Å²	112	48.7 Å²	48.7	52%	0.519	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-54.3	-169	-62.3	-76.8	0	0	0	114.9	F35 S167	F35-H169 HydrophobicContact CD2-CB 3.93Å; S167-H169 PolarHBondContact O-N 3.07Å
170	F	80.4	Confident	79.6	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.035	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-41.5	-178.7	-176.2	-89.9	0	0	0	111.6	F35 V38 S168 R172 T173 T174 P539 A543 V546	F35-F170 AromaticContact CD1-CD2 3.81Å; F35-F170 HydrophobicContact CD1-CD2 3.81Å; F35-F170 HydrophobicContact CD2-CB 4.14Å; F35-F170 HydrophobicContact CD2-CD2 4.47Å; F35-F170 AromaticContact CE1-CD2 3.58Å; F35-F170 HydrophobicContact CE1-CD2 3.58Å; F35-F170 HydrophobicContact CE1-CE2 4.1Å; F35-F170 HydrophobicContact CE2-CB 4.37Å; F35-F170 HydrophobicContact CE2-CD2 4.28Å; F35-F170 HydrophobicContact CG-CB 4.29Å; F35-F170 HydrophobicContact CG-CD2 4.26Å; F35-F170 AromaticContact CZ-CD2 3.83Å; F35-F170 HydrophobicContact CZ-CD2 3.83Å; F35-F170 HydrophobicContact CZ-CE2 4.44Å; V38-F170 HydrophobicContact CG2-CD2 4.22Å; V38-F170 HydrophobicContact CG2-CE2 3.97Å; S168-F170 PolarHBondContact O-N 3.32Å; F170-R172 PolarHBondContact O-N 2.81Å; F170-R172 VanDerWaalsContact O-N 3.14Å; F170-T173 WeakPolarHBondContact O-CB 3.46Å; F170-T173 PolarHBondContact O-N 3Å; F170-T173 PolarHBondContact O-OG1 2.84Å; F170-T174 HydrophobicContact CD1-CG2 4.4Å; F170-T174 HydrophobicContact CE1-CG2 3.99Å; F170-P539 HydrophobicContact CD1-CB 4.34Å; F170-P539 WeakPolarHBondContact CD1-O 3.5Å; F170-P539 WeakPolarHBondContact CE1-O 3.35Å; F170-A543 HydrophobicContact CD1-CB 3.84Å; F170-A543 HydrophobicContact CD2-CB 4.25Å; F170-A543 HydrophobicContact CE1-CB 3.68Å; F170-A543 HydrophobicContact CE2-CB 4.09Å; F170-A543 HydrophobicContact CG-CB 4.14Å; F170-A543 VanDerWaalsContact CZ-CA 3.42Å; F170-A543 HydrophobicContact CZ-CB 3.8Å; F170-A543 VanDerWaalsContact CZ-N 3.32Å; F170-V546 HydrophobicContact CZ-CG2 4.28Å
171	A	75.6	Confident	79	Confident	13 Å²	13	49.9 Å²	49.9	11%	0.107	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-56	-35.4	-176.2	0	0	0	0	0	113.9	L164 S168 T173 T174 P539	L164-A171 HydrophobicContact CD1-CB 3.71Å; L164-A171 HydrophobicContact CD2-CB 4.32Å; S168-A171 PolarHBondContact O-N 3Å; A171-T173 PolarHBondContact O-N 3.41Å; A171-T174 PolarHBondContact O-N 3.31Å; A171-T174 VanDerWaalsContact O-N 3.11Å; A171-T174 PolarHBondContact O-OG1 3.31Å; A171-P539 VanDerWaalsContact CA-CB 3.41Å; A171-P539 HydrophobicContact CB-CB 3.54Å; A171-P539 HydrophobicContact CB-CG 3.53Å
172	R	83.4	Confident	79	Confident	14 Å²	14	50.6 Å²	50.6	5%	0.053	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-65	-17.7	177.9	-70	-178.2	65	-164.8	4.3	114.6	N158 Y159 L164 S168 F170 T174	N158-R172 CarbonylContact C-O 3.53Å; Y159-R172 VanDerWaalsContact CA-O 3.28Å; Y159-R172 WeakPolarHBondContact CA-O 3.12Å; Y159-R172 HydrophobicContact CD2-CB 4.36Å; Y159-R172 PolarHBondContact N-O 2.75Å; Y159-R172 PolarHBondContact O-NH2 3.37Å; L164-R172 HydrophobicContact CB-CG 4.14Å; S168-R172 WeakPolarHBondContact O-CG 3.42Å; S168-R172 PolarHBondContact O-N 2.8Å; F170-R172 PolarHBondContact O-N 2.81Å; F170-R172 VanDerWaalsContact O-N 3.14Å; R172-T174 VanDerWaalsContact C-N 3.29Å
173	T	86.8	Confident	79.3	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.043	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-85.5	-5.6	177.8	70.1	0	0	0	0	113	F35 L155 N158 Y159 F170 A171 I619	F35-T173 HydrophobicContact CE2-CG2 3.89Å; F35-T173 HydrophobicContact CZ-CG2 3.99Å; L155-T173 HydrophobicContact CD1-CG2 4.16Å; N158-T173 WeakPolarHBondContact CB-O 3.38Å; N158-T173 PolarHBondContact ND2-O 3.02Å; Y159-T173 HydrophobicContact CD2-CG2 4.46Å; F170-T173 WeakPolarHBondContact O-CB 3.46Å; F170-T173 PolarHBondContact O-N 3Å; F170-T173 PolarHBondContact O-OG1 2.84Å; A171-T173 PolarHBondContact O-N 3.41Å; T173-I619 HydrophobicContact CG2-CD1 3.73Å; T173-I619 WeakPolarHBondContact OG1-CD1 3.47Å
174	T	87.1	Confident	79.8	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.037	28%	0.278	C	S	.	.	S	Bend	trans	-102.7	161	-177	72.2	0	0	0	0	112.3	N158 F170 A171 R172 V176 N177 P539 T616 C617	N158-T174 VanDerWaalsContact CG-C 3.48Å; F170-T174 HydrophobicContact CD1-CG2 4.4Å; F170-T174 HydrophobicContact CE1-CG2 3.99Å; A171-T174 PolarHBondContact O-N 3.31Å; A171-T174 VanDerWaalsContact O-N 3.11Å; A171-T174 PolarHBondContact O-OG1 3.31Å; R172-T174 VanDerWaalsContact C-N 3.29Å; T174-V176 PolarHBondContact O-N 2.93Å; T174-N177 PolarHBondContact O-N 2.84Å; T174-N177 VanDerWaalsContact O-N 3.1Å; T174-P539 HydrophobicContact CG2-CB 4.08Å; T174-T616 VanDerWaalsContact CA-O 3.25Å; T174-T616 WeakPolarHBondContact CA-O 3.4Å; T174-T616 WeakPolarHBondContact CB-O 3.49Å; T174-C617 HydrophobicContact CG2-CB 4.36Å
175	I	85.9	Confident	80.3	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-57.5	-20.9	179.3	-165.7	170.7	0	0	0	113.5	N158 N177 V178 L185 H188 T616 M671 F674 R678	N158-I175 PolarHBondContact ND2-N 3.47Å; I175-N177 PolarHBondContact O-N 2.93Å; I175-V178 PolarHBondContact O-N 3.42Å; I175-L185 HydrophobicContact CD1-CD1 3.78Å; I175-L185 HydrophobicContact CG1-CD1 3.86Å; I175-H188 HydrophobicContact CD1-CB 3.97Å; I175-T616 HydrophobicContact CG2-CG2 4.1Å; I175-T616 PolarHBondContact N-O 2.96Å; I175-M671 HydrophobicContact CD1-CE 3.75Å; I175-M671 HydrophobicContact CD1-SD 3.88Å; I175-F674 HydrophobicContact CB-CZ 4.37Å; I175-F674 HydrophobicContact CD1-CD1 4.13Å; I175-F674 HydrophobicContact CD1-CE1 3.88Å; I175-F674 HydrophobicContact CD1-CZ 4.23Å; I175-F674 HydrophobicContact CG1-CE1 3.95Å; I175-F674 HydrophobicContact CG1-CZ 3.86Å; I175-F674 HydrophobicContact CG2-CD2 4.1Å; I175-F674 HydrophobicContact CG2-CE1 4.49Å; I175-F674 HydrophobicContact CG2-CE2 3.69Å; I175-F674 HydrophobicContact CG2-CZ 3.87Å; I175-R678 PolarHBondContact O-NH1 3.03Å
176	V	82	Confident	81.2	Confident	6 Å²	6	54 Å²	54	4%	0.036	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-60.6	-30.9	177.5	179.4	0	0	0	0	111.9	F23 L164 T174 V178 F537 P539 F674 R678	F23-V176 HydrophobicContact CD1-CG1 4.08Å; F23-V176 HydrophobicContact CE1-CG1 3.48Å; F23-V176 VanDerWaalsContact CE1-CG1 3.48Å; F23-V176 HydrophobicContact CZ-CG1 4.3Å; L164-V176 HydrophobicContact CD1-CG1 4.22Å; T174-V176 PolarHBondContact O-N 2.93Å; V176-V178 VanDerWaalsContact C-N 3.25Å; V176-V178 PolarHBondContact O-N 3.33Å; V176-F537 HydrophobicContact CG2-CB 4.42Å; V176-F537 WeakPolarHBondContact CG2-O 3.12Å; V176-P539 HydrophobicContact CB-CG 4.26Å; V176-P539 HydrophobicContact CG1-CG 4.43Å; V176-P539 HydrophobicContact CG2-CG 4.25Å; V176-F674 HydrophobicContact CG2-CE2 4.39Å; V176-R678 VanDerWaalsContact O-CZ 3.28Å; V176-R678 PolarHBondContact O-NH1 2.73Å; V176-R678 PolarHBondContact O-NH2 3.46Å
177	N	85.3	Confident	82.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-72.4	-17.7	-178.5	-164.3	33.3	0	0	0	114	N158 G161 S162 V163 L164 T174 I175	N158-N177 WeakPolarHBondContact O-CB 3.36Å; N158-N177 PolarHBondContact O-ND2 3.05Å; G161-N177 VanDerWaalsContact C-ND2 3.31Å; G161-N177 CarbonylContact C-O 3.59Å; G161-N177 WeakPolarHBondContact CA-ND2 3.24Å; G161-N177 WeakPolarHBondContact CA-O 3.2Å; G161-N177 PolarHBondContact O-ND2 3.28Å; G161-N177 PolarHBondContact O-OD1 3.32Å; S162-N177 PolarHBondContact N-O 3.34Å; V163-N177 WeakPolarHBondContact CG2-O 3.36Å; V163-N177 PolarHBondContact N-O 3.37Å; V163-N177 PolarHBondContact N-OD1 3.47Å; L164-N177 WeakPolarHBondContact CB-OD1 3.38Å; L164-N177 HydrophobicContact CD1-CB 3.84Å; L164-N177 PolarHBondContact N-OD1 3.37Å; T174-N177 PolarHBondContact O-N 2.84Å; T174-N177 VanDerWaalsContact O-N 3.1Å; I175-N177 PolarHBondContact O-N 2.93Å
178	V	86.2	Confident	83.6	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.024	22%	0.223	C	C	.	.	S	Bend	trans	-76.8	130.5	178.7	-176.6	0	0	0	0	109.4	I157 I175 V176 R678	I157-V178 HydrophobicContact CG2-CG2 4.22Å; I175-V178 PolarHBondContact O-N 3.42Å; V176-V178 VanDerWaalsContact C-N 3.25Å; V176-V178 PolarHBondContact O-N 3.33Å; V178-R678 PolarHBondContact O-NH1 3.08Å; V178-R678 PolarHBondContact O-NH2 3.03Å
179	S	82.3	Confident	84.8	Confident	37 Å²	37	43.2 Å²	43.2	26%	0.259	21%	0.214	S	C	.	.			trans	-68.2	150.9	179	65	0	0	0	0	112.5	E181 S182	S179-E181 PolarHBondContact O-N 2.91Å; S179-S182 WeakPolarHBondContact O-CB 3.33Å; S179-S182 PolarHBondContact O-N 3.33Å; S179-S182 WeakPolarHBondContact OG-CB 3.04Å
180	T	78.6	Confident	85.6	Confident	62 Å²	62	42 Å²	42	38%	0.38	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.6	178.1	43.6	0	0	0	0	113.3	S182 R678	T180-S182 VanDerWaalsContact C-N 3.35Å; T180-R678 HydrophobicContact CG2-CG 3.58Å
181	E	77.3	Confident	86.2	Confident	181 Å²	181	42.5 Å²	42.5	85%	0.846	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-11.6	178.5	-59.1	-176.8	172.8	0	0	113.1	S179	S179-E181 PolarHBondContact O-N 2.91Å
182	S	84.3	Confident	87.1	Confident	30 Å²	30	42.2 Å²	42.2	21%	0.21	21%	0.21	C	C	.	.			trans	-76.7	131.2	-175.9	-177.7	0	0	0	0	112.4	S179 T180 L184 L185	S179-S182 WeakPolarHBondContact O-CB 3.33Å; S179-S182 PolarHBondContact O-N 3.33Å; S179-S182 WeakPolarHBondContact OG-CB 3.04Å; T180-S182 VanDerWaalsContact C-N 3.35Å; S182-L184 PolarHBondContact O-N 3.38Å; S182-L184 VanDerWaalsContact O-N 3.15Å; S182-L184 WeakPolarHBondContact OG-CB 3.26Å; S182-L184 WeakPolarHBondContact OG-CG 3.44Å; S182-L184 PolarHBondContact OG-N 3.31Å; S182-L185 PolarHBondContact O-N 3.39Å
183	K	85.8	Confident	87.7	Confident	185 Å²	185	44 Å²	44	80%	0.804	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.7	171.7	-64.7	-177.6	-178.8	178	0	113	L185 W186	K183-L185 PolarHBondContact O-N 3.3Å; K183-W186 WeakPolarHBondContact O-CB 3.25Å; K183-W186 PolarHBondContact O-N 2.99Å
184	L	87.7	Confident	88	Confident	80 Å²	80	48.5 Å²	48.5	42%	0.419	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.5	-179.2	-60.9	174.7	0	0	0	113.3	I157 S182 W186 L187 H188	I157-L184 HydrophobicContact CG2-CB 3.84Å; I157-L184 HydrophobicContact CG2-CD1 4.06Å; I157-L184 HydrophobicContact CG2-CG 4.45Å; S182-L184 PolarHBondContact O-N 3.38Å; S182-L184 VanDerWaalsContact O-N 3.15Å; S182-L184 WeakPolarHBondContact OG-CB 3.26Å; S182-L184 WeakPolarHBondContact OG-CG 3.44Å; S182-L184 PolarHBondContact OG-N 3.31Å; L184-W186 PolarHBondContact O-N 3.05Å; L184-L187 WeakPolarHBondContact O-CB 3.36Å; L184-L187 PolarHBondContact O-N 3Å; L184-H188 PolarHBondContact O-ND1 3.46Å
185	L	87.1	Confident	88.4	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-66.6	-25.6	175.8	-164.7	72.8	0	0	0	112.6	I175 S182 K183 L187 H188 S189 F674 L679 I685	I175-L185 HydrophobicContact CD1-CD1 3.78Å; I175-L185 HydrophobicContact CG1-CD1 3.86Å; S182-L185 PolarHBondContact O-N 3.39Å; K183-L185 PolarHBondContact O-N 3.3Å; L185-L187 PolarHBondContact O-N 2.86Å; L185-H188 WeakPolarHBondContact O-CB 3.29Å; L185-H188 PolarHBondContact O-N 3.04Å; L185-S189 PolarHBondContact O-N 3.19Å; L185-F674 HydrophobicContact CD1-CE1 3.83Å; L185-F674 HydrophobicContact CD2-CE1 4.34Å; L185-L679 HydrophobicContact CD2-CD1 3.43Å; L185-L679 VanDerWaalsContact CD2-CD1 3.43Å; L185-L679 HydrophobicContact CD2-CD2 3.66Å; L185-L679 HydrophobicContact CD2-CG 4.18Å; L185-I685 HydrophobicContact CB-CD1 3.89Å; L185-I685 HydrophobicContact CD2-CD1 3.9Å; L185-I685 HydrophobicContact CD2-CG2 4.36Å; L185-I685 HydrophobicContact CG-CD1 4.17Å
186	W	91.6	Very high	88.9	Confident	95 Å²	95	48.2 Å²	48.2	36%	0.36	24%	0.236	S	C	.	.	H	α-helix	trans	-57.7	-36.8	172.7	-85.6	95.9	0	0	0	112.5	K183 L184 H188 S189 L190 A684 I685 F688	K183-W186 WeakPolarHBondContact O-CB 3.25Å; K183-W186 PolarHBondContact O-N 2.99Å; L184-W186 PolarHBondContact O-N 3.05Å; W186-H188 VanDerWaalsContact C-N 3.3Å; W186-H188 PolarHBondContact O-N 3.1Å; W186-S189 PolarHBondContact O-N 2.92Å; W186-L190 WeakPolarHBondContact O-CB 3.37Å; W186-L190 VanDerWaalsContact O-CG 3.32Å; W186-L190 WeakPolarHBondContact O-CG 3.25Å; W186-L190 PolarHBondContact O-N 3.14Å; W186-A684 HydrophobicContact CZ2-CB 3.94Å; W186-I685 HydrophobicContact CD2-CG1 3.99Å; W186-I685 HydrophobicContact CG-CD1 4.25Å; W186-I685 HydrophobicContact CG-CG1 4.21Å; W186-I685 HydrophobicContact CZ2-CG1 3.98Å; W186-F688 HydrophobicContact CE3-CD1 4.38Å; W186-F688 HydrophobicContact CH2-CB 4.1Å; W186-F688 HydrophobicContact CH2-CG 4.3Å; W186-F688 HydrophobicContact CZ3-CB 4.01Å; W186-F688 AromaticContact CZ3-CD1 3.86Å; W186-F688 HydrophobicContact CZ3-CD1 3.86Å; W186-F688 HydrophobicContact CZ3-CD2 4.18Å; W186-F688 HydrophobicContact CZ3-CE1 4.44Å; W186-F688 AromaticContact CZ3-CG 3.74Å; W186-F688 HydrophobicContact CZ3-CG 3.74Å
187	L	92.6	Very high	89.5	Confident	59 Å²	59	50.6 Å²	50.6	31%	0.309	25%	0.248	S	C	.	.	H	α-helix	trans	-66.2	-35.2	-178.6	-166.1	64.1	0	0	0	111.9	I153 I157 L184 L185 L191	I153-L187 HydrophobicContact CG2-CD2 3.26Å; I153-L187 HydrophobicContact CG2-CG 4.2Å; I157-L187 HydrophobicContact CD1-CD2 3.29Å; L184-L187 WeakPolarHBondContact O-CB 3.36Å; L184-L187 PolarHBondContact O-N 3Å; L185-L187 PolarHBondContact O-N 2.86Å; L187-L191 HydrophobicContact CD1-CD1 4.47Å; L187-L191 HydrophobicContact CD1-CG 4.47Å; L187-L191 HydrophobicContact CG-CD1 3.98Å; L187-L191 HydrophobicContact CG-CG 4.38Å; L187-L191 VanDerWaalsContact O-CB 3.27Å; L187-L191 WeakPolarHBondContact O-CB 3.48Å; L187-L191 VanDerWaalsContact O-CG 3.24Å; L187-L191 WeakPolarHBondContact O-CG 3.48Å; L187-L191 PolarHBondContact O-N 2.84Å
188	H	91.8	Very high	89.9	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-44.9	175.6	-67.8	77.5	0	0	0	111.6	N158 I175 L184 L185 W186 S192 I615 M671	N158-H188 PolarHBondContact OD1-NE2 2.72Å; I175-H188 HydrophobicContact CD1-CB 3.97Å; L184-H188 PolarHBondContact O-ND1 3.46Å; L185-H188 WeakPolarHBondContact O-CB 3.29Å; L185-H188 PolarHBondContact O-N 3.04Å; W186-H188 VanDerWaalsContact C-N 3.3Å; W186-H188 PolarHBondContact O-N 3.1Å; H188-S192 WeakPolarHBondContact O-CB 3.28Å; H188-S192 PolarHBondContact O-N 3.07Å; H188-I615 HydrophobicContact CB-CG2 3.79Å; H188-M671 HydrophobicContact CB-CE 3.75Å
189	S	91.7	Very high	90.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-68.2	-41.8	178.9	-173.1	0	0	0	0	112.1	L185 W186 S192 F193 F688 S689	L185-S189 PolarHBondContact O-N 3.19Å; W186-S189 PolarHBondContact O-N 2.92Å; S189-S192 PolarHBondContact O-N 3.15Å; S189-F193 PolarHBondContact O-N 3.09Å; S189-F688 WeakPolarHBondContact OG-CD1 3.38Å; S189-F688 VanDerWaalsContact OG-CE1 3.32Å; S189-F688 WeakPolarHBondContact OG-CE1 3.31Å; S189-S689 PolarHBondContact OG-OG 3.49Å
190	L	94.1	Very high	90.8	Very high	86 Å²	86	51.7 Å²	51.7	45%	0.45	25%	0.249	S	C	.	.	H	α-helix	trans	-62.8	-45.8	175.4	-71.1	169.8	0	0	0	112.2	W186 S192 F193 F194 F688	W186-L190 WeakPolarHBondContact O-CB 3.37Å; W186-L190 VanDerWaalsContact O-CG 3.32Å; W186-L190 WeakPolarHBondContact O-CG 3.25Å; W186-L190 PolarHBondContact O-N 3.14Å; L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 3.34Å; L190-F193 PolarHBondContact O-N 3.26Å; L190-F194 PolarHBondContact O-N 3.43Å; L190-F688 HydrophobicContact CD2-CE1 4.01Å; L190-F688 HydrophobicContact CD2-CZ 3.69Å; L190-F688 HydrophobicContact CG-CE1 4.46Å
191	L	94.1	Very high	91.4	Very high	20 Å²	20	52.8 Å²	52.8	11%	0.105	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-35.3	177.9	-73.6	174.1	0	0	0	112.1	P149 I153 I154 L187 F193 F194 Y195 I615	P149-L191 HydrophobicContact CB-CD2 4.33Å; I153-L191 HydrophobicContact CG2-CD1 4.19Å; I154-L191 HydrophobicContact CD1-CB 4.35Å; I154-L191 HydrophobicContact CD1-CD1 3.79Å; I154-L191 HydrophobicContact CG1-CD1 3.52Å; L187-L191 HydrophobicContact CD1-CD1 4.47Å; L187-L191 HydrophobicContact CD1-CG 4.47Å; L187-L191 HydrophobicContact CG-CD1 3.98Å; L187-L191 HydrophobicContact CG-CG 4.38Å; L187-L191 VanDerWaalsContact O-CB 3.27Å; L187-L191 WeakPolarHBondContact O-CB 3.48Å; L187-L191 VanDerWaalsContact O-CG 3.24Å; L187-L191 WeakPolarHBondContact O-CG 3.48Å; L187-L191 PolarHBondContact O-N 2.84Å; L191-F193 VanDerWaalsContact C-N 3.33Å; L191-F193 PolarHBondContact O-N 2.99Å; L191-F194 WeakPolarHBondContact O-CB 3.29Å; L191-F194 PolarHBondContact O-N 3.42Å; L191-Y195 VanDerWaalsContact O-CD1 3.24Å; L191-Y195 WeakPolarHBondContact O-CD1 3.26Å; L191-Y195 PolarHBondContact O-N 2.99Å; L191-I615 HydrophobicContact CB-CD1 4.15Å
192	S	93.3	Very high	92	Very high	6 Å²	6	46.5 Å²	46.5	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-42.1	174.7	-168.1	0	0	0	0	112.1	H188 S189 L190 F196 L668	H188-S192 WeakPolarHBondContact O-CB 3.28Å; H188-S192 PolarHBondContact O-N 3.07Å; S189-S192 PolarHBondContact O-N 3.15Å; L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 3.34Å; S192-F196 PolarHBondContact O-N 3.14Å; S192-L668 VanDerWaalsContact OG-CD2 3.29Å; S192-L668 WeakPolarHBondContact OG-CD2 3.16Å
193	F	95.2	Very high	92.3	Very high	52 Å²	52	45 Å²	45	23%	0.228	22%	0.216	C	C	.	.	H	α-helix	trans	-70.4	-39.3	176	-174.3	-116.4	0	0	0	111.6	S189 L190 L191 Y195 F196 I197 T692 I695 A696	S189-F193 PolarHBondContact O-N 3.09Å; L190-F193 PolarHBondContact O-N 3.26Å; L191-F193 VanDerWaalsContact C-N 3.33Å; L191-F193 PolarHBondContact O-N 2.99Å; F193-Y195 VanDerWaalsContact C-N 3.33Å; F193-Y195 PolarHBondContact O-N 3.26Å; F193-F196 HydrophobicContact CE2-CD1 4.35Å; F193-F196 WeakPolarHBondContact O-CB 3.06Å; F193-F196 PolarHBondContact O-N 2.99Å; F193-I197 HydrophobicContact CD1-CG1 4.28Å; F193-I197 HydrophobicContact CE1-CD1 4.24Å; F193-I197 HydrophobicContact CE1-CG1 3.93Å; F193-I197 HydrophobicContact CE2-CD1 4.19Å; F193-I197 HydrophobicContact CE2-CG1 4.31Å; F193-I197 HydrophobicContact CZ-CD1 3.8Å; F193-I197 HydrophobicContact CZ-CG1 3.95Å; F193-I197 WeakPolarHBondContact O-CG1 3.2Å; F193-I197 PolarHBondContact O-N 3.06Å; F193-T692 HydrophobicContact CB-CG2 4.13Å; F193-T692 HydrophobicContact CD1-CG2 4.44Å; F193-T692 HydrophobicContact CD2-CG2 3.99Å; F193-T692 HydrophobicContact CG-CG2 3.94Å; F193-I695 HydrophobicContact CE2-CG2 4.28Å; F193-I695 HydrophobicContact CZ-CG2 4.16Å; F193-A696 HydrophobicContact CE2-CB 4.49Å
194	F	94.8	Very high	92.3	Very high	101 Å²	101	37.7 Å²	37.7	44%	0.443	19%	0.19	S	C	.	.	H	α-helix	trans	-57.7	-43.8	173.5	178	-105.7	0	0	0	112	L190 L191 F196 I197 T198	L190-F194 PolarHBondContact O-N 3.43Å; L191-F194 WeakPolarHBondContact O-CB 3.29Å; L191-F194 PolarHBondContact O-N 3.42Å; F194-F196 VanDerWaalsContact C-N 3.31Å; F194-F196 PolarHBondContact O-N 2.96Å; F194-I197 PolarHBondContact O-N 3.11Å; F194-T198 PolarHBondContact O-N 3.45Å; F194-T198 PolarHBondContact O-OG1 2.95Å; F194-T198 VanDerWaalsContact O-OG1 3.12Å
195	Y	94.9	Very high	92.2	Very high	3 Å²	3	38.7 Å²	38.7	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-39.5	177.6	-72.6	7.9	0	0	0	112.1	I146 P149 S150 L191 F193 N199 M611 I615	I146-Y195 HydrophobicContact CB-CD1 4.28Å; I146-Y195 HydrophobicContact CB-CD2 4.37Å; I146-Y195 HydrophobicContact CB-CE1 4.06Å; I146-Y195 HydrophobicContact CB-CE2 4.12Å; I146-Y195 HydrophobicContact CB-CG 4.46Å; I146-Y195 HydrophobicContact CG2-CD1 3.83Å; I146-Y195 HydrophobicContact CG2-CD2 4.36Å; I146-Y195 HydrophobicContact CG2-CE1 4.08Å; I146-Y195 HydrophobicContact CG2-CG 4.02Å; I146-Y195 PolarHBondContact O-OH 3.38Å; P149-Y195 HydrophobicContact CB-CE1 4.42Å; P149-Y195 HydrophobicContact CG-CE1 3.77Å; P149-Y195 WeakPolarHBondContact CG-OH 3.3Å; S150-Y195 PolarHBondContact N-OH 2.98Å; S150-Y195 PolarHBondContact OG-OH 3.39Å; L191-Y195 VanDerWaalsContact O-CD1 3.24Å; L191-Y195 WeakPolarHBondContact O-CD1 3.26Å; L191-Y195 PolarHBondContact O-N 2.99Å; F193-Y195 VanDerWaalsContact C-N 3.33Å; F193-Y195 PolarHBondContact O-N 3.26Å; Y195-N199 VanDerWaalsContact O-CB 3.27Å; Y195-N199 WeakPolarHBondContact O-CB 3.16Å; Y195-N199 PolarHBondContact O-N 3.21Å; Y195-M611 HydrophobicContact CD2-CE 4.4Å; Y195-I615 HydrophobicContact CD2-CD1 3.71Å; Y195-I615 HydrophobicContact CD2-CG1 4.39Å; Y195-I615 HydrophobicContact CE2-CD1 3.42Å; Y195-I615 VanDerWaalsContact CE2-CD1 3.42Å; Y195-I615 HydrophobicContact CE2-CG1 4.38Å; Y195-I615 HydrophobicContact CG-CD1 4.49Å
196	F	95.8	Very high	92.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-48.9	173.5	170.6	-95.6	0	0	0	111.8	S192 F193 F194 T198 N199 F200 P664 L665 L668 A696 I699 A700	S192-F196 PolarHBondContact O-N 3.14Å; F193-F196 HydrophobicContact CE2-CD1 4.35Å; F193-F196 WeakPolarHBondContact O-CB 3.06Å; F193-F196 PolarHBondContact O-N 2.99Å; F194-F196 VanDerWaalsContact C-N 3.31Å; F194-F196 PolarHBondContact O-N 2.96Å; F196-T198 PolarHBondContact O-N 2.92Å; F196-N199 PolarHBondContact O-N 3.28Å; F196-F200 WeakPolarHBondContact O-CB 3.16Å; F196-F200 PolarHBondContact O-N 2.88Å; F196-P664 HydrophobicContact CB-CB 4.24Å; F196-P664 HydrophobicContact CD2-CB 4.22Å; F196-L665 HydrophobicContact CD2-CD2 3.96Å; F196-L665 HydrophobicContact CD2-CG 4.36Å; F196-L665 HydrophobicContact CE2-CD2 3.72Å; F196-L665 HydrophobicContact CE2-CG 4.1Å; F196-L665 HydrophobicContact CZ-CD2 4.44Å; F196-L668 HydrophobicContact CB-CD1 3.93Å; F196-L668 HydrophobicContact CD2-CD1 4.41Å; F196-L668 HydrophobicContact CG-CD1 4.12Å; F196-A696 HydrophobicContact CD1-CB 3.64Å; F196-A696 HydrophobicContact CD2-CB 4.08Å; F196-A696 HydrophobicContact CE1-CB 3.52Å; F196-A696 HydrophobicContact CE2-CB 3.96Å; F196-A696 HydrophobicContact CG-CB 3.93Å; F196-A696 HydrophobicContact CZ-CB 3.69Å; F196-A696 WeakPolarHBondContact CZ-O 3.31Å; F196-I699 HydrophobicContact CE1-CB 4.11Å; F196-I699 HydrophobicContact CE1-CD1 4.32Å; F196-I699 HydrophobicContact CE1-CG2 4.04Å; F196-I699 HydrophobicContact CZ-CB 4.2Å; F196-I699 HydrophobicContact CZ-CG2 4.14Å; F196-A700 HydrophobicContact CE2-CB 4.37Å; F196-A700 HydrophobicContact CZ-CB 4.27Å
197	I	94.9	Very high	91.5	Very high	56 Å²	56	35.9 Å²	35.9	29%	0.287	19%	0.187	S	C	.	.	H	α-helix	trans	-62.5	-46.3	-179.2	-64.5	-62.6	0	0	0	111.3	F193 F194 N199 F200 V201 I699	F193-I197 HydrophobicContact CD1-CG1 4.28Å; F193-I197 HydrophobicContact CE1-CD1 4.24Å; F193-I197 HydrophobicContact CE1-CG1 3.93Å; F193-I197 HydrophobicContact CE2-CD1 4.19Å; F193-I197 HydrophobicContact CE2-CG1 4.31Å; F193-I197 HydrophobicContact CZ-CD1 3.8Å; F193-I197 HydrophobicContact CZ-CG1 3.95Å; F193-I197 WeakPolarHBondContact O-CG1 3.2Å; F193-I197 PolarHBondContact O-N 3.06Å; F194-I197 PolarHBondContact O-N 3.11Å; I197-N199 VanDerWaalsContact C-N 3.34Å; I197-N199 PolarHBondContact O-N 3.43Å; I197-F200 PolarHBondContact O-N 3.39Å; I197-V201 WeakPolarHBondContact O-CG2 3.45Å; I197-V201 PolarHBondContact O-N 3.12Å; I197-I699 HydrophobicContact CD1-CD1 4.07Å
198	T	93.6	Very high	90.8	Very high	20 Å²	20	37.8 Å²	37.8	12%	0.123	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-43.2	176.6	-56.4	0	0	0	0	111.3	F142 F194 F196 V201 F202	F142-T198 HydrophobicContact CD2-CG2 4.11Å; F142-T198 HydrophobicContact CE2-CG2 4.09Å; F194-T198 PolarHBondContact O-N 3.45Å; F194-T198 PolarHBondContact O-OG1 2.95Å; F194-T198 VanDerWaalsContact O-OG1 3.12Å; F196-T198 PolarHBondContact O-N 2.92Å; T198-V201 PolarHBondContact O-N 3.36Å; T198-F202 HydrophobicContact CG2-CD2 3.99Å; T198-F202 HydrophobicContact CG2-CE2 4.1Å; T198-F202 WeakPolarHBondContact O-CD2 3.19Å; T198-F202 PolarHBondContact O-N 3.43Å
199	N	94.2	Very high	89.9	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-47.6	176.1	-177.1	-91.4	0	0	0	111.8	F142 Y195 F196 I197 V201 F202 M203 A660 P664	F142-N199 HydrophobicContact CD2-CB 4.39Å; F142-N199 HydrophobicContact CE1-CB 4.28Å; F142-N199 WeakPolarHBondContact CE1-ND2 3.11Å; F142-N199 HydrophobicContact CE2-CB 3.64Å; F142-N199 HydrophobicContact CZ-CB 3.58Å; Y195-N199 VanDerWaalsContact O-CB 3.27Å; Y195-N199 WeakPolarHBondContact O-CB 3.16Å; Y195-N199 PolarHBondContact O-N 3.21Å; F196-N199 PolarHBondContact O-N 3.28Å; I197-N199 VanDerWaalsContact C-N 3.34Å; I197-N199 PolarHBondContact O-N 3.43Å; N199-V201 VanDerWaalsContact C-N 3.33Å; N199-V201 PolarHBondContact O-N 3.15Å; N199-F202 PolarHBondContact O-N 2.88Å; N199-M203 WeakPolarHBondContact O-CB 3.19Å; N199-M203 WeakPolarHBondContact O-CG 3.41Å; N199-M203 PolarHBondContact O-N 3.13Å; N199-A660 PolarHBondContact OD1-O 3.44Å; N199-P664 HydrophobicContact CB-CG 3.8Å
200	F	93.4	Very high	88.7	Confident	43 Å²	43	46.3 Å²	46.3	19%	0.189	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-44.3	179.3	-178.8	-95.6	0	0	0	111.6	F196 I197 M203 A204 I661 I699	F196-F200 WeakPolarHBondContact O-CB 3.16Å; F196-F200 PolarHBondContact O-N 2.88Å; I197-F200 PolarHBondContact O-N 3.39Å; F200-M203 PolarHBondContact O-N 3.21Å; F200-A204 WeakPolarHBondContact O-CB 3.31Å; F200-A204 PolarHBondContact O-N 2.8Å; F200-I661 HydrophobicContact CD2-CG2 4.13Å; F200-I699 HydrophobicContact CD1-CG2 4.04Å; F200-I699 HydrophobicContact CD2-CG2 3.93Å; F200-I699 HydrophobicContact CE1-CG2 3.9Å; F200-I699 HydrophobicContact CE2-CG2 3.78Å; F200-I699 HydrophobicContact CG-CG2 4.05Å; F200-I699 HydrophobicContact CZ-CG2 3.77Å
201	V	91	Very high	87	Confident	86 Å²	86	43.6 Å²	43.6	52%	0.521	22%	0.219	S	C	.	.	H	α-helix	trans	-63.1	-44.3	176.8	172.5	0	0	0	0	111.5	I197 T198 N199 A204 H205	I197-V201 WeakPolarHBondContact O-CG2 3.45Å; I197-V201 PolarHBondContact O-N 3.12Å; T198-V201 PolarHBondContact O-N 3.36Å; N199-V201 VanDerWaalsContact C-N 3.33Å; N199-V201 PolarHBondContact O-N 3.15Å; V201-A204 PolarHBondContact O-N 3.41Å; V201-H205 WeakPolarHBondContact O-CB 3.3Å; V201-H205 PolarHBondContact O-N 2.91Å
202	F	90.9	Very high	85	Confident	48 Å²	48	44.4 Å²	44.4	21%	0.211	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-45.3	176.8	-96.8	-100.6	0	0	0	112.3	I141 F142 I145 T198 N199 H205 H206	I141-F202 HydrophobicContact CB-CE1 4.23Å; I141-F202 HydrophobicContact CG2-CE1 3.64Å; I141-F202 HydrophobicContact CG2-CZ 3.86Å; F142-F202 HydrophobicContact CB-CD1 4.27Å; F142-F202 HydrophobicContact CB-CG 4.42Å; I145-F202 HydrophobicContact CD1-CE1 4.43Å; I145-F202 HydrophobicContact CD1-CE2 3.8Å; I145-F202 HydrophobicContact CD1-CZ 3.43Å; I145-F202 VanDerWaalsContact CD1-CZ 3.43Å; T198-F202 HydrophobicContact CG2-CD2 3.99Å; T198-F202 HydrophobicContact CG2-CE2 4.1Å; T198-F202 WeakPolarHBondContact O-CD2 3.19Å; T198-F202 PolarHBondContact O-N 3.43Å; N199-F202 PolarHBondContact O-N 2.88Å; F202-H205 PolarHBondContact O-N 3.37Å; F202-H206 WeakPolarHBondContact O-CB 3.49Å; F202-H206 PolarHBondContact O-N 2.91Å
203	M	89.9	Confident	82.8	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-69.4	-37.8	178.7	-68.2	-56.1	102	0	0	111.9	F135 L139 N199 F200 H206 C207 V657 A660 I661	F135-M203 HydrophobicContact CE2-SD 3.94Å; L139-M203 HydrophobicContact CD2-CE 3.87Å; L139-M203 HydrophobicContact CD2-SD 4.46Å; N199-M203 WeakPolarHBondContact O-CB 3.19Å; N199-M203 WeakPolarHBondContact O-CG 3.41Å; N199-M203 PolarHBondContact O-N 3.13Å; F200-M203 PolarHBondContact O-N 3.21Å; M203-H206 PolarHBondContact O-N 3.48Å; M203-C207 WeakPolarHBondContact O-CB 3.32Å; M203-C207 PolarHBondContact O-N 3.32Å; M203-C207 PolarHBondContact O-SG 3.37Å; M203-V657 HydrophobicContact CB-CG1 3.93Å; M203-V657 HydrophobicContact CG-CG1 4.39Å; M203-V657 HydrophobicContact SD-CG1 4.11Å; M203-A660 HydrophobicContact CG-CB 4.18Å; M203-A660 HydrophobicContact SD-CB 3.62Å; M203-I661 HydrophobicContact CB-CD1 4.03Å; M203-I661 HydrophobicContact CB-CG1 3.56Å; M203-I661 HydrophobicContact CG-CG1 3.88Å
204	A	86.1	Confident	80.5	Confident	31 Å²	31	59.8 Å²	59.8	26%	0.256	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-44	173.1	0	0	0	0	0	111.3	F200 V201 H206 C207 L208	F200-A204 WeakPolarHBondContact O-CB 3.31Å; F200-A204 PolarHBondContact O-N 2.8Å; V201-A204 PolarHBondContact O-N 3.41Å; A204-H206 PolarHBondContact O-N 3.26Å; A204-C207 CarbonylContact O-C 3.58Å; A204-C207 WeakPolarHBondContact O-CB 3.17Å; A204-C207 PolarHBondContact O-N 3.38Å; A204-L208 VanDerWaalsContact O-CG 3.27Å; A204-L208 WeakPolarHBondContact O-CG 3.46Å; A204-L208 PolarHBondContact O-N 3.23Å
205	H	85.3	Confident	77.9	Confident	100 Å²	100	57.9 Å²	57.9	46%	0.463	29%	0.291	S	S	.	.	H	α-helix	trans	-60.9	-43.6	174.8	177.6	-92.3	0	0	0	111.8	H138 V201 F202 L208 R209	H138-H205 AromaticContact NE2-ND1 3.95Å; V201-H205 WeakPolarHBondContact O-CB 3.3Å; V201-H205 PolarHBondContact O-N 2.91Å; F202-H205 PolarHBondContact O-N 3.37Å; H205-L208 PolarHBondContact O-N 3.24Å; H205-R209 WeakPolarHBondContact O-CB 3.21Å; H205-R209 PolarHBondContact O-N 2.71Å
206	H	84.4	Confident	75.6	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.019	31%	0.311	C	S	.	.	H	α-helix	trans	-58.6	-49.1	172.9	-175.8	-84.8	0	0	0	111	F135 H138 F202 M203 A204 L208 R209 F210	F135-H206 WeakPolarHBondContact CA-NE2 3.43Å; F135-H206 AromaticContact CD2-CE1 3.99Å; H138-H206 AromaticContact CE1-CD2 3.96Å; H138-H206 AromaticContact CG-CD2 3.93Å; H138-H206 AromaticContact ND1-CD2 3.69Å; F202-H206 WeakPolarHBondContact O-CB 3.49Å; F202-H206 PolarHBondContact O-N 2.91Å; M203-H206 PolarHBondContact O-N 3.48Å; A204-H206 PolarHBondContact O-N 3.26Å; H206-L208 VanDerWaalsContact C-N 3.29Å; H206-L208 PolarHBondContact O-N 2.84Å; H206-R209 PolarHBondContact O-N 2.79Å; H206-F210 AromaticContact CD2-CD2 3.6Å; H206-F210 AromaticContact CD2-CE2 3.77Å; H206-F210 AromaticContact CE1-CD2 3.78Å; H206-F210 AromaticContact CG-CD2 3.91Å; H206-F210 AromaticContact NE2-CD2 3.52Å; H206-F210 AromaticContact NE2-CE2 3.86Å; H206-F210 WeakPolarHBondContact O-CB 3.2Å; H206-F210 WeakPolarHBondContact O-CD2 3.4Å; H206-F210 PolarHBondContact O-N 3.36Å
207	C	80.1	Confident	73.5	Confident	37 Å²	37	69.1 Å²	69.1	25%	0.25	34%	0.342	C	S	.	.	H	α-helix	trans	-59.3	-34.7	175.5	-79.1	0	0	0	0	113.6	M203 A204 F210 A211 V657	M203-C207 WeakPolarHBondContact O-CB 3.32Å; M203-C207 PolarHBondContact O-N 3.32Å; M203-C207 PolarHBondContact O-SG 3.37Å; A204-C207 CarbonylContact O-C 3.58Å; A204-C207 WeakPolarHBondContact O-CB 3.17Å; A204-C207 PolarHBondContact O-N 3.38Å; C207-F210 CarbonylContact O-C 3.47Å; C207-A211 WeakPolarHBondContact O-CA 3.28Å; C207-A211 WeakPolarHBondContact O-CB 3.37Å; C207-A211 PolarHBondContact O-N 3.25Å; C207-V657 WeakPolarHBondContact SG-CG1 3.45Å
208	L	77.5	Confident	71.6	Confident	99 Å²	99	68 Å²	68	52%	0.518	34%	0.338	S	S	.	.	H	α-helix	trans	-75.3	-38.5	178.9	-70.9	170.7	0	0	0	112.1	A204 H205 H206 R710	A204-L208 VanDerWaalsContact O-CG 3.27Å; A204-L208 WeakPolarHBondContact O-CG 3.46Å; A204-L208 PolarHBondContact O-N 3.23Å; H205-L208 PolarHBondContact O-N 3.24Å; H206-L208 VanDerWaalsContact C-N 3.29Å; H206-L208 PolarHBondContact O-N 2.84Å; L208-R710 VanDerWaalsContact CD2-NH1 3.32Å
209	R	73.4	Confident	70.3	Confident	159 Å²	159	68.7 Å²	68.7	60%	0.6	34%	0.342	S	S	*	.	H	α-helix	trans	-73.5	-31.9	179.3	-170.7	175.6	-175.1	-173.3	2	112.6	H205 H206	H205-R209 WeakPolarHBondContact O-CB 3.21Å; H205-R209 PolarHBondContact O-N 2.71Å; H206-R209 PolarHBondContact O-N 2.79Å
210	F	66.7	Low	69.8	Low	21 Å²	21	73.4 Å²	73.4	9%	0.092	36%	0.36	C	S	.	.	S	Bend	trans	-112.5	15.4	179.9	-57.9	-75.8	0	0	0	112.2	I131 V134 H206 C207 P212	I131-F210 HydrophobicContact CG1-CD1 4.44Å; V134-F210 HydrophobicContact CB-CE2 4.35Å; V134-F210 HydrophobicContact CB-CZ 3.98Å; V134-F210 HydrophobicContact CG1-CE1 4.39Å; V134-F210 HydrophobicContact CG1-CE2 3.5Å; V134-F210 HydrophobicContact CG1-CZ 3.37Å; V134-F210 HydrophobicContact CG2-CZ 4.26Å; H206-F210 AromaticContact CD2-CD2 3.6Å; H206-F210 AromaticContact CD2-CE2 3.77Å; H206-F210 AromaticContact CE1-CD2 3.78Å; H206-F210 AromaticContact CG-CD2 3.91Å; H206-F210 AromaticContact NE2-CD2 3.52Å; H206-F210 AromaticContact NE2-CE2 3.86Å; H206-F210 WeakPolarHBondContact O-CB 3.2Å; H206-F210 WeakPolarHBondContact O-CD2 3.4Å; H206-F210 PolarHBondContact O-N 3.36Å; C207-F210 CarbonylContact O-C 3.47Å; F210-P212 VanDerWaalsContact O-CD 3.29Å; F210-P212 WeakPolarHBondContact O-CD 3.34Å
211	A	56.6	Low	69.6	Low	29 Å²	29	71.6 Å²	71.6	24%	0.24	35%	0.352	C	S	.	.	S	Bend	trans	-54.6	124	165.7	0	0	0	0	0	105.5	C207 R213	C207-A211 WeakPolarHBondContact O-CA 3.28Å; C207-A211 WeakPolarHBondContact O-CB 3.37Å; C207-A211 PolarHBondContact O-N 3.25Å; A211-R213 VanDerWaalsContact C-N 3.27Å; A211-R213 PolarHBondContact O-N 3.01Å
212	P	52.3	Low	69.7	Low	37 Å²	37	67.5 Å²	67.5	24%	0.24	33%	0.327	C	S	.	.			trans	-46.3	84.9	-175.3	-33.3	31.3	0	0	0	113.9	F210 N214 E650 M654 M711	F210-P212 VanDerWaalsContact O-CD 3.29Å; F210-P212 WeakPolarHBondContact O-CD 3.34Å; P212-N214 PolarHBondContact O-N 2.97Å; P212-N214 VanDerWaalsContact O-N 3.16Å; P212-E650 WeakPolarHBondContact CB-OE2 3.34Å; P212-E650 WeakPolarHBondContact CG-OE2 3.34Å; P212-M654 HydrophobicContact CG-CE 4.27Å; P212-M711 HydrophobicContact CB-CE 3.82Å; P212-M711 VanDerWaalsContact CD-SD 3.52Å; P212-M711 HydrophobicContact CG-CE 3.44Å; P212-M711 VanDerWaalsContact CG-CE 3.44Å; P212-M711 HydrophobicContact CG-SD 3.67Å
213	R	46.8	Very low	69.7	Low	231 Å²	231	66 Å²	66	87%	0.872	32%	0.321	S	S	*	.	S	Bend	trans	-79.7	96.7	163.4	-109.4	178.8	153.9	169.5	-7.2	104.9	A211 S215	A211-R213 VanDerWaalsContact C-N 3.27Å; A211-R213 PolarHBondContact O-N 3.01Å; R213-S215 PolarHBondContact O-N 2.7Å
214	N	46.9	Very low	69.9	Low	150 Å²	150	66 Å²	66	80%	0.802	32%	0.321	S	S	*	.	S	Bend	trans	74.7	15.7	157.4	-60.2	-17.3	0	0	0	119.9	P212	P212-N214 PolarHBondContact O-N 2.97Å; P212-N214 VanDerWaalsContact O-N 3.16Å
215	S	41.1	Very low	70.2	Confident	61 Å²	61	65 Å²	65	43%	0.427	31%	0.312	S	S	.	.			trans	-94	-24.5	-172.8	106.8	0	0	0	0	117	R213 K217 E650	R213-S215 PolarHBondContact O-N 2.7Å; S215-K217 PolarHBondContact O-N 3.37Å; S215-E650 VanDerWaalsContact CB-OE1 3.28Å; S215-E650 WeakPolarHBondContact CB-OE1 3.33Å; S215-E650 PolarHBondContact OG-OE1 2.9Å
216	Q	46.8	Very low	70.5	Confident	92 Å²	92	64.3 Å²	64.3	43%	0.43	31%	0.306	S	S	.	.	S	Bend	trans	-75.1	77.4	161.3	-85.1	-173.9	3.7	0	0	107.9	V218 N649	Q216-V218 VanDerWaalsContact C-N 3.27Å; Q216-V218 PolarHBondContact O-N 2.86Å; Q216-N649 PolarHBondContact NE2-OD1 3.45Å
217	K	51.6	Low	70.8	Confident	147 Å²	147	64.2 Å²	64.2	64%	0.639	31%	0.306	S	S	*	.			trans	-44.9	103.4	158.6	-74.8	-176.6	179.3	-178.4	0	105.6	S215 T219	S215-K217 PolarHBondContact O-N 3.37Å; K217-T219 PolarHBondContact O-N 3.24Å
218	V	54.3	Low	71.4	Confident	34 Å²	34	63.3 Å²	63.3	21%	0.206	30%	0.299	C	S	.	.			trans	-57.5	108.9	-174.6	174.7	0	0	0	0	105.2	Q216 R220 S350 K354 M387	Q216-V218 VanDerWaalsContact C-N 3.27Å; Q216-V218 PolarHBondContact O-N 2.86Å; V218-R220 PolarHBondContact O-N 3.27Å; V218-S350 WeakPolarHBondContact O-CB 3.24Å; V218-K354 HydrophobicContact CG1-CD 4.19Å; V218-K354 VanDerWaalsContact CG1-CE 3.5Å; V218-K354 HydrophobicContact CG1-CG 3.8Å; V218-M387 HydrophobicContact CG1-CE 3.87Å; V218-M387 HydrophobicContact CG1-SD 4.42Å
219	T	66.6	Low	72	Confident	34 Å²	34	62.5 Å²	62.5	21%	0.209	29%	0.292	C	S	.	.			trans	-61.9	128.7	179.7	52.4	0	0	0	0	106.3	K217 T221 A388	K217-T219 PolarHBondContact O-N 3.24Å; T219-T221 PolarHBondContact O-N 2.98Å; T219-T221 PolarHBondContact OG1-O 3.31Å; T219-A388 PolarHBondContact OG1-O 3.29Å
220	R	84.9	Confident	72.8	Confident	99 Å²	99	61.6 Å²	61.6	37%	0.374	30%	0.298	S	S	.	.	S	Bend	trans	-63.5	-1.9	167.5	61.1	174.5	121.8	98.9	-3.6	112.5	V218 T346 F347	V218-R220 PolarHBondContact O-N 3.27Å; R220-T346 HydrophobicContact CG-CG2 3.96Å; R220-F347 WeakPolarHBondContact CB-O 3.12Å; R220-F347 WeakPolarHBondContact CD-O 3.25Å; R220-F347 WeakPolarHBondContact O-CB 3.45Å; R220-F347 WeakPolarHBondContact O-CD2 3.33Å; R220-F347 PolarHBondContact O-N 3Å
221	T	89.1	Confident	73.8	Confident	5 Å²	5	61 Å²	61	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.1	178.3	-49.1	0	0	0	0	111.9	T219 F344 V345 T346 A388 Y742	T219-T221 PolarHBondContact O-N 2.98Å; T219-T221 PolarHBondContact OG1-O 3.31Å; T221-F344 HydrophobicContact CG2-CB 3.98Å; T221-F344 HydrophobicContact CG2-CD1 4.22Å; T221-V345 CarbonylContact C-O 3.56Å; T221-V345 VanDerWaalsContact CA-O 3.25Å; T221-V345 WeakPolarHBondContact CA-O 3.24Å; T221-T346 WeakPolarHBondContact CG2-OG1 3.41Å; T221-T346 WeakPolarHBondContact OG1-CG2 3.35Å; T221-T346 PolarHBondContact OG1-OG1 3.43Å; T221-A388 HydrophobicContact CG2-CB 3.87Å; T221-A388 VanDerWaalsContact O-CB 3.31Å; T221-A388 WeakPolarHBondContact O-CB 3.21Å; T221-A388 PolarHBondContact O-N 3.43Å; T221-Y742 HydrophobicContact CG2-CD2 3.75Å; T221-Y742 HydrophobicContact CG2-CE2 3.63Å; T221-Y742 HydrophobicContact CG2-CG 4.35Å; T221-Y742 VanDerWaalsContact OG1-CE2 3.31Å; T221-Y742 WeakPolarHBondContact OG1-CE2 3.26Å
222	L	91.8	Very high	75.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	141.2	171.4	-62.1	-179.1	0	0	0	110.5	I224 F344 V345 F347 A353 V356 R357 V385 M387	L222-I224 HydrophobicContact CB-CG1 4.34Å; L222-F344 CarbonylContact O-C 3.58Å; L222-F344 WeakPolarHBondContact O-CA 3.44Å; L222-V345 PolarHBondContact N-O 3.13Å; L222-V345 PolarHBondContact O-N 3.1Å; L222-F347 HydrophobicContact CB-CE2 4.36Å; L222-F347 HydrophobicContact CD1-CD2 4.29Å; L222-F347 HydrophobicContact CD1-CE2 3.47Å; L222-F347 VanDerWaalsContact CD1-CE2 3.47Å; L222-F347 HydrophobicContact CD1-CZ 4.07Å; L222-F347 HydrophobicContact CG-CD2 4.27Å; L222-F347 HydrophobicContact CG-CE2 3.79Å; L222-A353 HydrophobicContact CD1-CB 4.38Å; L222-A353 HydrophobicContact CD2-CB 3.9Å; L222-A353 HydrophobicContact CG-CB 3.96Å; L222-V356 HydrophobicContact CD1-CB 3.83Å; L222-V356 HydrophobicContact CD1-CG1 3.67Å; L222-R357 HydrophobicContact CD2-CB 4.39Å; L222-V385 HydrophobicContact CB-CG1 4.24Å; L222-V385 HydrophobicContact CD1-CG1 3.7Å; L222-V385 HydrophobicContact CD2-CG1 4.28Å; L222-V385 HydrophobicContact CG-CG1 4.31Å; L222-M387 HydrophobicContact CD2-CE 4.3Å; L222-M387 HydrophobicContact CD2-SD 3.46Å; L222-M387 WeakPolarHBondContact CD2-SD 3.21Å
223	M	92	Very high	77	Confident	16 Å²	16	70.2 Å²	70.2	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.3	168.7	-178.1	-175.2	-179.7	0	0	107.9	L342 F344 T386 A388 L399 W481	M223-L342 HydrophobicContact CE-CD1 3.34Å; M223-L342 HydrophobicContact CE-CD2 3.91Å; M223-L342 HydrophobicContact CE-CG 4.28Å; M223-L342 HydrophobicContact CG-CD1 3.65Å; M223-L342 HydrophobicContact SD-CD1 4.35Å; M223-F344 HydrophobicContact CB-CD1 4.09Å; M223-F344 HydrophobicContact CB-CE1 3.79Å; M223-F344 HydrophobicContact CG-CD1 4.37Å; M223-F344 HydrophobicContact CG-CE1 3.76Å; M223-F344 HydrophobicContact CG-CZ 4.31Å; M223-F344 HydrophobicContact SD-CE1 4.34Å; M223-T386 PolarHBondContact N-O 3.28Å; M223-T386 PolarHBondContact O-N 3.18Å; M223-T386 PolarHBondContact O-OG1 3.23Å; M223-A388 HydrophobicContact CB-CB 4.34Å; M223-L399 HydrophobicContact CE-CD1 4.36Å; M223-W481 HydrophobicContact CE-CE3 3.63Å; M223-W481 HydrophobicContact CE-CZ3 3.76Å
224	I	93.6	Very high	79.1	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.3	-176.7	-50.7	-176.8	0	0	0	109.4	L222 V227 F241 L342 I343 V345 W383 R384 V385	L222-I224 HydrophobicContact CB-CG1 4.34Å; I224-V227 HydrophobicContact CB-CG2 4.46Å; I224-V227 HydrophobicContact CG2-CG2 3.87Å; I224-F241 HydrophobicContact CD1-CE2 4.1Å; I224-F241 HydrophobicContact CD1-CZ 3.56Å; I224-L342 WeakPolarHBondContact O-CA 3.32Å; I224-L342 WeakPolarHBondContact O-CD1 3.37Å; I224-I343 HydrophobicContact CB-CD1 4.23Å; I224-I343 HydrophobicContact CB-CG1 3.71Å; I224-I343 HydrophobicContact CD1-CD1 4.33Å; I224-I343 HydrophobicContact CG1-CG1 4.36Å; I224-I343 HydrophobicContact CG2-CG1 4.47Å; I224-I343 PolarHBondContact N-O 3.27Å; I224-I343 PolarHBondContact O-N 3.49Å; I224-V345 HydrophobicContact CD1-CB 4.35Å; I224-V345 HydrophobicContact CD1-CG2 3.74Å; I224-V345 HydrophobicContact CG1-CG2 4.42Å; I224-W383 HydrophobicContact CD1-CE3 4.44Å; I224-W383 HydrophobicContact CD1-CZ3 4.49Å; I224-W383 HydrophobicContact CG2-CB 3.89Å; I224-W383 HydrophobicContact CG2-CD2 3.85Å; I224-W383 HydrophobicContact CG2-CE3 3.97Å; I224-W383 HydrophobicContact CG2-CG 3.87Å; I224-R384 WeakPolarHBondContact CA-O 3.11Å; I224-V385 HydrophobicContact CD1-CG2 4.31Å; I224-V385 HydrophobicContact CG1-CG1 4.39Å; I224-V385 HydrophobicContact CG1-CG2 4.13Å; I224-V385 HydrophobicContact CG2-CG2 4.18Å
225	T	92.1	Very high	81.2	Confident	9 Å²	9	60.3 Å²	60.3	6%	0.055	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	159.7	180	47.2	0	0	0	0	111.4	D341 L342 W383 R384 W481	T225-D341 CarbonylContact C-O 3.55Å; T225-D341 WeakPolarHBondContact CA-O 3.45Å; T225-L342 HydrophobicContact CG2-CD1 3.36Å; T225-W383 WeakPolarHBondContact O-CA 3.09Å; T225-R384 PolarHBondContact N-O 2.89Å; T225-R384 PolarHBondContact O-N 2.92Å; T225-R384 VanDerWaalsContact O-N 3.1Å; T225-R384 VanDerWaalsContact OG1-CB 3.3Å; T225-R384 WeakPolarHBondContact OG1-CB 3.35Å; T225-R384 PolarHBondContact OG1-O 3.32Å; T225-W481 HydrophobicContact CG2-CH2 4.11Å; T225-W481 HydrophobicContact CG2-CZ3 4.05Å
226	Y	91.1	Very high	83.7	Confident	86 Å²	86	59.5 Å²	59.5	34%	0.337	29%	0.288	S	S	.	.	S	Bend	trans	67.9	33.5	-176.2	-48	-77.8	0	0	0	113.9	D341 R384 R403	Y226-D341 PolarHBondContact N-O 2.8Å; Y226-R384 HydrophobicContact CD2-CB 3.97Å; Y226-R384 HydrophobicContact CE2-CB 4Å; Y226-R403 VanDerWaalsContact OH-CD 3.22Å; Y226-R403 WeakPolarHBondContact OH-CD 3.41Å; Y226-R403 PolarHBondContact OH-NH1 3.42Å
227	V	92.5	Very high	85.9	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.018	27%	0.267	C	S	.	.			trans	-79	132.1	172.6	-176.7	0	0	0	0	109.2	I224 K229 I231 I237 D341 I343 W383	I224-V227 HydrophobicContact CB-CG2 4.46Å; I224-V227 HydrophobicContact CG2-CG2 3.87Å; V227-K229 PolarHBondContact O-N 3.29Å; V227-I231 HydrophobicContact CG1-CD1 4.42Å; V227-I237 HydrophobicContact CG1-CD1 4.46Å; V227-D341 PolarHBondContact N-O 2.77Å; V227-D341 VanDerWaalsContact N-O 3.16Å; V227-D341 WeakPolarHBondContact O-CA 3.06Å; V227-D341 WeakPolarHBondContact O-CB 3.44Å; V227-I343 HydrophobicContact CB-CG2 4.43Å; V227-I343 HydrophobicContact CG1-CG2 4.44Å; V227-I343 HydrophobicContact CG2-CD1 3.85Å; V227-I343 HydrophobicContact CG2-CG1 3.91Å; V227-I343 HydrophobicContact CG2-CG2 4.29Å; V227-W383 HydrophobicContact CG1-CZ2 4.47Å; V227-W383 HydrophobicContact CG2-CZ2 4.39Å
228	P	92.3	Very high	87.8	Confident	18 Å²	18	50.2 Å²	50.2	12%	0.117	25%	0.248	C	C	.	.			trans	-55.8	134	176.5	-25.3	33.8	0	0	0	112.2	D230 I231 R339 V378 K379	P228-D230 PolarHBondContact O-N 3.34Å; P228-I231 HydrophobicContact CB-CD1 3.81Å; P228-I231 HydrophobicContact CB-CG1 4.19Å; P228-I231 HydrophobicContact CG-CD1 3.9Å; P228-R339 PolarHBondContact O-NH1 3.25Å; P228-V378 WeakPolarHBondContact CD-O 3.48Å; P228-K379 HydrophobicContact CG-CB 4.04Å; P228-K379 HydrophobicContact CG-CD 4.03Å; P228-K379 HydrophobicContact CG-CG 4.13Å
229	K	90.2	Very high	89.7	Confident	82 Å²	82	53.3 Å²	53.3	36%	0.357	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-11.6	-176.6	-62.9	-172.8	177.8	-147.8	0	113.9	V227 I231 R339	V227-K229 PolarHBondContact O-N 3.29Å; K229-I231 VanDerWaalsContact C-N 3.29Å; K229-R339 WeakPolarHBondContact CE-O 3.48Å; K229-R339 PolarHBondContact NZ-O 3.29Å; K229-R339 PolarHBondContact O-NH1 3.06Å
230	D	89.3	Confident	91	Very high	139 Å²	139	51.7 Å²	51.7	74%	0.743	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-13.1	-179	-42.6	-50.9	0	0	0	112.3	P228 E232	P228-D230 PolarHBondContact O-N 3.34Å; D230-E232 PolarHBondContact O-N 2.91Å
231	I	89	Confident	91.4	Very high	9 Å²	9	47 Å²	47	5%	0.046	23%	0.23	C	C	.	.			trans	-87.6	83.4	-174	-57.8	165.3	0	0	0	110.7	V227 P228 K229 I236 I237 R339 V378	V227-I231 HydrophobicContact CG1-CD1 4.42Å; P228-I231 HydrophobicContact CB-CD1 3.81Å; P228-I231 HydrophobicContact CB-CG1 4.19Å; P228-I231 HydrophobicContact CG-CD1 3.9Å; K229-I231 VanDerWaalsContact C-N 3.29Å; I231-I236 HydrophobicContact CG2-CB 4.17Å; I231-I236 HydrophobicContact CG2-CD1 4.19Å; I231-I236 HydrophobicContact CG2-CG2 4.43Å; I231-I237 HydrophobicContact CG2-CG1 4.46Å; I231-R339 VanDerWaalsContact N-NH1 3.14Å; I231-R339 PolarHBondContact O-NH1 3.16Å; I231-R339 PolarHBondContact O-NH2 3Å; I231-V378 HydrophobicContact CD1-CB 4.24Å; I231-V378 HydrophobicContact CD1-CG1 4.21Å
232	E	85.3	Confident	91.6	Very high	159 Å²	159	53.1 Å²	53.1	74%	0.743	26%	0.258	S	S	*	.			trans	-73.6	-30.8	-176.2	-64	-177.6	176.3	0	0	112.7	D230 F255	D230-E232 PolarHBondContact O-N 2.91Å; E232-F255 WeakPolarHBondContact O-CE2 3.39Å
233	D	89.3	Confident	91.6	Very high	101 Å²	101	56.6 Å²	56.6	54%	0.54	28%	0.275	S	S	.	.			trans	-83	121.2	-175.9	-64	-38.9	0	0	0	112.7	E235 I236	D233-E235 PolarHBondContact O-N 3.5Å; D233-I236 HydrophobicContact CB-CD1 4.13Å; D233-I236 HydrophobicContact CB-CG1 4.17Å; D233-I236 PolarHBondContact O-N 2.59Å
234	P	90.8	Very high	91.6	Very high	46 Å²	46	56 Å²	56	30%	0.299	27%	0.273	S	S	.	.	H	α-helix	trans	-66	-25.1	176.2	27.3	-33	0	0	0	112.4	I236 I237 I238 V253 F255	P234-I236 PolarHBondContact O-N 3.45Å; P234-I237 WeakPolarHBondContact O-CB 3.39Å; P234-I237 PolarHBondContact O-N 3.34Å; P234-I238 WeakPolarHBondContact O-CG1 3.22Å; P234-I238 PolarHBondContact O-N 2.83Å; P234-V253 HydrophobicContact CB-CB 4.06Å; P234-V253 HydrophobicContact CB-CG1 4.35Å; P234-F255 HydrophobicContact CB-CE2 3.99Å; P234-F255 HydrophobicContact CB-CZ 4.34Å
235	E	91.8	Very high	91.5	Very high	126 Å²	126	56.6 Å²	56.6	59%	0.589	28%	0.275	S	S	*	.	H	α-helix	trans	-59.1	-33.1	179.7	-65.9	-56.2	146	0	0	113	D233 I237 I238 K239	D233-E235 PolarHBondContact O-N 3.5Å; E235-I237 VanDerWaalsContact C-N 3.29Å; E235-I237 PolarHBondContact O-N 3.21Å; E235-I238 PolarHBondContact O-N 2.82Å; E235-K239 VanDerWaalsContact O-CB 3.28Å; E235-K239 WeakPolarHBondContact O-CB 3.33Å; E235-K239 PolarHBondContact O-N 2.71Å
236	I	92.7	Very high	91.3	Very high	45 Å²	45	61.2 Å²	61.2	23%	0.231	31%	0.305	C	S	.	.	H	α-helix	trans	-65.1	-37.9	177.9	-59.2	174	0	0	0	110.3	I231 D233 P234 H240 V374 V378	I231-I236 HydrophobicContact CG2-CB 4.17Å; I231-I236 HydrophobicContact CG2-CD1 4.19Å; I231-I236 HydrophobicContact CG2-CG2 4.43Å; D233-I236 HydrophobicContact CB-CD1 4.13Å; D233-I236 HydrophobicContact CB-CG1 4.17Å; D233-I236 PolarHBondContact O-N 2.59Å; P234-I236 PolarHBondContact O-N 3.45Å; I236-H240 PolarHBondContact O-N 2.64Å; I236-V374 HydrophobicContact CG2-CB 4.21Å; I236-V374 HydrophobicContact CG2-CG1 4.31Å; I236-V378 HydrophobicContact CG2-CG1 3.61Å
237	I	93.1	Very high	91	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-73.8	-39.5	178.3	-64.3	164.6	0	0	0	110.3	V227 I231 P234 E235 K239 H240 F241 V253 F255 I343 V345 W383	V227-I237 HydrophobicContact CG1-CD1 4.46Å; I231-I237 HydrophobicContact CG2-CG1 4.46Å; P234-I237 WeakPolarHBondContact O-CB 3.39Å; P234-I237 PolarHBondContact O-N 3.34Å; E235-I237 VanDerWaalsContact C-N 3.29Å; E235-I237 PolarHBondContact O-N 3.21Å; I237-K239 VanDerWaalsContact C-N 3.34Å; I237-H240 WeakPolarHBondContact O-CB 3.39Å; I237-H240 PolarHBondContact O-N 3.45Å; I237-F241 HydrophobicContact CG2-CD2 3.93Å; I237-F241 HydrophobicContact CG2-CE2 3.65Å; I237-F241 VanDerWaalsContact O-CD2 3.23Å; I237-F241 WeakPolarHBondContact O-CD2 3.39Å; I237-F241 PolarHBondContact O-N 3.41Å; I237-V253 HydrophobicContact CB-CG1 4.31Å; I237-V253 HydrophobicContact CB-CG2 4.32Å; I237-V253 HydrophobicContact CD1-CG1 3.94Å; I237-V253 HydrophobicContact CG2-CG1 4.13Å; I237-V253 HydrophobicContact CG2-CG2 3.95Å; I237-F255 HydrophobicContact CD1-CE1 3.46Å; I237-F255 VanDerWaalsContact CD1-CE1 3.46Å; I237-F255 HydrophobicContact CD1-CZ 3.67Å; I237-I343 HydrophobicContact CD1-CD1 3.79Å; I237-I343 HydrophobicContact CG2-CD1 4.05Å; I237-V345 HydrophobicContact CG2-CG2 4.39Å; I237-W383 HydrophobicContact CG2-CH2 4.46Å
238	I	93.2	Very high	90.7	Very high	44 Å²	44	60 Å²	60	23%	0.226	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-46.7	174.6	-65	170.9	0	0	0	109.9	P234 E235 H240 F241 H242 V250 V253	P234-I238 WeakPolarHBondContact O-CG1 3.22Å; P234-I238 PolarHBondContact O-N 2.83Å; E235-I238 PolarHBondContact O-N 2.82Å; I238-H240 VanDerWaalsContact C-N 3.33Å; I238-H240 PolarHBondContact O-N 3.13Å; I238-F241 PolarHBondContact O-N 2.89Å; I238-H242 WeakPolarHBondContact O-CB 3.45Å; I238-H242 PolarHBondContact O-N 2.87Å; I238-V250 HydrophobicContact CG1-CB 4.49Å; I238-V250 HydrophobicContact CG1-CG1 4.15Å; I238-V253 HydrophobicContact CD1-CG2 4.38Å; I238-V253 HydrophobicContact CG1-CG2 3.68Å
239	K	93.1	Very high	90.5	Very high	98 Å²	98	62.6 Å²	62.6	43%	0.426	33%	0.334	S	S	.	.	H	α-helix	trans	-57.7	-43.1	176	-175.5	176.2	177.1	-176.1	0	112.1	E235 I237 F241 H242 E243 S373 V374	E235-K239 VanDerWaalsContact O-CB 3.28Å; E235-K239 WeakPolarHBondContact O-CB 3.33Å; E235-K239 PolarHBondContact O-N 2.71Å; I237-K239 VanDerWaalsContact C-N 3.34Å; K239-F241 PolarHBondContact O-N 2.95Å; K239-H242 PolarHBondContact O-N 3.44Å; K239-E243 WeakPolarHBondContact CE-OE1 3.46Å; K239-E243 HydrophobicContact CG-CG 4.43Å; K239-E243 IonicContact NZ-OE1 3.99Å; K239-E243 WeakPolarHBondContact O-CB 3.23Å; K239-E243 WeakPolarHBondContact O-CG 3.34Å; K239-E243 PolarHBondContact O-N 2.9Å; K239-S373 WeakPolarHBondContact CE-OG 3.33Å; K239-V374 HydrophobicContact CD-CG1 3.96Å; K239-V374 HydrophobicContact CG-CG1 4.46Å
240	H	93.8	Very high	90.5	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-55	-52.1	174.7	175.6	64.6	0	0	0	111.8	I236 I237 I238 A244 Y360 S372 V374 V378 W383	I236-H240 PolarHBondContact O-N 2.64Å; I237-H240 WeakPolarHBondContact O-CB 3.39Å; I237-H240 PolarHBondContact O-N 3.45Å; I238-H240 VanDerWaalsContact C-N 3.33Å; I238-H240 PolarHBondContact O-N 3.13Å; H240-A244 WeakPolarHBondContact O-CB 3.08Å; H240-A244 PolarHBondContact O-N 2.9Å; H240-Y360 PolarHBondContact NE2-OH 3.14Å; H240-S372 PolarHBondContact ND1-OG 2.99Å; H240-V374 HydrophobicContact CB-CG2 3.62Å; H240-V378 HydrophobicContact CB-CG2 4.41Å; H240-W383 AromaticContact CD2-CH2 3.8Å; H240-W383 AromaticContact CD2-CZ3 3.55Å; H240-W383 AromaticContact NE2-CZ3 3.83Å
241	F	94.1	Very high	90.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-68.8	-35.9	-178	-75.1	-64.1	0	0	0	113.1	I224 I237 I238 K239 Y245 V250 V345 F347 V356 W383	I224-F241 HydrophobicContact CD1-CE2 4.1Å; I224-F241 HydrophobicContact CD1-CZ 3.56Å; I237-F241 HydrophobicContact CG2-CD2 3.93Å; I237-F241 HydrophobicContact CG2-CE2 3.65Å; I237-F241 VanDerWaalsContact O-CD2 3.23Å; I237-F241 WeakPolarHBondContact O-CD2 3.39Å; I237-F241 PolarHBondContact O-N 3.41Å; I238-F241 PolarHBondContact O-N 2.89Å; K239-F241 PolarHBondContact O-N 2.95Å; F241-Y245 AromaticContact CD1-CD2 3.89Å; F241-Y245 HydrophobicContact CD1-CD2 3.89Å; F241-Y245 HydrophobicContact CD1-CE2 4.01Å; F241-Y245 HydrophobicContact CE1-CE2 4.29Å; F241-Y245 WeakPolarHBondContact O-CB 3.47Å; F241-Y245 PolarHBondContact O-N 3.19Å; F241-V250 HydrophobicContact CB-CG2 3.56Å; F241-V250 HydrophobicContact CD2-CG2 4.03Å; F241-V250 HydrophobicContact CG-CG2 3.99Å; F241-V345 HydrophobicContact CD2-CG1 4.13Å; F241-V345 HydrophobicContact CE2-CB 4.48Å; F241-V345 HydrophobicContact CE2-CG1 3.94Å; F241-V345 HydrophobicContact CE2-CG2 4.06Å; F241-F347 HydrophobicContact CD1-CE1 4.29Å; F241-F347 AromaticContact CD1-CZ 3.99Å; F241-F347 HydrophobicContact CD1-CZ 3.99Å; F241-F347 HydrophobicContact CE1-CZ 4.17Å; F241-F347 HydrophobicContact CG-CE1 4.37Å; F241-F347 HydrophobicContact CG-CZ 4.23Å; F241-V356 HydrophobicContact CD1-CG1 4.31Å; F241-V356 HydrophobicContact CD1-CG2 4.3Å; F241-V356 HydrophobicContact CE1-CG1 3.63Å; F241-V356 HydrophobicContact CE1-CG2 4.41Å; F241-W383 HydrophobicContact CE1-CZ3 4.49Å; F241-W383 HydrophobicContact CE2-CZ3 4.16Å; F241-W383 AromaticContact CZ-CZ3 3.74Å; F241-W383 HydrophobicContact CZ-CZ3 3.74Å
242	H	92.1	Very high	90.3	Very high	134 Å²	134	62.1 Å²	62.1	62%	0.62	33%	0.33	S	S	*	.	H	α-helix	trans	-65.6	-41.7	178	-172.8	-84.4	0	0	0	112	I238 K239	I238-H242 WeakPolarHBondContact O-CB 3.45Å; I238-H242 PolarHBondContact O-N 2.87Å; K239-H242 PolarHBondContact O-N 3.44Å
243	E	93.5	Very high	90.5	Very high	74 Å²	74	55.5 Å²	55.5	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-77.8	-43.8	178.4	-70.4	178.8	-176.3	0	0	112.9	K239 S372 S373	K239-E243 WeakPolarHBondContact CE-OE1 3.46Å; K239-E243 HydrophobicContact CG-CG 4.43Å; K239-E243 IonicContact NZ-OE1 3.99Å; K239-E243 WeakPolarHBondContact O-CB 3.23Å; K239-E243 WeakPolarHBondContact O-CG 3.34Å; K239-E243 PolarHBondContact O-N 2.9Å; E243-S372 WeakPolarHBondContact OE2-CB 3.1Å; E243-S373 VanDerWaalsContact CD-OG 3.22Å; E243-S373 PolarHBondContact OE1-OG 3.46Å; E243-S373 VanDerWaalsContact OE1-OG 3.05Å; E243-S373 WeakPolarHBondContact OE2-CB 3.37Å; E243-S373 PolarHBondContact OE2-N 2.74Å; E243-S373 PolarHBondContact OE2-OG 2.73Å
244	A	91.5	Very high	90.5	Very high	4 Å²	4	53.5 Å²	53.5	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-73.8	-27.5	-177.3	0	0	0	0	0	112.9	H240 Q370	H240-A244 WeakPolarHBondContact O-CB 3.08Å; H240-A244 PolarHBondContact O-N 2.9Å; A244-Q370 HydrophobicContact CB-CB 3.95Å; A244-Q370 VanDerWaalsContact O-CB 3.29Å; A244-Q370 WeakPolarHBondContact O-CB 3.48Å
245	Y	92	Very high	90.6	Very high	12 Å²	12	52.2 Å²	52.2	5%	0.047	28%	0.277	C	S	.	.	S	Bend	trans	-132.7	79.8	-178.8	-55.2	-82.4	0	0	0	111.7	F241 G247 S248 V356 D359 Y360 Q370	F241-Y245 AromaticContact CD1-CD2 3.89Å; F241-Y245 HydrophobicContact CD1-CD2 3.89Å; F241-Y245 HydrophobicContact CD1-CE2 4.01Å; F241-Y245 HydrophobicContact CE1-CE2 4.29Å; F241-Y245 WeakPolarHBondContact O-CB 3.47Å; F241-Y245 PolarHBondContact O-N 3.19Å; Y245-G247 PolarHBondContact O-N 2.92Å; Y245-S248 WeakPolarHBondContact CB-OG 3.26Å; Y245-S248 VanDerWaalsContact O-CB 3.32Å; Y245-S248 WeakPolarHBondContact O-CB 3.45Å; Y245-S248 PolarHBondContact O-N 3.43Å; Y245-S248 PolarHBondContact O-OG 2.96Å; Y245-V356 HydrophobicContact CD1-CG2 4.32Å; Y245-V356 HydrophobicContact CD2-CG2 3.92Å; Y245-V356 HydrophobicContact CE1-CG2 4.42Å; Y245-V356 HydrophobicContact CE2-CG1 4.3Å; Y245-V356 HydrophobicContact CE2-CG2 4.02Å; Y245-V356 HydrophobicContact CG-CG2 4.06Å; Y245-D359 HydrophobicContact CE1-CB 4.07Å; Y245-D359 WeakPolarHBondContact CE1-OD2 3.37Å; Y245-D359 PolarHBondContact OH-OD2 3.36Å; Y245-Y360 HydrophobicContact CE2-CE2 4.2Å; Y245-Y360 WeakPolarHBondContact OH-CE2 3.46Å; Y245-Q370 HydrophobicContact CD1-CB 4.5Å; Y245-Q370 HydrophobicContact CD1-CG 4.3Å; Y245-Q370 HydrophobicContact CE1-CB 3.92Å; Y245-Q370 HydrophobicContact CE1-CG 3.77Å
246	P	86.8	Confident	90.5	Very high	106 Å²	106	46.4 Å²	46.4	69%	0.688	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	130.5	176.6	-25.5	33.9	0	0	0	111.7
247	G	84	Confident	90.5	Very high	62 Å²	62	47.3 Å²	47.3	64%	0.639	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	5.6	-176.5	0	0	0	0	0	115.4	Y245 M352	Y245-G247 PolarHBondContact O-N 2.92Å; G247-M352 WeakPolarHBondContact O-CE 3.42Å
248	S	86.9	Confident	90.4	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.014	26%	0.263	C	S	.	.			trans	-98.4	107.3	170.1	-51.7	0	0	0	0	110.1	Y245	Y245-S248 WeakPolarHBondContact CB-OG 3.26Å; Y245-S248 VanDerWaalsContact O-CB 3.32Å; Y245-S248 WeakPolarHBondContact O-CB 3.45Å; Y245-S248 PolarHBondContact O-N 3.43Å; Y245-S248 PolarHBondContact O-OG 2.96Å
249	V	88.9	Confident	90.3	Very high	71 Å²	71	47.5 Å²	47.5	43%	0.43	25%	0.253	S	S	.	.			trans	-90.2	117.4	179.9	-176.4	0	0	0	0	109.5	F347 Q348 M352	V249-F347 WeakPolarHBondContact O-CA 3.41Å; V249-Q348 HydrophobicContact CB-CB 4.25Å; V249-Q348 PolarHBondContact O-N 2.98Å; V249-M352 PolarHBondContact N-SD 2.93Å; V249-M352 VanDerWaalsContact N-SD 3.41Å
250	V	90	Very high	90.2	Very high	18 Å²	18	46 Å²	46	11%	0.109	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	120.2	170.7	179.9	0	0	0	0	108.2	I238 F241 V253 V345 F347	I238-V250 HydrophobicContact CG1-CB 4.49Å; I238-V250 HydrophobicContact CG1-CG1 4.15Å; F241-V250 HydrophobicContact CB-CG2 3.56Å; F241-V250 HydrophobicContact CD2-CG2 4.03Å; F241-V250 HydrophobicContact CG-CG2 3.99Å; V250-V253 HydrophobicContact CG1-CG2 3.85Å; V250-V345 HydrophobicContact CG1-CG1 3.69Å; V250-V345 HydrophobicContact CG2-CG1 4.16Å; V250-F347 HydrophobicContact CG2-CD1 4.07Å; V250-F347 HydrophobicContact CG2-CE1 3.7Å; V250-F347 HydrophobicContact CG2-CZ 4.24Å
251	T	87	Confident	90.1	Very high	74 Å²	74	50 Å²	50	45%	0.454	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-39.3	177.3	58.5	0	0	0	0	111.8	T346 Q348	T251-T346 PolarHBondContact N-O 3.02Å; T251-T346 WeakPolarHBondContact OG1-CB 3.42Å; T251-T346 WeakPolarHBondContact OG1-CG2 3.24Å; T251-T346 PolarHBondContact OG1-O 3.35Å; T251-Q348 HydrophobicContact CG2-CB 4.17Å
252	R	85.6	Confident	90	Very high	129 Å²	129	50 Å²	50	49%	0.487	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	146.2	-177.5	-78.4	-168.7	144.4	91.8	-0.3	112.1	T346 S739	R252-T346 PolarHBondContact N-O 3.12Å; R252-T346 PolarHBondContact O-N 3.21Å; R252-S739 WeakPolarHBondContact CD-O 3.32Å; R252-S739 VanDerWaalsContact CZ-CB 3.46Å
253	V	90.8	Very high	89.9	Confident	20 Å²	20	45.7 Å²	45.7	12%	0.121	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.7	166.4	178.7	0	0	0	0	107.9	P234 I237 I238 V250 F255 I343 V345	P234-V253 HydrophobicContact CB-CB 4.06Å; P234-V253 HydrophobicContact CB-CG1 4.35Å; I237-V253 HydrophobicContact CB-CG1 4.31Å; I237-V253 HydrophobicContact CB-CG2 4.32Å; I237-V253 HydrophobicContact CD1-CG1 3.94Å; I237-V253 HydrophobicContact CG2-CG1 4.13Å; I237-V253 HydrophobicContact CG2-CG2 3.95Å; I238-V253 HydrophobicContact CD1-CG2 4.38Å; I238-V253 HydrophobicContact CG1-CG2 3.68Å; V250-V253 HydrophobicContact CG1-CG2 3.85Å; V253-F255 HydrophobicContact CG1-CE1 4.48Å; V253-F255 HydrophobicContact CG1-CZ 4.5Å; V253-I343 HydrophobicContact CG1-CD1 4.36Å; V253-V345 HydrophobicContact CG1-CG2 4.42Å; V253-V345 HydrophobicContact CG2-CG1 4.31Å; V253-V345 HydrophobicContact CG2-CG2 4.34Å
254	H	89.7	Confident	89.7	Confident	58 Å²	58	44.8 Å²	44.8	27%	0.269	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.4	179.3	-135.1	-66.5	0	0	0	110.8	I343 F344 V743	H254-I343 CarbonylContact O-C 3.06Å; H254-I343 VanDerWaalsContact O-CA 3.27Å; H254-I343 WeakPolarHBondContact O-CA 3.23Å; H254-I343 WeakPolarHBondContact O-CB 3.33Å; H254-F344 HydrophobicContact CB-CB 4.33Å; H254-F344 PolarHBondContact N-O 3.26Å; H254-F344 PolarHBondContact O-N 2.97Å; H254-V743 WeakPolarHBondContact CE1-CG2 3.24Å; H254-V743 WeakPolarHBondContact NE2-CG2 3.27Å
255	F	91.1	Very high	89.7	Confident	19 Å²	19	45.7 Å²	45.7	8%	0.083	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	142.8	170.8	-63.6	-61	0	0	0	110.6	E232 P234 I237 V253 Y257 I343	E232-F255 WeakPolarHBondContact O-CE2 3.39Å; P234-F255 HydrophobicContact CB-CE2 3.99Å; P234-F255 HydrophobicContact CB-CZ 4.34Å; I237-F255 HydrophobicContact CD1-CE1 3.46Å; I237-F255 VanDerWaalsContact CD1-CE1 3.46Å; I237-F255 HydrophobicContact CD1-CZ 3.67Å; V253-F255 HydrophobicContact CG1-CE1 4.48Å; V253-F255 HydrophobicContact CG1-CZ 4.5Å; F255-Y257 HydrophobicContact CB-CE2 4.04Å; F255-I343 HydrophobicContact CD1-CG2 3.38Å; F255-I343 HydrophobicContact CE1-CG2 3.7Å; F255-I343 HydrophobicContact CG-CG2 4.49Å
256	C	91.4	Very high	89.5	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.034	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	145	175	-60.5	0	0	0	0	110.6	L340 L342 F344 L399	C256-L340 HydrophobicContact CB-CB 4.25Å; C256-L340 HydrophobicContact CB-CD1 4.16Å; C256-L340 WeakPolarHBondContact O-CB 3.35Å; C256-L340 PolarHBondContact O-N 2.77Å; C256-L342 HydrophobicContact CB-CB 4.17Å; C256-L342 HydrophobicContact CB-CD2 4Å; C256-L342 HydrophobicContact CB-CG 4.23Å; C256-L342 VanDerWaalsContact CB-O 3.32Å; C256-L342 WeakPolarHBondContact CB-O 3.42Å; C256-L342 PolarHBondContact N-O 3.42Å; C256-L342 VanDerWaalsContact N-O 3.16Å; C256-F344 VanDerWaalsContact SG-CD2 3.52Å; C256-F344 WeakPolarHBondContact SG-CE2 3.44Å; C256-L399 HydrophobicContact CB-CD2 4.21Å
257	Y	91.3	Very high	89.4	Confident	64 Å²	64	44.6 Å²	44.6	25%	0.251	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	158.2	-178.1	-56.5	-85.3	0	0	0	111.1	F255 V259 V335 R339 L747	F255-Y257 HydrophobicContact CB-CE2 4.04Å; Y257-V259 PolarHBondContact O-N 2.82Å; Y257-V259 VanDerWaalsContact O-N 3.14Å; Y257-V335 VanDerWaalsContact CB-CG1 3.42Å; Y257-V335 HydrophobicContact CD1-CG1 4.21Å; Y257-V335 VanDerWaalsContact CD1-O 3.31Å; Y257-V335 WeakPolarHBondContact CD1-O 3.48Å; Y257-V335 HydrophobicContact CD2-CG1 4.29Å; Y257-V335 HydrophobicContact CG-CG1 3.74Å; Y257-R339 HydrophobicContact CD1-CB 4.16Å; Y257-R339 HydrophobicContact CE1-CB 4.12Å; Y257-R339 HydrophobicContact CE1-CG 4.31Å; Y257-L747 HydrophobicContact CD2-CD1 4.47Å
258	D	92.3	Very high	89.6	Confident	45 Å²	45	46.4 Å²	46.4	24%	0.241	23%	0.23	C	C	.	.			trans	-74.9	100.8	171.2	-168.3	4.6	0	0	0	110.6	R260 K338 L340 S400	D258-R260 PolarHBondContact OD1-N 3.39Å; D258-K338 HydrophobicContact CB-CB 4.07Å; D258-K338 PolarHBondContact N-O 3.4Å; D258-L340 HydrophobicContact CB-CD2 4.31Å; D258-S400 WeakPolarHBondContact OD1-CB 3.1Å; D258-S400 PolarHBondContact OD1-OG 3.33Å
259	V	91.2	Very high	89.6	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.018	24%	0.239	C	C	.	.			trans	-104.9	11.1	-179.2	-65.8	0	0	0	0	113	Y257 N261 L262 I263 V335 W396 A744 V746 L747	Y257-V259 PolarHBondContact O-N 2.82Å; Y257-V259 VanDerWaalsContact O-N 3.14Å; V259-N261 PolarHBondContact O-N 3.44Å; V259-L262 HydrophobicContact CB-CB 4.43Å; V259-L262 HydrophobicContact CG1-CD2 4.43Å; V259-L262 PolarHBondContact O-N 3.1Å; V259-I263 HydrophobicContact CB-CD1 4.42Å; V259-I263 HydrophobicContact CB-CG1 4.47Å; V259-I263 HydrophobicContact CG2-CD1 3.76Å; V259-I263 HydrophobicContact CG2-CG1 4.32Å; V259-I263 VanDerWaalsContact O-CG1 3.3Å; V259-I263 WeakPolarHBondContact O-CG1 3.31Å; V259-I263 PolarHBondContact O-N 2.99Å; V259-V335 HydrophobicContact CG1-CG1 4.42Å; V259-W396 HydrophobicContact CG2-CB 4.41Å; V259-A744 HydrophobicContact CG2-CB 4Å; V259-V746 HydrophobicContact CB-CG2 4.49Å; V259-L747 HydrophobicContact CG1-CD1 3.64Å; V259-L747 HydrophobicContact CG1-CD2 4.29Å; V259-L747 HydrophobicContact CG1-CG 3.99Å
260	R	91.1	Very high	89.3	Confident	65 Å²	65	48.5 Å²	48.5	25%	0.245	23%	0.229	C	C	.	.	H	α-helix	trans	-54.8	-53.6	-175.5	171.8	176.3	-57.2	134.8	14.2	112.4	D258 L262 I263 D264 K397 S400	D258-R260 PolarHBondContact OD1-N 3.39Å; R260-L262 VanDerWaalsContact C-N 3.31Å; R260-I263 PolarHBondContact O-N 3.47Å; R260-D264 PolarHBondContact O-N 2.87Å; R260-K397 HydrophobicContact CB-CG 4.44Å; R260-K397 HydrophobicContact CG-CG 3.91Å; R260-K397 PolarHBondContact NE-O 3.39Å; R260-K397 PolarHBondContact NH2-O 2.93Å; R260-S400 PolarHBondContact NH2-OG 2.86Å
261	N	91	Very high	89	Confident	85 Å²	85	49.5 Å²	49.5	46%	0.455	23%	0.233	S	C	.	.	H	α-helix	trans	-68.3	-36.7	-177.9	-65.7	-6.3	0	0	0	110.9	V259 I263 D264 L265 E331	V259-N261 PolarHBondContact O-N 3.44Å; N261-I263 PolarHBondContact O-N 3.32Å; N261-D264 PolarHBondContact O-N 3.41Å; N261-L265 WeakPolarHBondContact O-CB 3.22Å; N261-L265 WeakPolarHBondContact O-CG 3.5Å; N261-L265 PolarHBondContact O-N 3.23Å; N261-E331 HydrophobicContact CB-CG 4.37Å
262	L	91.5	Very high	89	Confident	1 Å²	1	46 Å²	46	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-42.5	178	-166.8	74.4	0	0	0	111.9	V259 R260 L265 D266 F328 E331 L332 V335 V746 L747	V259-L262 HydrophobicContact CB-CB 4.43Å; V259-L262 HydrophobicContact CG1-CD2 4.43Å; V259-L262 PolarHBondContact O-N 3.1Å; R260-L262 VanDerWaalsContact C-N 3.31Å; L262-L265 PolarHBondContact O-N 3.04Å; L262-D266 VanDerWaalsContact O-CB 3.24Å; L262-D266 WeakPolarHBondContact O-CB 3.25Å; L262-D266 PolarHBondContact O-N 3.35Å; L262-F328 HydrophobicContact CD1-CD2 3.53Å; L262-F328 HydrophobicContact CD1-CE2 3.38Å; L262-F328 HydrophobicContact CD1-CG 4.22Å; L262-F328 HydrophobicContact CD1-CZ 3.98Å; L262-F328 HydrophobicContact CD2-CE2 4.36Å; L262-F328 HydrophobicContact CG-CD2 4.14Å; L262-F328 HydrophobicContact CG-CE2 3.64Å; L262-F328 HydrophobicContact CG-CZ 4.34Å; L262-E331 HydrophobicContact CD1-CB 4.35Å; L262-E331 HydrophobicContact CD1-CG 4.34Å; L262-L332 HydrophobicContact CD1-CB 4.12Å; L262-L332 HydrophobicContact CD1-CD1 4.44Å; L262-L332 HydrophobicContact CD2-CD1 4.04Å; L262-V335 HydrophobicContact CD2-CG2 4.1Å; L262-V746 HydrophobicContact CD2-CB 4.15Å; L262-V746 HydrophobicContact CD2-CG2 4.28Å; L262-V746 HydrophobicContact CG-CB 4.49Å; L262-L747 HydrophobicContact CD2-CD2 3.65Å; L262-L747 HydrophobicContact CD2-CG 4.45Å
263	I	89.4	Confident	88.9	Confident	43 Å²	43	41.6 Å²	41.6	22%	0.221	20%	0.197	C	C	.	.	H	α-helix	trans	-61.6	-45.2	174.4	-67.7	167.7	0	0	0	110.8	V259 R260 N261 D266 D267 W396 V746	V259-I263 HydrophobicContact CB-CD1 4.42Å; V259-I263 HydrophobicContact CB-CG1 4.47Å; V259-I263 HydrophobicContact CG2-CD1 3.76Å; V259-I263 HydrophobicContact CG2-CG1 4.32Å; V259-I263 VanDerWaalsContact O-CG1 3.3Å; V259-I263 WeakPolarHBondContact O-CG1 3.31Å; V259-I263 PolarHBondContact O-N 2.99Å; R260-I263 PolarHBondContact O-N 3.47Å; N261-I263 PolarHBondContact O-N 3.32Å; I263-D266 PolarHBondContact O-N 2.92Å; I263-D267 PolarHBondContact O-N 3.39Å; I263-W396 HydrophobicContact CD1-CB 3.86Å; I263-V746 HydrophobicContact CD1-CG2 4.41Å; I263-V746 HydrophobicContact CG1-CG1 4.31Å; I263-V746 HydrophobicContact CG1-CG2 3.56Å
264	D	90.5	Very high	88.5	Confident	54 Å²	54	43.3 Å²	43.3	29%	0.289	20%	0.201	S	C	.	.	H	α-helix	trans	-68.6	-35.3	-178.5	-71.7	-13	0	0	0	112.1	R260 N261 Q268 K397	R260-D264 PolarHBondContact O-N 2.87Å; N261-D264 PolarHBondContact O-N 3.41Å; D264-Q268 VanDerWaalsContact O-CG 3.29Å; D264-Q268 WeakPolarHBondContact O-CG 3.49Å; D264-Q268 PolarHBondContact O-N 3.23Å; D264-Q268 PolarHBondContact O-NE2 3.16Å; D264-K397 WeakPolarHBondContact OD1-CE 3.38Å; D264-K397 IonicContact OD1-NZ 2.7Å; D264-K397 PolarHBondContact OD1-NZ 3.19Å; D264-K397 WeakPolarHBondContact OD2-CE 3.42Å; D264-K397 IonicContact OD2-NZ 2.73Å; D264-K397 PolarHBondContact OD2-NZ 3.26Å
265	L	91.2	Very high	88.2	Confident	23 Å²	23	40.6 Å²	40.6	12%	0.12	19%	0.188	C	C	.	.	H	α-helix	trans	-69.5	-41.9	173.8	-76.2	170.1	0	0	0	111.7	N261 L262 Q268 R269 L324 E327 F328 E331	N261-L265 WeakPolarHBondContact O-CB 3.22Å; N261-L265 WeakPolarHBondContact O-CG 3.5Å; N261-L265 PolarHBondContact O-N 3.23Å; L262-L265 PolarHBondContact O-N 3.04Å; L265-Q268 PolarHBondContact O-N 2.95Å; L265-R269 VanDerWaalsContact O-CB 3.31Å; L265-R269 WeakPolarHBondContact O-CB 3.34Å; L265-R269 PolarHBondContact O-N 3.42Å; L265-L324 HydrophobicContact CD2-CD2 4.29Å; L265-E327 HydrophobicContact CD2-CB 4.15Å; L265-F328 HydrophobicContact CB-CD2 4.47Å; L265-E331 HydrophobicContact CD1-CB 3.95Å; L265-E331 HydrophobicContact CD1-CG 4.29Å
266	D	88.6	Confident	88	Confident	6 Å²	6	41 Å²	41	3%	0.032	19%	0.189	C	C	.	.	H	α-helix	trans	-67.1	-39.8	179.7	-178.5	54.9	0	0	0	112.5	L262 I263 Q268 R269 R270 F328 V746	L262-D266 VanDerWaalsContact O-CB 3.24Å; L262-D266 WeakPolarHBondContact O-CB 3.25Å; L262-D266 PolarHBondContact O-N 3.35Å; I263-D266 PolarHBondContact O-N 2.92Å; D266-Q268 VanDerWaalsContact C-N 3.32Å; D266-Q268 PolarHBondContact O-N 3.11Å; D266-R269 PolarHBondContact O-N 3.16Å; D266-R269 IonicContact OD1-CZ 2.73Å; D266-R269 IonicContact OD1-NE 3.13Å; D266-R269 PolarHBondContact OD1-NE 3.1Å; D266-R269 IonicContact OD1-NH2 2.63Å; D266-R269 PolarHBondContact OD1-NH2 2.72Å; D266-R270 WeakPolarHBondContact O-CB 3.45Å; D266-R270 VanDerWaalsContact O-CG 3.28Å; D266-R270 WeakPolarHBondContact O-CG 3.32Å; D266-R270 PolarHBondContact O-N 3.02Å; D266-R270 IonicContact OD1-NE 2.67Å; D266-R270 PolarHBondContact OD1-NE 3.28Å; D266-R270 IonicContact OD1-NH2 3.46Å; D266-R270 IonicContact OD2-CZ 3.7Å; D266-R270 IonicContact OD2-NE 3.23Å; D266-R270 PolarHBondContact OD2-NE 2.87Å; D266-R270 IonicContact OD2-NH2 3.04Å; D266-R270 PolarHBondContact OD2-NH2 3.28Å; D266-F328 HydrophobicContact CB-CD2 4.08Å; D266-F328 HydrophobicContact CB-CE2 3.84Å; D266-V746 HydrophobicContact CB-CG1 3.57Å; D266-V746 WeakPolarHBondContact OD2-CG1 3.24Å
267	D	84.6	Confident	87.6	Confident	90 Å²	90	42.5 Å²	42.5	48%	0.481	20%	0.197	S	C	.	.	H	α-helix	trans	-61.3	-42.4	173.5	-170	44.4	0	0	0	111.3	I263 H271	I263-D267 PolarHBondContact O-N 3.39Å; D267-H271 VanDerWaalsContact O-CB 3.31Å; D267-H271 WeakPolarHBondContact O-CB 3.41Å; D267-H271 PolarHBondContact O-N 3.08Å
268	Q	87.5	Confident	87.2	Confident	99 Å²	99	40.8 Å²	40.8	46%	0.463	19%	0.191	S	C	.	.	H	α-helix	trans	-64.6	-42.9	174.3	-72.7	171.6	65.6	0	0	112.1	D264 L265 D266 H271 A272 L324	D264-Q268 VanDerWaalsContact O-CG 3.29Å; D264-Q268 WeakPolarHBondContact O-CG 3.49Å; D264-Q268 PolarHBondContact O-N 3.23Å; D264-Q268 PolarHBondContact O-NE2 3.16Å; L265-Q268 PolarHBondContact O-N 2.95Å; D266-Q268 VanDerWaalsContact C-N 3.32Å; D266-Q268 PolarHBondContact O-N 3.11Å; Q268-H271 WeakPolarHBondContact O-CB 3.32Å; Q268-H271 PolarHBondContact O-N 2.69Å; Q268-A272 PolarHBondContact O-N 3.07Å; Q268-L324 HydrophobicContact CB-CD1 3.93Å; Q268-L324 HydrophobicContact CB-CD2 4.06Å
269	R	86.6	Confident	86.8	Confident	54 Å²	54	39 Å²	39	20%	0.204	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-50	178.7	-178	-177.1	66.1	154.1	-0.3	111.1	L265 D266 H271 A272 M273 L324 T325	L265-R269 VanDerWaalsContact O-CB 3.31Å; L265-R269 WeakPolarHBondContact O-CB 3.34Å; L265-R269 PolarHBondContact O-N 3.42Å; D266-R269 PolarHBondContact O-N 3.16Å; D266-R269 IonicContact OD1-CZ 2.73Å; D266-R269 IonicContact OD1-NE 3.13Å; D266-R269 PolarHBondContact OD1-NE 3.1Å; D266-R269 IonicContact OD1-NH2 2.63Å; D266-R269 PolarHBondContact OD1-NH2 2.72Å; R269-H271 PolarHBondContact O-N 2.71Å; R269-A272 PolarHBondContact O-N 3.26Å; R269-A272 VanDerWaalsContact O-N 3.11Å; R269-M273 WeakPolarHBondContact O-CB 3.35Å; R269-M273 PolarHBondContact O-N 3.44Å; R269-L324 HydrophobicContact CB-CB 4.13Å; R269-L324 HydrophobicContact CG-CB 4.48Å; R269-T325 WeakPolarHBondContact CD-OG1 3.36Å
270	R	83.1	Confident	86.5	Confident	63 Å²	63	39.7 Å²	39.7	24%	0.238	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-37	175.5	-68.3	178.7	-154.3	-146.4	-0.6	111.5	D266 R274 E749	D266-R270 WeakPolarHBondContact O-CB 3.45Å; D266-R270 VanDerWaalsContact O-CG 3.28Å; D266-R270 WeakPolarHBondContact O-CG 3.32Å; D266-R270 PolarHBondContact O-N 3.02Å; D266-R270 IonicContact OD1-NE 2.67Å; D266-R270 PolarHBondContact OD1-NE 3.28Å; D266-R270 IonicContact OD1-NH2 3.46Å; D266-R270 IonicContact OD2-CZ 3.7Å; D266-R270 IonicContact OD2-NE 3.23Å; D266-R270 PolarHBondContact OD2-NE 2.87Å; D266-R270 IonicContact OD2-NH2 3.04Å; D266-R270 PolarHBondContact OD2-NH2 3.28Å; R270-R274 VanDerWaalsContact O-CG 3.27Å; R270-R274 WeakPolarHBondContact O-CG 3.22Å; R270-R274 PolarHBondContact O-N 2.75Å; R270-E749 IonicContact CZ-OE2 2.7Å; R270-E749 IonicContact NH2-OE2 3.78Å; R270-E749 PolarHBondContact NH2-OE2 3.48Å
271	H	83	Confident	86.1	Confident	40 Å²	40	37 Å²	37	19%	0.185	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-44.7	174.8	-176	77.7	0	0	0	111.9	D267 Q268 R269 G275 N585	D267-H271 VanDerWaalsContact O-CB 3.31Å; D267-H271 WeakPolarHBondContact O-CB 3.41Å; D267-H271 PolarHBondContact O-N 3.08Å; Q268-H271 WeakPolarHBondContact O-CB 3.32Å; Q268-H271 PolarHBondContact O-N 2.69Å; R269-H271 PolarHBondContact O-N 2.71Å; H271-G275 PolarHBondContact O-N 3.28Å; H271-N585 PolarHBondContact ND1-ND2 3.44Å
272	A	86.6	Confident	85.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.9	-46.3	177	0	0	0	0	0	112	Q268 R269 R274 G275 R276 Y317 L320 E321 L324	Q268-A272 PolarHBondContact O-N 3.07Å; R269-A272 PolarHBondContact O-N 3.26Å; R269-A272 VanDerWaalsContact O-N 3.11Å; A272-R274 PolarHBondContact O-N 3.05Å; A272-G275 CarbonylContact O-C 3.59Å; A272-G275 WeakPolarHBondContact O-CA 3.45Å; A272-G275 PolarHBondContact O-N 3.14Å; A272-R276 PolarHBondContact O-N 3.11Å; A272-Y317 HydrophobicContact CB-CD1 4.43Å; A272-Y317 WeakPolarHBondContact O-CD1 2.99Å; A272-L320 HydrophobicContact CB-CB 4.37Å; A272-L320 HydrophobicContact CB-CD2 4.01Å; A272-L320 HydrophobicContact CB-CG 3.94Å; A272-E321 HydrophobicContact CB-CB 4.11Å; A272-L324 HydrophobicContact CB-CD1 3.95Å
273	M	83.9	Confident	85.3	Confident	36 Å²	36	36.4 Å²	36.4	18%	0.177	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-47.2	176.3	-179.6	-167	174	0	0	112.2	R269 G275 R276 L277 E321 L754	R269-M273 WeakPolarHBondContact O-CB 3.35Å; R269-M273 PolarHBondContact O-N 3.44Å; M273-G275 VanDerWaalsContact C-N 3.3Å; M273-G275 PolarHBondContact O-N 2.89Å; M273-R276 PolarHBondContact O-N 3.42Å; M273-L277 HydrophobicContact CE-CD1 4.05Å; M273-L277 HydrophobicContact CG-CD1 4.33Å; M273-L277 WeakPolarHBondContact O-CG 3.48Å; M273-L277 PolarHBondContact O-N 3.25Å; M273-E321 WeakPolarHBondContact CA-OE2 2.98Å; M273-E321 HydrophobicContact CB-CG 4.36Å; M273-E321 WeakPolarHBondContact CG-OE1 3.46Å; M273-L754 HydrophobicContact CE-CD1 3.37Å; M273-L754 HydrophobicContact SD-CD1 4.15Å
274	R	82.1	Confident	85	Confident	57 Å²	57	40.9 Å²	40.9	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-39	175.3	-72.2	172.5	-173.9	163.3	6	112	L78 R270 A272 F278 N585	L78-R274 VanDerWaalsContact CD1-NH2 3.28Å; R270-R274 VanDerWaalsContact O-CG 3.27Å; R270-R274 WeakPolarHBondContact O-CG 3.22Å; R270-R274 PolarHBondContact O-N 2.75Å; A272-R274 PolarHBondContact O-N 3.05Å; R274-F278 WeakPolarHBondContact O-CB 3.41Å; R274-F278 PolarHBondContact O-N 3.47Å; R274-N585 PolarHBondContact NH1-OD1 3.35Å
275	G	84.3	Confident	84.8	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.1	-47.4	174.2	0	0	0	0	0	112.1	H271 A272 M273 F278 Y279	H271-G275 PolarHBondContact O-N 3.28Å; A272-G275 CarbonylContact O-C 3.59Å; A272-G275 WeakPolarHBondContact O-CA 3.45Å; A272-G275 PolarHBondContact O-N 3.14Å; M273-G275 VanDerWaalsContact C-N 3.3Å; M273-G275 PolarHBondContact O-N 2.89Å; G275-F278 PolarHBondContact O-N 3.48Å; G275-Y279 VanDerWaalsContact O-CD2 3.22Å; G275-Y279 WeakPolarHBondContact O-CD2 3.38Å; G275-Y279 PolarHBondContact O-N 3.02Å; G275-Y279 VanDerWaalsContact O-N 3.1Å
276	R	85.9	Confident	84.3	Confident	28 Å²	28	47.3 Å²	47.3	11%	0.106	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-55.3	176.6	-176.1	-177.2	62.2	89.1	-5.5	111.2	A272 M273 F278 Y279 T280 S318 E321	A272-R276 PolarHBondContact O-N 3.11Å; M273-R276 PolarHBondContact O-N 3.42Å; R276-F278 VanDerWaalsContact C-N 3.27Å; R276-F278 PolarHBondContact O-N 2.83Å; R276-Y279 PolarHBondContact O-N 3.46Å; R276-T280 PolarHBondContact O-N 3.2Å; R276-T280 PolarHBondContact O-OG1 2.81Å; R276-T280 VanDerWaalsContact O-OG1 3.14Å; R276-S318 WeakPolarHBondContact CD-OG 3.2Å; R276-S318 WeakPolarHBondContact CG-OG 3.32Å; R276-E321 WeakPolarHBondContact CD-OE2 3.38Å; R276-E321 IonicContact CZ-OE2 2.72Å; R276-E321 IonicContact NE-OE2 3.73Å; R276-E321 PolarHBondContact NE-OE2 2.9Å; R276-E321 IonicContact NH2-OE1 3.69Å; R276-E321 IonicContact NH2-OE2 3.68Å
277	L	83.4	Confident	84.1	Confident	37 Å²	37	48.6 Å²	48.6	19%	0.194	24%	0.24	C	C	.	.	H	α-helix	trans	-54	-43.7	-179.1	-72.6	172.8	0	0	0	112.4	M273 A281	M273-L277 HydrophobicContact CE-CD1 4.05Å; M273-L277 HydrophobicContact CG-CD1 4.33Å; M273-L277 WeakPolarHBondContact O-CG 3.48Å; M273-L277 PolarHBondContact O-N 3.25Å; L277-A281 WeakPolarHBondContact O-CB 3.39Å; L277-A281 PolarHBondContact O-N 3.09Å
278	F	83.1	Confident	84	Confident	27 Å²	27	52.1 Å²	52.1	12%	0.118	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-47.6	176.6	179.2	-85.8	0	0	0	112.2	R274 G275 R276 A281 K282 E580 P581 F784 L788	R274-F278 WeakPolarHBondContact O-CB 3.41Å; R274-F278 PolarHBondContact O-N 3.47Å; G275-F278 PolarHBondContact O-N 3.48Å; R276-F278 VanDerWaalsContact C-N 3.27Å; R276-F278 PolarHBondContact O-N 2.83Å; F278-A281 PolarHBondContact O-N 3.36Å; F278-K282 HydrophobicContact CE1-CD 4.05Å; F278-K282 WeakPolarHBondContact O-CB 3.42Å; F278-K282 PolarHBondContact O-N 2.92Å; F278-E580 HydrophobicContact CE1-CB 3.78Å; F278-E580 WeakPolarHBondContact CE1-OE2 3.41Å; F278-E580 HydrophobicContact CZ-CB 3.83Å; F278-E580 WeakPolarHBondContact CZ-OE2 3.45Å; F278-P581 HydrophobicContact CB-CB 4.44Å; F278-P581 HydrophobicContact CB-CG 3.84Å; F278-P581 HydrophobicContact CD1-CG 3.45Å; F278-P581 VanDerWaalsContact CD1-CG 3.45Å; F278-P581 HydrophobicContact CE1-CG 4.13Å; F278-P581 HydrophobicContact CG-CG 3.72Å; F278-F784 HydrophobicContact CB-CE1 3.97Å; F278-F784 HydrophobicContact CB-CZ 4.24Å; F278-F784 AromaticContact CD2-CE1 3.97Å; F278-F784 HydrophobicContact CD2-CE1 3.97Å; F278-F784 HydrophobicContact CD2-CZ 4.39Å; F278-F784 HydrophobicContact CG-CE1 4.44Å; F278-L788 HydrophobicContact CD2-CD1 4.23Å; F278-L788 HydrophobicContact CE2-CD1 4.19Å
279	Y	84.4	Confident	83.8	Confident	7 Å²	7	49 Å²	49	3%	0.027	24%	0.239	C	C	.	.	H	α-helix	trans	-73.7	-32.3	-178.3	-78.2	-63.9	0	0	0	113.2	G275 R276 K282 A283 V289 I291 A313 Y317 S579 E580 P581	G275-Y279 VanDerWaalsContact O-CD2 3.22Å; G275-Y279 WeakPolarHBondContact O-CD2 3.38Å; G275-Y279 PolarHBondContact O-N 3.02Å; G275-Y279 VanDerWaalsContact O-N 3.1Å; R276-Y279 PolarHBondContact O-N 3.46Å; Y279-K282 PolarHBondContact O-N 3.06Å; Y279-A283 WeakPolarHBondContact O-CB 3.34Å; Y279-A283 PolarHBondContact O-N 2.87Å; Y279-V289 HydrophobicContact CD1-CB 4.19Å; Y279-V289 HydrophobicContact CD1-CG1 4.34Å; Y279-V289 HydrophobicContact CE1-CB 4.35Å; Y279-V289 HydrophobicContact CE1-CG1 3.99Å; Y279-I291 HydrophobicContact CE1-CG2 4.17Å; Y279-A313 HydrophobicContact CD1-CB 3.54Å; Y279-A313 HydrophobicContact CD2-CB 3.66Å; Y279-A313 HydrophobicContact CE1-CB 3.78Å; Y279-A313 HydrophobicContact CE2-CB 3.88Å; Y279-A313 HydrophobicContact CG-CB 3.49Å; Y279-A313 VanDerWaalsContact CG-CB 3.49Å; Y279-Y317 AromaticContact CD2-CD2 3.63Å; Y279-Y317 HydrophobicContact CD2-CD2 3.63Å; Y279-Y317 AromaticContact CD2-CE2 3.8Å; Y279-Y317 HydrophobicContact CD2-CE2 3.8Å; Y279-Y317 AromaticContact CE2-CD2 3.86Å; Y279-Y317 HydrophobicContact CE2-CD2 3.86Å; Y279-Y317 AromaticContact CE2-CE2 3.51Å; Y279-Y317 HydrophobicContact CE2-CE2 3.51Å; Y279-S579 WeakPolarHBondContact OH-CB 3.38Å; Y279-E580 PolarHBondContact OH-N 2.85Å; Y279-P581 HydrophobicContact CD2-CG 3.89Å; Y279-P581 VanDerWaalsContact CE2-CD 3.46Å; Y279-P581 HydrophobicContact CE2-CG 3.41Å; Y279-P581 VanDerWaalsContact CE2-CG 3.41Å; Y279-P581 WeakPolarHBondContact OH-CD 3.37Å
280	T	84	Confident	83.7	Confident	18 Å²	18	51.3 Å²	51.3	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-45.7	170.6	-61.1	0	0	0	0	110.9	R276 K282 A283 K284 E314	R276-T280 PolarHBondContact O-N 3.2Å; R276-T280 PolarHBondContact O-OG1 2.81Å; R276-T280 VanDerWaalsContact O-OG1 3.14Å; T280-K282 VanDerWaalsContact C-N 3.34Å; T280-K282 PolarHBondContact O-N 3.41Å; T280-A283 PolarHBondContact O-N 3.18Å; T280-K284 WeakPolarHBondContact O-CG 3.36Å; T280-K284 PolarHBondContact O-N 3.27Å; T280-E314 WeakPolarHBondContact CB-OE1 3.21Å; T280-E314 WeakPolarHBondContact CG2-OE1 2.98Å; T280-E314 PolarHBondContact OG1-OE1 3.08Å
281	A	83.2	Confident	83.7	Confident	10 Å²	10	49.2 Å²	49.2	8%	0.083	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-41.8	175.5	0	0	0	0	0	111.9	L277 F278 K284 K285	L277-A281 WeakPolarHBondContact O-CB 3.39Å; L277-A281 PolarHBondContact O-N 3.09Å; F278-A281 PolarHBondContact O-N 3.36Å; A281-K284 PolarHBondContact O-N 2.7Å; A281-K285 PolarHBondContact O-N 2.75Å
282	K	81.9	Confident	83.5	Confident	54 Å²	54	51.4 Å²	51.4	24%	0.235	25%	0.253	C	S	.	.	H	α-helix	trans	-68.8	-36.6	177.1	-165.8	169.7	-172.7	178.5	0	112.4	F278 Y279 T280 K285 T286 V289 E580	F278-K282 HydrophobicContact CE1-CD 4.05Å; F278-K282 WeakPolarHBondContact O-CB 3.42Å; F278-K282 PolarHBondContact O-N 2.92Å; Y279-K282 PolarHBondContact O-N 3.06Å; T280-K282 VanDerWaalsContact C-N 3.34Å; T280-K282 PolarHBondContact O-N 3.41Å; K282-K285 PolarHBondContact O-N 3.45Å; K282-T286 WeakPolarHBondContact CG-OG1 2.95Å; K282-T286 PolarHBondContact O-N 3.24Å; K282-T286 PolarHBondContact O-OG1 3.39Å; K282-V289 HydrophobicContact CD-CG2 4.14Å; K282-V289 HydrophobicContact CG-CG2 4.11Å; K282-E580 VanDerWaalsContact NZ-CD 3.26Å; K282-E580 IonicContact NZ-OE1 3.61Å; K282-E580 PolarHBondContact NZ-OE1 3.22Å; K282-E580 VanDerWaalsContact NZ-OE1 3.13Å; K282-E580 IonicContact NZ-OE2 2.89Å; K282-E580 PolarHBondContact NZ-OE2 2.91Å
283	A	83.9	Confident	82.8	Confident	19 Å²	19	54.6 Å²	54.6	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-39.1	177	0	0	0	0	0	111.8	Y279 T280 K285 G287	Y279-A283 WeakPolarHBondContact O-CB 3.34Å; Y279-A283 PolarHBondContact O-N 2.87Å; T280-A283 PolarHBondContact O-N 3.18Å; A283-K285 VanDerWaalsContact C-N 3.34Å; A283-K285 PolarHBondContact O-N 3.08Å; A283-G287 WeakPolarHBondContact CA-O 3.44Å; A283-G287 WeakPolarHBondContact O-CA 3.17Å; A283-G287 PolarHBondContact O-N 3.09Å
284	K	84	Confident	82.3	Confident	137 Å²	137	57.2 Å²	57.2	60%	0.596	28%	0.281	S	S	*	.	H	α-helix	trans	-62.6	-36.4	173	-71.8	-178.4	-179	-173.7	0	112.9	T280 A281 L781	T280-K284 WeakPolarHBondContact O-CG 3.36Å; T280-K284 PolarHBondContact O-N 3.27Å; A281-K284 PolarHBondContact O-N 2.7Å; K284-L781 HydrophobicContact CD-CD2 3.83Å
285	K	84.8	Confident	81.5	Confident	106 Å²	106	56.6 Å²	56.6	46%	0.461	29%	0.285	S	S	.	.	H	α-helix	trans	-83	-41.5	-179.6	-73	-175.2	171.8	-176.5	0	113.8	A281 K282 A283 L788 D789	A281-K285 PolarHBondContact O-N 2.75Å; K282-K285 PolarHBondContact O-N 3.45Å; A283-K285 VanDerWaalsContact C-N 3.34Å; A283-K285 PolarHBondContact O-N 3.08Å; K285-L788 HydrophobicContact CD-CD2 4.28Å; K285-D789 IonicContact NZ-OD1 3.37Å; K285-D789 PolarHBondContact NZ-OD1 3.49Å
286	T	81.9	Confident	80.6	Confident	105 Å²	105	59.4 Å²	59.4	64%	0.644	30%	0.304	S	S	*	.	H	α-helix	trans	-126.1	2	-166.4	49.2	0	0	0	0	114.9	K282	K282-T286 WeakPolarHBondContact CG-OG1 2.95Å; K282-T286 PolarHBondContact O-N 3.24Å; K282-T286 PolarHBondContact O-OG1 3.39Å
287	G	82.9	Confident	79.7	Confident	34 Å²	34	58.5 Å²	58.5	35%	0.351	30%	0.302	S	S	.	.			trans	80.9	179	-173.1	0	0	0	0	0	113	A283 V289	A283-G287 WeakPolarHBondContact CA-O 3.44Å; A283-G287 WeakPolarHBondContact O-CA 3.17Å; A283-G287 PolarHBondContact O-N 3.09Å; G287-V289 PolarHBondContact O-N 3.28Å
288	K	82.9	Confident	78.8	Confident	163 Å²	163	61.8 Å²	61.8	71%	0.709	31%	0.312	S	S	*	.			trans	-58.6	133.5	-173.9	-65.3	-174.1	170.9	-157	0	112.3	D312	K288-D312 IonicContact NZ-OD2 3.82Å
289	V	83.4	Confident	77.9	Confident	34 Å²	34	64.3 Å²	64.3	21%	0.206	33%	0.326	C	S	.	.			trans	-109.8	123.8	-178.1	-177.1	0	0	0	0	109.9	Y279 K282 G287 A313	Y279-V289 HydrophobicContact CD1-CB 4.19Å; Y279-V289 HydrophobicContact CD1-CG1 4.34Å; Y279-V289 HydrophobicContact CE1-CB 4.35Å; Y279-V289 HydrophobicContact CE1-CG1 3.99Å; K282-V289 HydrophobicContact CD-CG2 4.14Å; K282-V289 HydrophobicContact CG-CG2 4.11Å; G287-V289 PolarHBondContact O-N 3.28Å; V289-A313 VanDerWaalsContact O-CB 3.3Å; V289-A313 WeakPolarHBondContact O-CB 3.46Å; V289-A313 PolarHBondContact O-N 3.25Å
290	M	84.6	Confident	76.9	Confident	102 Å²	102	66 Å²	66	50%	0.502	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.7	176.3	-58.3	-60.1	-72.9	0	0	110.5	E310 V311 D312	M290-E310 HydrophobicContact CB-CB 4.42Å; M290-E310 HydrophobicContact CE-CB 4.24Å; M290-V311 CarbonylContact C-O 3.59Å; M290-V311 WeakPolarHBondContact CA-O 3.19Å; M290-D312 HydrophobicContact SD-CB 4.16Å
291	I	83.3	Confident	75.8	Confident	19 Å²	19	74.5 Å²	74.5	10%	0.097	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	157.7	177.8	60.1	169.2	0	0	0	111.7	Y279 E310 V311 A313 Y316 Y317	Y279-I291 HydrophobicContact CE1-CG2 4.17Å; I291-E310 WeakPolarHBondContact O-CA 3.48Å; I291-V311 HydrophobicContact CG1-CG2 4.02Å; I291-V311 PolarHBondContact N-O 2.9Å; I291-V311 PolarHBondContact O-N 3Å; I291-A313 HydrophobicContact CB-CB 4.27Å; I291-A313 HydrophobicContact CD1-CB 3.77Å; I291-A313 HydrophobicContact CG1-CB 3.74Å; I291-A313 HydrophobicContact CG2-CB 3.66Å; I291-Y316 HydrophobicContact CD1-CD1 4.04Å; I291-Y317 HydrophobicContact CD1-CD2 4.41Å; I291-Y317 HydrophobicContact CD1-CE2 3.99Å
292	R	79.5	Confident	74.7	Confident	87 Å²	87	75.9 Å²	75.9	33%	0.328	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.8	171.9	-62.1	176.9	-174.9	-179.2	-1.8	109	A297 E310	R292-A297 HydrophobicContact CB-CB 3.68Å; R292-E310 HydrophobicContact CG-CG 3.7Å; R292-E310 IonicContact CZ-OE1 3.65Å; R292-E310 VanDerWaalsContact CZ-OE1 3.28Å; R292-E310 IonicContact NE-OE1 2.91Å; R292-E310 PolarHBondContact NE-OE1 3.43Å; R292-E310 IonicContact NH2-OE1 2.63Å; R292-E310 PolarHBondContact NH2-OE1 3.08Å
293	I	71.8	Confident	73.4	Confident	67 Å²	67	83.1 Å²	83.1	34%	0.344	42%	0.415	S	S	.	.			trans	-85.2	-18.9	-170.4	52	169.3	0	0	0	114.7	V311 Y316 R578	I293-V311 HydrophobicContact CG2-CG2 3.73Å; I293-Y316 HydrophobicContact CG2-CD1 4.43Å; I293-Y316 HydrophobicContact CG2-CD2 3.91Å; I293-Y316 HydrophobicContact CG2-CE1 4.25Å; I293-Y316 HydrophobicContact CG2-CE2 3.68Å; I293-Y316 HydrophobicContact CG2-CG 4.28Å; I293-R578 WeakPolarHBondContact O-CD 3.46Å
294	H	73.1	Confident	72.2	Confident	90 Å²	90	84.9 Å²	84.9	42%	0.417	43%	0.425	S	S	.	.	S	Bend	trans	-79.7	133.9	-174.5	-165.3	-88.7	0	0	0	111.6	C296 A297 F308	H294-C296 WeakPolarHBondContact ND1-CB 3.36Å; H294-C296 PolarHBondContact ND1-N 2.89Å; H294-C296 VanDerWaalsContact ND1-N 3.14Å; H294-C296 PolarHBondContact O-N 2.67Å; H294-A297 HydrophobicContact CB-CB 4.23Å; H294-A297 WeakPolarHBondContact O-CB 3.38Å; H294-A297 PolarHBondContact O-N 2.66Å; H294-F308 HydrophobicContact CB-CD1 3.34Å; H294-F308 HydrophobicContact CB-CE1 3.52Å; H294-F308 HydrophobicContact CB-CG 4.39Å; H294-F308 AromaticContact CG-CD1 3.8Å; H294-F308 AromaticContact CG-CE1 3.44Å; H294-F308 VanDerWaalsContact CG-CE1 3.44Å; H294-F308 AromaticContact ND1-CE1 3.38Å; H294-F308 WeakPolarHBondContact ND1-CE1 3.46Å
295	P	64.4	Low	70.7	Confident	45 Å²	45	90.3 Å²	90.3	29%	0.292	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-54.6	-38.1	179.6	-24.9	31.3	0	0	0	113.9	A297	P295-A297 VanDerWaalsContact C-N 3.26Å; P295-A297 PolarHBondContact O-N 3.45Å
296	C	66.2	Low	69.5	Low	59 Å²	59	91.6 Å²	91.6	40%	0.399	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-80.6	-1	178.3	-50	0	0	0	0	113.9	H294 R298 L299 C300 F308	H294-C296 WeakPolarHBondContact ND1-CB 3.36Å; H294-C296 PolarHBondContact ND1-N 2.89Å; H294-C296 VanDerWaalsContact ND1-N 3.14Å; H294-C296 PolarHBondContact O-N 2.67Å; C296-R298 PolarHBondContact O-N 2.73Å; C296-L299 PolarHBondContact O-N 2.99Å; C296-C300 PolarHBondContact O-N 2.71Å; C296-C300 VanDerWaalsContact O-N 3.11Å; C296-F308 HydrophobicContact CB-CZ 4.48Å
297	A	66.8	Low	68.7	Low	9 Å²	9	89.2 Å²	89.2	7%	0.074	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-65.6	-20.8	-178.7	0	0	0	0	0	113.3	R292 H294 P295 F308	R292-A297 HydrophobicContact CB-CB 3.68Å; H294-A297 HydrophobicContact CB-CB 4.23Å; H294-A297 WeakPolarHBondContact O-CB 3.38Å; H294-A297 PolarHBondContact O-N 2.66Å; P295-A297 VanDerWaalsContact C-N 3.26Å; P295-A297 PolarHBondContact O-N 3.45Å; A297-F308 HydrophobicContact CB-CB 4.2Å; A297-F308 HydrophobicContact CB-CD1 4.01Å; A297-F308 HydrophobicContact CB-CD2 3.8Å; A297-F308 HydrophobicContact CB-CE1 4.43Å; A297-F308 HydrophobicContact CB-CE2 4.24Å; A297-F308 HydrophobicContact CB-CG 3.68Å
298	R	64.3	Low	68.1	Low	106 Å²	106	89.8 Å²	89.8	40%	0.4	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-84.1	-26.9	170.7	-94.4	-172.8	170.7	150.9	2.4	114.4	C296 S577 R583	C296-R298 PolarHBondContact O-N 2.73Å; R298-S577 PolarHBondContact NH1-O 2.98Å; R298-S577 PolarHBondContact NH1-OG 3.45Å; R298-R583 VanDerWaalsContact CZ-CZ 3.44Å; R298-R583 VanDerWaalsContact NH1-CZ 3.26Å; R298-R583 VanDerWaalsContact NH1-NE 3.11Å; R298-R583 VanDerWaalsContact NH2-NH2 3.14Å
299	L	65.5	Low	67.8	Low	80 Å²	80	90 Å²	90	42%	0.419	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-26.4	-178.9	-85	141.8	0	0	0	112.2	C296 F575 F576	C296-L299 PolarHBondContact O-N 2.99Å; L299-F575 HydrophobicContact CD1-CE1 4.32Å; L299-F575 HydrophobicContact CD2-CE1 3.88Å; L299-F575 HydrophobicContact CD2-CZ 4.02Å; L299-F575 HydrophobicContact CG-CE1 4.19Å; L299-F575 HydrophobicContact CG-CZ 4.46Å; L299-F576 HydrophobicContact CD1-CD1 4.2Å; L299-F576 HydrophobicContact CD1-CE1 3.76Å
300	C	63.3	Low	67.5	Low	43 Å²	43	92.9 Å²	92.9	29%	0.291	45%	0.451	S	S	.	.			trans	-87.8	111.5	175.6	-170	0	0	0	0	110.2	C296 C302 F308	C296-C300 PolarHBondContact O-N 2.71Å; C296-C300 VanDerWaalsContact O-N 3.11Å; C300-C302 PolarHBondContact O-N 3.38Å; C300-F308 HydrophobicContact CB-CE2 3.63Å; C300-F308 HydrophobicContact CB-CZ 4.36Å
301	F	59.5	Low	67.6	Low	195 Å²	195	89.4 Å²	89.4	86%	0.855	44%	0.435	S	S	*	.			trans	-79.4	3.4	175.3	-65.1	-82.6	0	0	0	113.7	K303	F301-K303 PolarHBondContact O-N 3.02Å
302	C	60.3	Low	67.8	Low	40 Å²	40	89.5 Å²	89.5	27%	0.27	44%	0.436	S	S	.	.			trans	-69.6	134.8	176.1	103	0	0	0	0	110.1	C300 C304 C307	C300-C302 PolarHBondContact O-N 3.38Å; C302-C304 HydrophobicContact CB-CB 4.2Å; C302-C304 WeakPolarHBondContact CB-SG 3.39Å; C302-C304 PolarHBondContact O-N 3.38Å; C302-C304 WeakPolarHBondContact SG-CB 3.1Å; C302-C304 PolarHBondContact SG-N 3.21Å; C302-C304 CovalentContact SG-SG 2.08Å; C302-C304 PolarHBondContact SG-SG 3.39Å; C302-C307 WeakPolarHBondContact SG-CB 3.17Å; C302-C307 PolarHBondContact SG-SG 3.22Å
303	K	54.4	Low	68.1	Low	206 Å²	206	85.4 Å²	85.4	90%	0.896	42%	0.421	S	S	*	.			trans	-87.1	16.2	167.1	-72.5	-173.7	176.3	-178.6	0	112.5	F301	F301-K303 PolarHBondContact O-N 3.02Å
304	C	59.2	Low	68.8	Low	55 Å²	55	84.8 Å²	84.8	37%	0.372	42%	0.416	S	S	.	.			trans	-75.9	126.7	-173.2	58.6	0	0	0	0	111.1	C302 T306 C307	C302-C304 HydrophobicContact CB-CB 4.2Å; C302-C304 WeakPolarHBondContact CB-SG 3.39Å; C302-C304 PolarHBondContact O-N 3.38Å; C302-C304 WeakPolarHBondContact SG-CB 3.1Å; C302-C304 PolarHBondContact SG-N 3.21Å; C302-C304 CovalentContact SG-SG 2.08Å; C302-C304 PolarHBondContact SG-SG 3.39Å; C304-T306 PolarHBondContact O-N 3.41Å; C304-C307 PolarHBondContact O-N 3.29Å; C304-C307 VanDerWaalsContact O-N 3.11Å; C304-C307 PolarHBondContact SG-SG 3.34Å
305	W	53.3	Low	69.6	Low	251 Å²	251	83.9 Å²	83.9	95%	0.951	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.5	-173.8	-162.4	15.1	0	0	0	113.3
306	T	59.5	Low	70.8	Confident	134 Å²	134	84.7 Å²	84.7	82%	0.822	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-13.3	-179.3	47.8	0	0	0	0	114.8	C304	C304-T306 PolarHBondContact O-N 3.41Å
307	C	64.9	Low	71.9	Confident	55 Å²	55	82.4 Å²	82.4	37%	0.372	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-40.6	-172.2	-89.2	0	0	0	0	114.1	C302 C304	C302-C307 WeakPolarHBondContact SG-CB 3.17Å; C302-C307 PolarHBondContact SG-SG 3.22Å; C304-C307 PolarHBondContact O-N 3.29Å; C304-C307 VanDerWaalsContact O-N 3.11Å; C304-C307 PolarHBondContact SG-SG 3.34Å
308	F	70.1	Confident	73	Confident	46 Å²	46	82.6 Å²	82.6	20%	0.202	39%	0.394	C	S	.	.			trans	-148.7	127.9	178.2	-58.6	-70.7	0	0	0	111	H294 C296 A297 C300 E310	H294-F308 HydrophobicContact CB-CD1 3.34Å; H294-F308 HydrophobicContact CB-CE1 3.52Å; H294-F308 HydrophobicContact CB-CG 4.39Å; H294-F308 AromaticContact CG-CD1 3.8Å; H294-F308 AromaticContact CG-CE1 3.44Å; H294-F308 VanDerWaalsContact CG-CE1 3.44Å; H294-F308 AromaticContact ND1-CE1 3.38Å; H294-F308 WeakPolarHBondContact ND1-CE1 3.46Å; C296-F308 HydrophobicContact CB-CZ 4.48Å; A297-F308 HydrophobicContact CB-CB 4.2Å; A297-F308 HydrophobicContact CB-CD1 4.01Å; A297-F308 HydrophobicContact CB-CD2 3.8Å; A297-F308 HydrophobicContact CB-CE1 4.43Å; A297-F308 HydrophobicContact CB-CE2 4.24Å; A297-F308 HydrophobicContact CB-CG 3.68Å; C300-F308 HydrophobicContact CB-CE2 3.63Å; C300-F308 HydrophobicContact CB-CZ 4.36Å; F308-E310 PolarHBondContact O-N 3.07Å
309	K	75.8	Confident	74.3	Confident	166 Å²	166	81.3 Å²	81.3	72%	0.722	39%	0.393	S	S	*	.			trans	-68.9	126.5	175.2	-172.4	179.5	178.5	-174.9	0	109.7	V311	K309-V311 HydrophobicContact CD-CG1 4.4Å; K309-V311 HydrophobicContact CG-CG1 4.29Å
310	E	78.3	Confident	75.5	Confident	95 Å²	95	79.6 Å²	79.6	44%	0.444	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133.8	169.4	-73.2	177.8	-178.6	0	0	109.3	M290 I291 R292 F308	M290-E310 HydrophobicContact CB-CB 4.42Å; M290-E310 HydrophobicContact CE-CB 4.24Å; I291-E310 WeakPolarHBondContact O-CA 3.48Å; R292-E310 HydrophobicContact CG-CG 3.7Å; R292-E310 IonicContact CZ-OE1 3.65Å; R292-E310 VanDerWaalsContact CZ-OE1 3.28Å; R292-E310 IonicContact NE-OE1 2.91Å; R292-E310 PolarHBondContact NE-OE1 3.43Å; R292-E310 IonicContact NH2-OE1 2.63Å; R292-E310 PolarHBondContact NH2-OE1 3.08Å; F308-E310 PolarHBondContact O-N 3.07Å
311	V	85.3	Confident	76.8	Confident	29 Å²	29	78.1 Å²	78.1	18%	0.176	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.9	-179.5	-63.9	0	0	0	0	109.7	M290 I291 I293 K309 A313 Y316	M290-V311 CarbonylContact C-O 3.59Å; M290-V311 WeakPolarHBondContact CA-O 3.19Å; I291-V311 HydrophobicContact CG1-CG2 4.02Å; I291-V311 PolarHBondContact N-O 2.9Å; I291-V311 PolarHBondContact O-N 3Å; I293-V311 HydrophobicContact CG2-CG2 3.73Å; K309-V311 HydrophobicContact CD-CG1 4.4Å; K309-V311 HydrophobicContact CG-CG1 4.29Å; V311-A313 PolarHBondContact O-N 3.44Å; V311-Y316 HydrophobicContact CG2-CD2 4.36Å; V311-Y316 HydrophobicContact CG2-CG 4.34Å
312	D	88.2	Confident	78.3	Confident	22 Å²	22	70.4 Å²	70.4	12%	0.118	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	123.7	172.8	-172.9	-26.9	0	0	0	108.8	K288 M290 E314 Q315 Y316	K288-D312 IonicContact NZ-OD2 3.82Å; M290-D312 HydrophobicContact SD-CB 4.16Å; D312-E314 PolarHBondContact OD1-N 3.14Å; D312-E314 VanDerWaalsContact OD1-N 3.12Å; D312-Q315 HydrophobicContact CB-CB 3.95Å; D312-Q315 PolarHBondContact O-N 3.45Å; D312-Y316 VanDerWaalsContact O-CB 3.32Å; D312-Y316 WeakPolarHBondContact O-CB 3.49Å; D312-Y316 PolarHBondContact O-N 2.69Å
313	A	86.6	Confident	79.9	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-66.7	-40.5	-173.8	0	0	0	0	0	112.5	Y279 V289 I291 V311 Y316 Y317	Y279-A313 HydrophobicContact CD1-CB 3.54Å; Y279-A313 HydrophobicContact CD2-CB 3.66Å; Y279-A313 HydrophobicContact CE1-CB 3.78Å; Y279-A313 HydrophobicContact CE2-CB 3.88Å; Y279-A313 HydrophobicContact CG-CB 3.49Å; Y279-A313 VanDerWaalsContact CG-CB 3.49Å; V289-A313 VanDerWaalsContact O-CB 3.3Å; V289-A313 WeakPolarHBondContact O-CB 3.46Å; V289-A313 PolarHBondContact O-N 3.25Å; I291-A313 HydrophobicContact CB-CB 4.27Å; I291-A313 HydrophobicContact CD1-CB 3.77Å; I291-A313 HydrophobicContact CG1-CB 3.74Å; I291-A313 HydrophobicContact CG2-CB 3.66Å; V311-A313 PolarHBondContact O-N 3.44Å; A313-Y316 PolarHBondContact O-N 2.86Å; A313-Y317 WeakPolarHBondContact O-CD2 3.24Å; A313-Y317 PolarHBondContact O-N 3.02Å
314	E	86.5	Confident	81.7	Confident	54 Å²	54	64.3 Å²	64.3	25%	0.252	31%	0.31	S	S	.	.	H	α-helix	trans	-64.9	-46.4	178.9	176.5	170.4	-147.5	0	0	109.7	T280 D312 S318	T280-E314 WeakPolarHBondContact CB-OE1 3.21Å; T280-E314 WeakPolarHBondContact CG2-OE1 2.98Å; T280-E314 PolarHBondContact OG1-OE1 3.08Å; D312-E314 PolarHBondContact OD1-N 3.14Å; D312-E314 VanDerWaalsContact OD1-N 3.12Å; E314-S318 VanDerWaalsContact O-CB 3.31Å; E314-S318 WeakPolarHBondContact O-CB 3Å; E314-S318 PolarHBondContact O-N 3.31Å; E314-S318 PolarHBondContact O-OG 3.49Å
315	Q	88.9	Confident	83.2	Confident	72 Å²	72	62.3 Å²	62.3	34%	0.336	30%	0.296	S	S	.	.	H	α-helix	trans	-62	-47.3	177.6	-172.9	178.7	-12.7	0	0	111.7	D312 Y317 S318 E319	D312-Q315 HydrophobicContact CB-CB 3.95Å; D312-Q315 PolarHBondContact O-N 3.45Å; Q315-Y317 PolarHBondContact O-N 2.95Å; Q315-S318 PolarHBondContact O-N 3.37Å; Q315-E319 HydrophobicContact CG-CG 4.46Å; Q315-E319 WeakPolarHBondContact CG-OE1 3.35Å; Q315-E319 PolarHBondContact NE2-OE1 3.21Å; Q315-E319 WeakPolarHBondContact O-CG 3.26Å; Q315-E319 PolarHBondContact O-N 3.46Å
316	Y	89.5	Confident	85.1	Confident	61 Å²	61	54.8 Å²	54.8	24%	0.239	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-48.2	179.9	171.5	-96.3	0	0	0	112.4	I291 I293 V311 D312 A313 S318 E319 L320	I291-Y316 HydrophobicContact CD1-CD1 4.04Å; I293-Y316 HydrophobicContact CG2-CD1 4.43Å; I293-Y316 HydrophobicContact CG2-CD2 3.91Å; I293-Y316 HydrophobicContact CG2-CE1 4.25Å; I293-Y316 HydrophobicContact CG2-CE2 3.68Å; I293-Y316 HydrophobicContact CG2-CG 4.28Å; V311-Y316 HydrophobicContact CG2-CD2 4.36Å; V311-Y316 HydrophobicContact CG2-CG 4.34Å; D312-Y316 VanDerWaalsContact O-CB 3.32Å; D312-Y316 WeakPolarHBondContact O-CB 3.49Å; D312-Y316 PolarHBondContact O-N 2.69Å; A313-Y316 PolarHBondContact O-N 2.86Å; Y316-S318 VanDerWaalsContact C-N 3.32Å; Y316-E319 PolarHBondContact O-N 3.23Å; Y316-L320 HydrophobicContact CE1-CD2 4.05Å; Y316-L320 VanDerWaalsContact O-CB 3.27Å; Y316-L320 WeakPolarHBondContact O-CB 3.42Å; Y316-L320 PolarHBondContact O-N 3.41Å
317	Y	88.8	Confident	86.8	Confident	11 Å²	11	52.5 Å²	52.5	4%	0.043	25%	0.254	C	S	.	.	H	α-helix	trans	-70.5	-30.2	-179.8	-84.2	-73.5	0	0	0	112.6	A272 Y279 I291 A313 Q315 L320 E321 S579	A272-Y317 HydrophobicContact CB-CD1 4.43Å; A272-Y317 WeakPolarHBondContact O-CD1 2.99Å; Y279-Y317 AromaticContact CD2-CD2 3.63Å; Y279-Y317 HydrophobicContact CD2-CD2 3.63Å; Y279-Y317 AromaticContact CD2-CE2 3.8Å; Y279-Y317 HydrophobicContact CD2-CE2 3.8Å; Y279-Y317 AromaticContact CE2-CD2 3.86Å; Y279-Y317 HydrophobicContact CE2-CD2 3.86Å; Y279-Y317 AromaticContact CE2-CE2 3.51Å; Y279-Y317 HydrophobicContact CE2-CE2 3.51Å; I291-Y317 HydrophobicContact CD1-CD2 4.41Å; I291-Y317 HydrophobicContact CD1-CE2 3.99Å; A313-Y317 WeakPolarHBondContact O-CD2 3.24Å; A313-Y317 PolarHBondContact O-N 3.02Å; Q315-Y317 PolarHBondContact O-N 2.95Å; Y317-L320 HydrophobicContact CD1-CD2 4.39Å; Y317-E321 VanDerWaalsContact O-CB 3.3Å; Y317-E321 WeakPolarHBondContact O-CB 3.3Å; Y317-E321 PolarHBondContact O-N 3.13Å; Y317-S579 WeakPolarHBondContact OH-CB 3.23Å; Y317-S579 PolarHBondContact OH-OG 2.92Å
318	S	90.2	Very high	88.1	Confident	13 Å²	13	50.4 Å²	50.4	9%	0.091	24%	0.239	C	C	.	.	H	α-helix	trans	-66.6	-48.6	173.3	-55.7	0	0	0	0	111.7	R276 E314 Q315 Y316 L320 E321 E322	R276-S318 WeakPolarHBondContact CD-OG 3.2Å; R276-S318 WeakPolarHBondContact CG-OG 3.32Å; E314-S318 VanDerWaalsContact O-CB 3.31Å; E314-S318 WeakPolarHBondContact O-CB 3Å; E314-S318 PolarHBondContact O-N 3.31Å; E314-S318 PolarHBondContact O-OG 3.49Å; Q315-S318 PolarHBondContact O-N 3.37Å; Y316-S318 VanDerWaalsContact C-N 3.32Å; S318-L320 VanDerWaalsContact C-N 3.3Å; S318-L320 PolarHBondContact O-N 3Å; S318-E321 PolarHBondContact O-N 3.24Å; S318-E322 WeakPolarHBondContact O-CB 3.33Å; S318-E322 PolarHBondContact O-N 3.46Å
319	E	92.1	Very high	89.1	Confident	80 Å²	80	51.4 Å²	51.4	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-62.1	-39.3	176	-72	174.5	-171.7	0	0	111.6	Q315 Y316 E322 Q323	Q315-E319 HydrophobicContact CG-CG 4.46Å; Q315-E319 WeakPolarHBondContact CG-OE1 3.35Å; Q315-E319 PolarHBondContact NE2-OE1 3.21Å; Q315-E319 WeakPolarHBondContact O-CG 3.26Å; Q315-E319 PolarHBondContact O-N 3.46Å; Y316-E319 PolarHBondContact O-N 3.23Å; E319-E322 PolarHBondContact O-N 2.89Å; E319-Q323 WeakPolarHBondContact O-CB 3.13Å; E319-Q323 PolarHBondContact O-N 3.43Å
320	L	90.8	Very high	89.9	Confident	44 Å²	44	45.5 Å²	45.5	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-67.3	-41.6	177.6	-176.7	63.1	0	0	0	112.2	A272 Y316 Y317 S318 L324	A272-L320 HydrophobicContact CB-CB 4.37Å; A272-L320 HydrophobicContact CB-CD2 4.01Å; A272-L320 HydrophobicContact CB-CG 3.94Å; Y316-L320 HydrophobicContact CE1-CD2 4.05Å; Y316-L320 VanDerWaalsContact O-CB 3.27Å; Y316-L320 WeakPolarHBondContact O-CB 3.42Å; Y316-L320 PolarHBondContact O-N 3.41Å; Y317-L320 HydrophobicContact CD1-CD2 4.39Å; S318-L320 VanDerWaalsContact C-N 3.3Å; S318-L320 PolarHBondContact O-N 3Å; L320-L324 HydrophobicContact CD1-CD1 3.94Å; L320-L324 HydrophobicContact CD1-CG 4.22Å; L320-L324 HydrophobicContact CG-CD1 3.82Å; L320-L324 HydrophobicContact CG-CG 4.49Å; L320-L324 VanDerWaalsContact O-CB 3.32Å; L320-L324 WeakPolarHBondContact O-CB 3.43Å; L320-L324 WeakPolarHBondContact O-CD1 3.46Å; L320-L324 WeakPolarHBondContact O-CG 3.34Å; L320-L324 PolarHBondContact O-N 3.03Å
321	E	90.3	Very high	90.5	Very high	12 Å²	12	41.7 Å²	41.7	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-43.6	175.2	-178.5	-179.7	178.6	0	0	111.3	A272 M273 R276 Y317 S318 L324 T325	A272-E321 HydrophobicContact CB-CB 4.11Å; M273-E321 WeakPolarHBondContact CA-OE2 2.98Å; M273-E321 HydrophobicContact CB-CG 4.36Å; M273-E321 WeakPolarHBondContact CG-OE1 3.46Å; R276-E321 WeakPolarHBondContact CD-OE2 3.38Å; R276-E321 IonicContact CZ-OE2 2.72Å; R276-E321 IonicContact NE-OE2 3.73Å; R276-E321 PolarHBondContact NE-OE2 2.9Å; R276-E321 IonicContact NH2-OE1 3.69Å; R276-E321 IonicContact NH2-OE2 3.68Å; Y317-E321 VanDerWaalsContact O-CB 3.3Å; Y317-E321 WeakPolarHBondContact O-CB 3.3Å; Y317-E321 PolarHBondContact O-N 3.13Å; S318-E321 PolarHBondContact O-N 3.24Å; E321-L324 PolarHBondContact O-N 3.45Å; E321-T325 VanDerWaalsContact O-CB 3.23Å; E321-T325 WeakPolarHBondContact O-CB 3.46Å; E321-T325 PolarHBondContact O-N 3.46Å; E321-T325 PolarHBondContact O-OG1 2.89Å
322	E	90.6	Very high	90.8	Very high	33 Å²	33	42.9 Å²	42.9	15%	0.154	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-52.2	176.1	-172.4	179.1	173.6	0	0	110.5	S318 E319 L324 T325 D326 R762	S318-E322 WeakPolarHBondContact O-CB 3.33Å; S318-E322 PolarHBondContact O-N 3.46Å; E319-E322 PolarHBondContact O-N 2.89Å; E322-L324 PolarHBondContact O-N 3.41Å; E322-T325 PolarHBondContact O-N 2.86Å; E322-T325 VanDerWaalsContact O-N 3.16Å; E322-D326 PolarHBondContact O-N 3.47Å; E322-R762 IonicContact OE1-CZ 3.28Å; E322-R762 IonicContact OE1-NH1 2.78Å; E322-R762 PolarHBondContact OE1-NH1 2.86Å
323	Q	93.9	Very high	91	Very high	108 Å²	108	47.9 Å²	47.9	51%	0.505	24%	0.243	S	C	.	.	H	α-helix	trans	-58.3	-47.2	178.6	-175.1	-173.8	-16.6	0	0	112.2	E319 T325 D326 E327	E319-Q323 WeakPolarHBondContact O-CB 3.13Å; E319-Q323 PolarHBondContact O-N 3.43Å; Q323-T325 VanDerWaalsContact C-N 3.28Å; Q323-T325 PolarHBondContact O-N 3.29Å; Q323-D326 PolarHBondContact O-N 2.81Å; Q323-E327 PolarHBondContact NE2-OE1 3.23Å; Q323-E327 WeakPolarHBondContact O-CG 3.32Å; Q323-E327 PolarHBondContact O-N 2.92Å
324	L	93.4	Very high	91.2	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.052	27%	0.268	C	S	.	.	H	α-helix	trans	-68	-30.3	-179.6	-71.9	169	0	0	0	112.1	L265 Q268 R269 A272 L320 E321 E322 F328	L265-L324 HydrophobicContact CD2-CD2 4.29Å; Q268-L324 HydrophobicContact CB-CD1 3.93Å; Q268-L324 HydrophobicContact CB-CD2 4.06Å; R269-L324 HydrophobicContact CB-CB 4.13Å; R269-L324 HydrophobicContact CG-CB 4.48Å; A272-L324 HydrophobicContact CB-CD1 3.95Å; L320-L324 HydrophobicContact CD1-CD1 3.94Å; L320-L324 HydrophobicContact CD1-CG 4.22Å; L320-L324 HydrophobicContact CG-CD1 3.82Å; L320-L324 HydrophobicContact CG-CG 4.49Å; L320-L324 VanDerWaalsContact O-CB 3.32Å; L320-L324 WeakPolarHBondContact O-CB 3.43Å; L320-L324 WeakPolarHBondContact O-CD1 3.46Å; L320-L324 WeakPolarHBondContact O-CG 3.34Å; L320-L324 PolarHBondContact O-N 3.03Å; E321-L324 PolarHBondContact O-N 3.45Å; E322-L324 PolarHBondContact O-N 3.41Å; L324-F328 WeakPolarHBondContact O-CB 3.5Å; L324-F328 PolarHBondContact O-N 3.01Å
325	T	91	Very high	91.4	Very high	13 Å²	13	52.2 Å²	52.2	8%	0.08	26%	0.257	C	S	.	.	H	α-helix	trans	-70.2	-42	175.1	-60.6	0	0	0	0	111	R269 E321 E322 Q323 F328 N329	R269-T325 WeakPolarHBondContact CD-OG1 3.36Å; E321-T325 VanDerWaalsContact O-CB 3.23Å; E321-T325 WeakPolarHBondContact O-CB 3.46Å; E321-T325 PolarHBondContact O-N 3.46Å; E321-T325 PolarHBondContact O-OG1 2.89Å; E322-T325 PolarHBondContact O-N 2.86Å; E322-T325 VanDerWaalsContact O-N 3.16Å; Q323-T325 VanDerWaalsContact C-N 3.28Å; Q323-T325 PolarHBondContact O-N 3.29Å; T325-F328 PolarHBondContact O-N 3.35Å; T325-N329 WeakPolarHBondContact O-CB 3.38Å; T325-N329 VanDerWaalsContact O-CG 3.24Å; T325-N329 PolarHBondContact O-N 2.9Å; T325-N329 PolarHBondContact O-ND2 3.48Å
326	D	93	Very high	91.3	Very high	92 Å²	92	52.7 Å²	52.7	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-46.4	174	-74.9	-14.4	0	0	0	111.5	E322 Q323 N329 A330	E322-D326 PolarHBondContact O-N 3.47Å; Q323-D326 PolarHBondContact O-N 2.81Å; D326-N329 PolarHBondContact O-N 3.32Å; D326-A330 VanDerWaalsContact O-CB 3.3Å; D326-A330 WeakPolarHBondContact O-CB 3.45Å; D326-A330 PolarHBondContact O-N 3.31Å
327	E	93.8	Very high	91.4	Very high	87 Å²	87	57 Å²	57	41%	0.407	29%	0.294	S	S	.	.	H	α-helix	trans	-63.2	-41	175.8	-72.7	-177.7	-155.3	0	0	112	L265 Q323 A330 E331	L265-E327 HydrophobicContact CD2-CB 4.15Å; Q323-E327 PolarHBondContact NE2-OE1 3.23Å; Q323-E327 WeakPolarHBondContact O-CG 3.32Å; Q323-E327 PolarHBondContact O-N 2.92Å; E327-A330 PolarHBondContact O-N 3.24Å; E327-E331 WeakPolarHBondContact O-CB 3.38Å; E327-E331 PolarHBondContact O-N 3.28Å
328	F	92.6	Very high	91.4	Very high	10 Å²	10	59.9 Å²	59.9	4%	0.044	31%	0.306	C	S	.	.	H	α-helix	trans	-61.1	-49	175	174.3	-90.5	0	0	0	111.4	L262 L265 D266 L324 T325 A330 E331 L332	L262-F328 HydrophobicContact CD1-CD2 3.53Å; L262-F328 HydrophobicContact CD1-CE2 3.38Å; L262-F328 HydrophobicContact CD1-CG 4.22Å; L262-F328 HydrophobicContact CD1-CZ 3.98Å; L262-F328 HydrophobicContact CD2-CE2 4.36Å; L262-F328 HydrophobicContact CG-CD2 4.14Å; L262-F328 HydrophobicContact CG-CE2 3.64Å; L262-F328 HydrophobicContact CG-CZ 4.34Å; L265-F328 HydrophobicContact CB-CD2 4.47Å; D266-F328 HydrophobicContact CB-CD2 4.08Å; D266-F328 HydrophobicContact CB-CE2 3.84Å; L324-F328 WeakPolarHBondContact O-CB 3.5Å; L324-F328 PolarHBondContact O-N 3.01Å; T325-F328 PolarHBondContact O-N 3.35Å; F328-A330 PolarHBondContact O-N 3.5Å; F328-E331 PolarHBondContact O-N 2.99Å; F328-L332 HydrophobicContact CE1-CD2 4.09Å; F328-L332 VanDerWaalsContact O-CB 3.31Å; F328-L332 WeakPolarHBondContact O-CB 3.14Å; F328-L332 PolarHBondContact O-N 3.3Å
329	N	91.3	Very high	91.5	Very high	67 Å²	67	60.2 Å²	60.2	36%	0.358	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-40.4	179.4	-73.2	-28.1	0	0	0	111.6	T325 D326 E331 L332 N333	T325-N329 WeakPolarHBondContact O-CB 3.38Å; T325-N329 VanDerWaalsContact O-CG 3.24Å; T325-N329 PolarHBondContact O-N 2.9Å; T325-N329 PolarHBondContact O-ND2 3.48Å; D326-N329 PolarHBondContact O-N 3.32Å; N329-E331 VanDerWaalsContact C-N 3.33Å; N329-E331 PolarHBondContact O-N 2.94Å; N329-L332 PolarHBondContact O-N 3.16Å; N329-N333 PolarHBondContact O-N 3.31Å; N329-N333 VanDerWaalsContact O-N 3.07Å; N329-N333 PolarHBondContact O-ND2 2.82Å; N329-N333 VanDerWaalsContact O-ND2 3.12Å
330	A	92.6	Very high	91.5	Very high	43 Å²	43	57.1 Å²	57.1	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-40.6	174.8	0	0	0	0	0	112	D326 E327 F328 R334	D326-A330 VanDerWaalsContact O-CB 3.3Å; D326-A330 WeakPolarHBondContact O-CB 3.45Å; D326-A330 PolarHBondContact O-N 3.31Å; E327-A330 PolarHBondContact O-N 3.24Å; F328-A330 PolarHBondContact O-N 3.5Å; A330-R334 WeakPolarHBondContact O-CG 3.44Å
331	E	92.4	Very high	91.5	Very high	14 Å²	14	57.6 Å²	57.6	7%	0.065	29%	0.294	C	S	.	.	H	α-helix	trans	-73.9	-37.9	176.4	-173.7	66.3	175.9	0	0	112.1	N261 L262 L265 E327 F328 N329 N333 R334 V335 K338	N261-E331 HydrophobicContact CB-CG 4.37Å; L262-E331 HydrophobicContact CD1-CB 4.35Å; L262-E331 HydrophobicContact CD1-CG 4.34Å; L265-E331 HydrophobicContact CD1-CB 3.95Å; L265-E331 HydrophobicContact CD1-CG 4.29Å; E327-E331 WeakPolarHBondContact O-CB 3.38Å; E327-E331 PolarHBondContact O-N 3.28Å; F328-E331 PolarHBondContact O-N 2.99Å; N329-E331 VanDerWaalsContact C-N 3.33Å; N329-E331 PolarHBondContact O-N 2.94Å; E331-N333 VanDerWaalsContact C-N 3.31Å; E331-N333 PolarHBondContact O-N 3.44Å; E331-R334 CarbonylContact O-C 3.51Å; E331-R334 WeakPolarHBondContact O-CA 3.49Å; E331-R334 WeakPolarHBondContact O-CB 3.5Å; E331-R334 PolarHBondContact O-N 3.41Å; E331-R334 IonicContact OE2-NH1 2.89Å; E331-V335 WeakPolarHBondContact O-CG2 3.14Å; E331-V335 PolarHBondContact O-N 3.06Å; E331-V335 VanDerWaalsContact O-N 3.14Å; E331-K338 VanDerWaalsContact CD-NZ 3.29Å; E331-K338 IonicContact OE1-NZ 3.64Å; E331-K338 PolarHBondContact OE1-NZ 3.28Å; E331-K338 IonicContact OE2-NZ 2.71Å; E331-K338 PolarHBondContact OE2-NZ 2.87Å
332	L	91	Very high	91.6	Very high	54 Å²	54	57.2 Å²	57.2	28%	0.283	29%	0.292	S	S	.	.	H	α-helix	trans	-56.6	-45	175.8	-176.8	64.5	0	0	0	111.1	L262 F328 N329 R334 V335 L747	L262-L332 HydrophobicContact CD1-CB 4.12Å; L262-L332 HydrophobicContact CD1-CD1 4.44Å; L262-L332 HydrophobicContact CD2-CD1 4.04Å; F328-L332 HydrophobicContact CE1-CD2 4.09Å; F328-L332 VanDerWaalsContact O-CB 3.31Å; F328-L332 WeakPolarHBondContact O-CB 3.14Å; F328-L332 PolarHBondContact O-N 3.3Å; N329-L332 PolarHBondContact O-N 3.16Å; L332-R334 PolarHBondContact O-N 2.7Å; L332-V335 WeakPolarHBondContact O-CB 3.27Å; L332-V335 PolarHBondContact O-N 3.31Å; L332-V335 VanDerWaalsContact O-N 3.11Å; L332-L747 HydrophobicContact CD1-CD2 3.91Å
333	N	91.1	Very high	91.7	Very high	128 Å²	128	55.6 Å²	55.6	68%	0.684	29%	0.285	S	S	*	.	H	α-helix	trans	-63.3	-23.1	175.3	-71.8	-34.2	0	0	0	113.3	N329 E331	N329-N333 PolarHBondContact O-N 3.31Å; N329-N333 VanDerWaalsContact O-N 3.07Å; N329-N333 PolarHBondContact O-ND2 2.82Å; N329-N333 VanDerWaalsContact O-ND2 3.12Å; E331-N333 VanDerWaalsContact C-N 3.31Å; E331-N333 PolarHBondContact O-N 3.44Å
334	R	91.6	Very high	91.7	Very high	139 Å²	139	50.5 Å²	50.5	53%	0.525	26%	0.261	S	S	.	.	H	α-helix	trans	-88.7	-13.9	176.9	-66.3	169.8	178.5	164.2	1.3	113.3	A330 E331 L332 L337	A330-R334 WeakPolarHBondContact O-CG 3.44Å; E331-R334 CarbonylContact O-C 3.51Å; E331-R334 WeakPolarHBondContact O-CA 3.49Å; E331-R334 WeakPolarHBondContact O-CB 3.5Å; E331-R334 PolarHBondContact O-N 3.41Å; E331-R334 IonicContact OE2-NH1 2.89Å; L332-R334 PolarHBondContact O-N 2.7Å; R334-L337 WeakPolarHBondContact O-CB 3.48Å; R334-L337 PolarHBondContact O-N 2.8Å
335	V	90.2	Very high	91.7	Very high	5 Å²	5	50 Å²	50	3%	0.03	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-45.3	-177.4	174.2	0	0	0	0	112.9	Y257 V259 L262 E331 L332 L337 K338 L747	Y257-V335 VanDerWaalsContact CB-CG1 3.42Å; Y257-V335 HydrophobicContact CD1-CG1 4.21Å; Y257-V335 VanDerWaalsContact CD1-O 3.31Å; Y257-V335 WeakPolarHBondContact CD1-O 3.48Å; Y257-V335 HydrophobicContact CD2-CG1 4.29Å; Y257-V335 HydrophobicContact CG-CG1 3.74Å; V259-V335 HydrophobicContact CG1-CG1 4.42Å; L262-V335 HydrophobicContact CD2-CG2 4.1Å; E331-V335 WeakPolarHBondContact O-CG2 3.14Å; E331-V335 PolarHBondContact O-N 3.06Å; E331-V335 VanDerWaalsContact O-N 3.14Å; L332-V335 WeakPolarHBondContact O-CB 3.27Å; L332-V335 PolarHBondContact O-N 3.31Å; L332-V335 VanDerWaalsContact O-N 3.11Å; V335-L337 PolarHBondContact O-N 2.6Å; V335-K338 PolarHBondContact O-N 3.4Å; V335-L747 HydrophobicContact CG1-CD2 4.26Å
336	P	88.2	Confident	91.7	Very high	83 Å²	83	50.4 Å²	50.4	54%	0.539	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-58	-33.6	180	-25.8	36.1	0	0	0	113.3	K338	P336-K338 PolarHBondContact O-N 3.26Å
337	L	89.9	Confident	91.5	Very high	152 Å²	152	46 Å²	46	80%	0.796	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-70.5	-18.7	177.5	-55.7	173.8	0	0	0	112.8	R334 V335	R334-L337 WeakPolarHBondContact O-CB 3.48Å; R334-L337 PolarHBondContact O-N 2.8Å; V335-L337 PolarHBondContact O-N 2.6Å
338	K	90.6	Very high	91.2	Very high	71 Å²	71	46.9 Å²	46.9	31%	0.309	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-102.2	42.2	-177.4	-59.6	-178.1	-170.5	178.2	0	112.1	D258 E331 V335 P336	D258-K338 HydrophobicContact CB-CB 4.07Å; D258-K338 PolarHBondContact N-O 3.4Å; E331-K338 VanDerWaalsContact CD-NZ 3.29Å; E331-K338 IonicContact OE1-NZ 3.64Å; E331-K338 PolarHBondContact OE1-NZ 3.28Å; E331-K338 IonicContact OE2-NZ 2.71Å; E331-K338 PolarHBondContact OE2-NZ 2.87Å; V335-K338 PolarHBondContact O-N 3.4Å; P336-K338 PolarHBondContact O-N 3.26Å
339	R	91.4	Very high	90.8	Very high	20 Å²	20	50.4 Å²	50.4	8%	0.075	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	136	179.1	-175.9	-180	169.9	-165.1	12	112.9	P228 K229 I231 Y257	P228-R339 PolarHBondContact O-NH1 3.25Å; K229-R339 WeakPolarHBondContact CE-O 3.48Å; K229-R339 PolarHBondContact NZ-O 3.29Å; K229-R339 PolarHBondContact O-NH1 3.06Å; I231-R339 VanDerWaalsContact N-NH1 3.14Å; I231-R339 PolarHBondContact O-NH1 3.16Å; I231-R339 PolarHBondContact O-NH2 3Å; Y257-R339 HydrophobicContact CD1-CB 4.16Å; Y257-R339 HydrophobicContact CE1-CB 4.12Å; Y257-R339 HydrophobicContact CE1-CG 4.31Å
340	L	91.9	Very high	90.4	Very high	14 Å²	14	49.4 Å²	49.4	7%	0.073	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	155.1	172.4	-56.4	179.7	0	0	0	110.8	C256 D258 L342 L399	C256-L340 HydrophobicContact CB-CB 4.25Å; C256-L340 HydrophobicContact CB-CD1 4.16Å; C256-L340 WeakPolarHBondContact O-CB 3.35Å; C256-L340 PolarHBondContact O-N 2.77Å; D258-L340 HydrophobicContact CB-CD2 4.31Å; L340-L342 HydrophobicContact CB-CB 4.26Å; L340-L342 PolarHBondContact O-N 3.3Å; L340-L399 HydrophobicContact CD1-CB 4.43Å; L340-L399 HydrophobicContact CD1-CD2 4.43Å; L340-L399 HydrophobicContact CD1-CG 4.24Å
341	D	91.3	Very high	90	Very high	54 Å²	54	55.2 Å²	55.2	29%	0.289	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	32.8	173.4	58	-38.2	0	0	0	112.4	T225 Y226 V227	T225-D341 CarbonylContact C-O 3.55Å; T225-D341 WeakPolarHBondContact CA-O 3.45Å; Y226-D341 PolarHBondContact N-O 2.8Å; V227-D341 PolarHBondContact N-O 2.77Å; V227-D341 VanDerWaalsContact N-O 3.16Å; V227-D341 WeakPolarHBondContact O-CA 3.06Å; V227-D341 WeakPolarHBondContact O-CB 3.44Å
342	L	92.5	Very high	89.8	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.6	-170.7	177.1	77	0	0	0	110.2	M223 I224 T225 C256 L340 L399	M223-L342 HydrophobicContact CE-CD1 3.34Å; M223-L342 HydrophobicContact CE-CD2 3.91Å; M223-L342 HydrophobicContact CE-CG 4.28Å; M223-L342 HydrophobicContact CG-CD1 3.65Å; M223-L342 HydrophobicContact SD-CD1 4.35Å; I224-L342 WeakPolarHBondContact O-CA 3.32Å; I224-L342 WeakPolarHBondContact O-CD1 3.37Å; T225-L342 HydrophobicContact CG2-CD1 3.36Å; C256-L342 HydrophobicContact CB-CB 4.17Å; C256-L342 HydrophobicContact CB-CD2 4Å; C256-L342 HydrophobicContact CB-CG 4.23Å; C256-L342 VanDerWaalsContact CB-O 3.32Å; C256-L342 WeakPolarHBondContact CB-O 3.42Å; C256-L342 PolarHBondContact N-O 3.42Å; C256-L342 VanDerWaalsContact N-O 3.16Å; L340-L342 HydrophobicContact CB-CB 4.26Å; L340-L342 PolarHBondContact O-N 3.3Å; L342-L399 HydrophobicContact CD2-CD1 3.49Å; L342-L399 VanDerWaalsContact CD2-CD1 3.49Å; L342-L399 HydrophobicContact CD2-CD2 3.57Å; L342-L399 HydrophobicContact CD2-CG 3.5Å
343	I	93.2	Very high	89.7	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.5	176	67.4	176.7	0	0	0	112.2	I224 V227 I237 V253 H254 F255 V345	I224-I343 HydrophobicContact CB-CD1 4.23Å; I224-I343 HydrophobicContact CB-CG1 3.71Å; I224-I343 HydrophobicContact CD1-CD1 4.33Å; I224-I343 HydrophobicContact CG1-CG1 4.36Å; I224-I343 HydrophobicContact CG2-CG1 4.47Å; I224-I343 PolarHBondContact N-O 3.27Å; I224-I343 PolarHBondContact O-N 3.49Å; V227-I343 HydrophobicContact CB-CG2 4.43Å; V227-I343 HydrophobicContact CG1-CG2 4.44Å; V227-I343 HydrophobicContact CG2-CD1 3.85Å; V227-I343 HydrophobicContact CG2-CG1 3.91Å; V227-I343 HydrophobicContact CG2-CG2 4.29Å; I237-I343 HydrophobicContact CD1-CD1 3.79Å; I237-I343 HydrophobicContact CG2-CD1 4.05Å; V253-I343 HydrophobicContact CG1-CD1 4.36Å; H254-I343 CarbonylContact O-C 3.06Å; H254-I343 VanDerWaalsContact O-CA 3.27Å; H254-I343 WeakPolarHBondContact O-CA 3.23Å; H254-I343 WeakPolarHBondContact O-CB 3.33Å; F255-I343 HydrophobicContact CD1-CG2 3.38Å; F255-I343 HydrophobicContact CE1-CG2 3.7Å; F255-I343 HydrophobicContact CG-CG2 4.49Å; I343-V345 HydrophobicContact CD1-CG2 3.66Å; I343-V345 HydrophobicContact CG1-CG2 4.01Å
344	F	93.4	Very high	89.5	Confident	1 Å²	1	49.1 Å²	49.1	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.7	166.6	-68.5	-72.9	0	0	0	109.9	T221 L222 M223 H254 C256 A388 I394 W396 Y742	T221-F344 HydrophobicContact CG2-CB 3.98Å; T221-F344 HydrophobicContact CG2-CD1 4.22Å; L222-F344 CarbonylContact O-C 3.58Å; L222-F344 WeakPolarHBondContact O-CA 3.44Å; M223-F344 HydrophobicContact CB-CD1 4.09Å; M223-F344 HydrophobicContact CB-CE1 3.79Å; M223-F344 HydrophobicContact CG-CD1 4.37Å; M223-F344 HydrophobicContact CG-CE1 3.76Å; M223-F344 HydrophobicContact CG-CZ 4.31Å; M223-F344 HydrophobicContact SD-CE1 4.34Å; H254-F344 HydrophobicContact CB-CB 4.33Å; H254-F344 PolarHBondContact N-O 3.26Å; H254-F344 PolarHBondContact O-N 2.97Å; C256-F344 VanDerWaalsContact SG-CD2 3.52Å; C256-F344 WeakPolarHBondContact SG-CE2 3.44Å; F344-A388 HydrophobicContact CD1-CB 3.95Å; F344-A388 HydrophobicContact CE1-CB 4.04Å; F344-I394 HydrophobicContact CE1-CD1 4.2Å; F344-I394 HydrophobicContact CE2-CD1 4.41Å; F344-I394 HydrophobicContact CZ-CD1 3.69Å; F344-W396 HydrophobicContact CE2-CH2 4.15Å; F344-W396 HydrophobicContact CE2-CZ3 4.3Å; F344-Y742 HydrophobicContact CB-CG 4.34Å; F344-Y742 AromaticContact CD1-CD1 3.82Å; F344-Y742 HydrophobicContact CD1-CD1 3.82Å; F344-Y742 HydrophobicContact CD1-CE1 4.3Å; F344-Y742 HydrophobicContact CD1-CG 4.21Å; F344-Y742 HydrophobicContact CD2-CD1 4.33Å; F344-Y742 HydrophobicContact CD2-CG 4.43Å; F344-Y742 AromaticContact CE1-CD1 3.89Å; F344-Y742 HydrophobicContact CE1-CD1 3.89Å; F344-Y742 HydrophobicContact CE1-CE1 4.24Å; F344-Y742 HydrophobicContact CE2-CD1 4.4Å; F344-Y742 HydrophobicContact CG-CD1 4.06Å; F344-Y742 HydrophobicContact CG-CG 4.08Å; F344-Y742 HydrophobicContact CZ-CD1 4.2Å
345	V	92.9	Very high	89.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.9	179.7	-177.4	0	0	0	0	108.8	T221 L222 I224 I237 F241 V250 V253 I343 F347	T221-V345 CarbonylContact C-O 3.56Å; T221-V345 VanDerWaalsContact CA-O 3.25Å; T221-V345 WeakPolarHBondContact CA-O 3.24Å; L222-V345 PolarHBondContact N-O 3.13Å; L222-V345 PolarHBondContact O-N 3.1Å; I224-V345 HydrophobicContact CD1-CB 4.35Å; I224-V345 HydrophobicContact CD1-CG2 3.74Å; I224-V345 HydrophobicContact CG1-CG2 4.42Å; I237-V345 HydrophobicContact CG2-CG2 4.39Å; F241-V345 HydrophobicContact CD2-CG1 4.13Å; F241-V345 HydrophobicContact CE2-CB 4.48Å; F241-V345 HydrophobicContact CE2-CG1 3.94Å; F241-V345 HydrophobicContact CE2-CG2 4.06Å; V250-V345 HydrophobicContact CG1-CG1 3.69Å; V250-V345 HydrophobicContact CG2-CG1 4.16Å; V253-V345 HydrophobicContact CG1-CG2 4.42Å; V253-V345 HydrophobicContact CG2-CG1 4.31Å; V253-V345 HydrophobicContact CG2-CG2 4.34Å; I343-V345 HydrophobicContact CD1-CG2 3.66Å; I343-V345 HydrophobicContact CG1-CG2 4.01Å; V345-F347 HydrophobicContact CB-CE2 4.23Å; V345-F347 HydrophobicContact CG1-CD2 4.4Å; V345-F347 HydrophobicContact CG1-CE2 3.69Å; V345-F347 HydrophobicContact CG1-CZ 3.85Å
346	T	90.8	Very high	89.4	Confident	21 Å²	21	48.9 Å²	48.9	13%	0.129	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.5	-178.1	-57.1	0	0	0	0	110.1	R220 T221 T251 R252	R220-T346 HydrophobicContact CG-CG2 3.96Å; T221-T346 WeakPolarHBondContact CG2-OG1 3.41Å; T221-T346 WeakPolarHBondContact OG1-CG2 3.35Å; T221-T346 PolarHBondContact OG1-OG1 3.43Å; T251-T346 PolarHBondContact N-O 3.02Å; T251-T346 WeakPolarHBondContact OG1-CB 3.42Å; T251-T346 WeakPolarHBondContact OG1-CG2 3.24Å; T251-T346 PolarHBondContact OG1-O 3.35Å; R252-T346 PolarHBondContact N-O 3.12Å; R252-T346 PolarHBondContact O-N 3.21Å
347	F	90	Very high	89.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	162.4	175	-64.2	-93.8	0	0	0	110.7	R220 L222 F241 V249 V250 V345 M352 A353 V356	R220-F347 WeakPolarHBondContact CB-O 3.12Å; R220-F347 WeakPolarHBondContact CD-O 3.25Å; R220-F347 WeakPolarHBondContact O-CB 3.45Å; R220-F347 WeakPolarHBondContact O-CD2 3.33Å; R220-F347 PolarHBondContact O-N 3Å; L222-F347 HydrophobicContact CB-CE2 4.36Å; L222-F347 HydrophobicContact CD1-CD2 4.29Å; L222-F347 HydrophobicContact CD1-CE2 3.47Å; L222-F347 VanDerWaalsContact CD1-CE2 3.47Å; L222-F347 HydrophobicContact CD1-CZ 4.07Å; L222-F347 HydrophobicContact CG-CD2 4.27Å; L222-F347 HydrophobicContact CG-CE2 3.79Å; F241-F347 HydrophobicContact CD1-CE1 4.29Å; F241-F347 AromaticContact CD1-CZ 3.99Å; F241-F347 HydrophobicContact CD1-CZ 3.99Å; F241-F347 HydrophobicContact CE1-CZ 4.17Å; F241-F347 HydrophobicContact CG-CE1 4.37Å; F241-F347 HydrophobicContact CG-CZ 4.23Å; V249-F347 WeakPolarHBondContact O-CA 3.41Å; V250-F347 HydrophobicContact CG2-CD1 4.07Å; V250-F347 HydrophobicContact CG2-CE1 3.7Å; V250-F347 HydrophobicContact CG2-CZ 4.24Å; V345-F347 HydrophobicContact CB-CE2 4.23Å; V345-F347 HydrophobicContact CG1-CD2 4.4Å; V345-F347 HydrophobicContact CG1-CE2 3.69Å; V345-F347 HydrophobicContact CG1-CZ 3.85Å; F347-M352 HydrophobicContact CB-CB 4.04Å; F347-M352 HydrophobicContact CD1-CB 3.96Å; F347-M352 HydrophobicContact CG-CB 4.19Å; F347-A353 HydrophobicContact CD2-CB 3.89Å; F347-A353 HydrophobicContact CG-CB 4.4Å; F347-V356 HydrophobicContact CE1-CG2 4.04Å; F347-V356 HydrophobicContact CZ-CB 4.5Å; F347-V356 HydrophobicContact CZ-CG2 3.94Å
348	Q	87.4	Confident	89.4	Confident	105 Å²	105	48.5 Å²	48.5	49%	0.491	22%	0.217	S	C	.	.	S	Bend	trans	-62.1	-48.6	172.8	-174.3	171.9	13.9	0	0	110.7	V249 T251 M352	V249-Q348 HydrophobicContact CB-CB 4.25Å; V249-Q348 PolarHBondContact O-N 2.98Å; T251-Q348 HydrophobicContact CG2-CB 4.17Å; Q348-M352 HydrophobicContact CB-CE 4.32Å; Q348-M352 HydrophobicContact CB-SD 4.14Å
349	D	84.3	Confident	89.3	Confident	83 Å²	83	47.1 Å²	47.1	44%	0.444	21%	0.213	S	C	.	.	S	Bend	trans	-117.9	148.5	-178.2	-68.3	-40.2	0	0	0	113.6	R351 M352 A353	D349-R351 PolarHBondContact O-N 3.36Å; D349-M352 HydrophobicContact CB-CE 4.21Å; D349-M352 HydrophobicContact CB-CG 4.12Å; D349-M352 HydrophobicContact CB-SD 4.22Å; D349-M352 WeakPolarHBondContact O-CB 3.25Å; D349-M352 PolarHBondContact O-N 2.96Å; D349-A353 PolarHBondContact O-N 3.27Å
350	S	82.3	Confident	89.2	Confident	47 Å²	47	46.6 Å²	46.6	33%	0.329	21%	0.211	S	C	.	.	H	α-helix	trans	-63.5	-28.6	174.7	67.6	0	0	0	0	113	V218 A353 K354	V218-S350 WeakPolarHBondContact O-CB 3.24Å; S350-A353 PolarHBondContact O-N 2.85Å; S350-K354 PolarHBondContact O-N 2.91Å
351	R	83.9	Confident	88.9	Confident	165 Å²	165	52.2 Å²	52.2	62%	0.623	24%	0.235	S	C	*	.	H	α-helix	trans	-63.8	-39.7	175.4	-63.8	-178	-176.7	-164.9	-1	111.6	D349 K354 R355	D349-R351 PolarHBondContact O-N 3.36Å; R351-K354 PolarHBondContact O-N 2.8Å; R351-R355 PolarHBondContact O-N 3.37Å
352	M	88.7	Confident	88.5	Confident	20 Å²	20	55 Å²	55	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-47.2	177.4	-60.2	172.8	-176.4	0	0	110.6	G247 V249 F347 Q348 D349 K354 R355 V356	G247-M352 WeakPolarHBondContact O-CE 3.42Å; V249-M352 PolarHBondContact N-SD 2.93Å; V249-M352 VanDerWaalsContact N-SD 3.41Å; F347-M352 HydrophobicContact CB-CB 4.04Å; F347-M352 HydrophobicContact CD1-CB 3.96Å; F347-M352 HydrophobicContact CG-CB 4.19Å; Q348-M352 HydrophobicContact CB-CE 4.32Å; Q348-M352 HydrophobicContact CB-SD 4.14Å; D349-M352 HydrophobicContact CB-CE 4.21Å; D349-M352 HydrophobicContact CB-CG 4.12Å; D349-M352 HydrophobicContact CB-SD 4.22Å; D349-M352 WeakPolarHBondContact O-CB 3.25Å; D349-M352 PolarHBondContact O-N 2.96Å; M352-K354 VanDerWaalsContact C-N 3.33Å; M352-K354 PolarHBondContact O-N 3.06Å; M352-R355 WeakPolarHBondContact O-CB 3.27Å; M352-R355 PolarHBondContact O-N 3.21Å; M352-R355 VanDerWaalsContact O-N 3.14Å; M352-V356 PolarHBondContact O-N 3.04Å; M352-V356 VanDerWaalsContact O-N 3.08Å
353	A	88.3	Confident	88.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-41.9	175.9	0	0	0	0	0	112.3	L222 F347 D349 S350 R357	L222-A353 HydrophobicContact CD1-CB 4.38Å; L222-A353 HydrophobicContact CD2-CB 3.9Å; L222-A353 HydrophobicContact CG-CB 3.96Å; F347-A353 HydrophobicContact CD2-CB 3.89Å; F347-A353 HydrophobicContact CG-CB 4.4Å; D349-A353 PolarHBondContact O-N 3.27Å; S350-A353 PolarHBondContact O-N 2.85Å; A353-R357 WeakPolarHBondContact O-CB 3.19Å; A353-R357 PolarHBondContact O-N 3.34Å
354	K	86.9	Confident	87.3	Confident	47 Å²	47	62.6 Å²	62.6	20%	0.204	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-43.1	174.4	-78.2	-174	-178.2	-173.3	0	112.5	V218 S350 R351 M352 R357 K358 M387	V218-K354 HydrophobicContact CG1-CD 4.19Å; V218-K354 VanDerWaalsContact CG1-CE 3.5Å; V218-K354 HydrophobicContact CG1-CG 3.8Å; S350-K354 PolarHBondContact O-N 2.91Å; R351-K354 PolarHBondContact O-N 2.8Å; M352-K354 VanDerWaalsContact C-N 3.33Å; M352-K354 PolarHBondContact O-N 3.06Å; K354-R357 PolarHBondContact O-N 3.46Å; K354-K358 WeakPolarHBondContact O-CB 3.23Å; K354-K358 PolarHBondContact O-N 3.01Å; K354-M387 HydrophobicContact CB-CE 4.22Å; K354-M387 HydrophobicContact CG-CE 3.55Å
355	R	88.8	Confident	86.6	Confident	139 Å²	139	67.3 Å²	67.3	53%	0.525	31%	0.309	S	S	.	.	H	α-helix	trans	-58.8	-51.2	178.9	-176.7	-175.3	-68.8	149.6	-4.4	110.7	R351 M352 R357 K358 D359	R351-R355 PolarHBondContact O-N 3.37Å; M352-R355 WeakPolarHBondContact O-CB 3.27Å; M352-R355 PolarHBondContact O-N 3.21Å; M352-R355 VanDerWaalsContact O-N 3.14Å; R355-R357 PolarHBondContact O-N 3.22Å; R355-K358 PolarHBondContact O-N 3.03Å; R355-D359 PolarHBondContact O-N 3.26Å
356	V	90.4	Very high	85.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-59.3	-49.3	176.5	175.2	0	0	0	0	110.5	L222 F241 Y245 F347 M352 K358 D359 Y360	L222-V356 HydrophobicContact CD1-CB 3.83Å; L222-V356 HydrophobicContact CD1-CG1 3.67Å; F241-V356 HydrophobicContact CD1-CG1 4.31Å; F241-V356 HydrophobicContact CD1-CG2 4.3Å; F241-V356 HydrophobicContact CE1-CG1 3.63Å; F241-V356 HydrophobicContact CE1-CG2 4.41Å; Y245-V356 HydrophobicContact CD1-CG2 4.32Å; Y245-V356 HydrophobicContact CD2-CG2 3.92Å; Y245-V356 HydrophobicContact CE1-CG2 4.42Å; Y245-V356 HydrophobicContact CE2-CG1 4.3Å; Y245-V356 HydrophobicContact CE2-CG2 4.02Å; Y245-V356 HydrophobicContact CG-CG2 4.06Å; F347-V356 HydrophobicContact CE1-CG2 4.04Å; F347-V356 HydrophobicContact CZ-CB 4.5Å; F347-V356 HydrophobicContact CZ-CG2 3.94Å; M352-V356 PolarHBondContact O-N 3.04Å; M352-V356 VanDerWaalsContact O-N 3.08Å; V356-K358 VanDerWaalsContact C-N 3.27Å; V356-K358 PolarHBondContact O-N 2.87Å; V356-D359 PolarHBondContact O-N 3.1Å; V356-D359 VanDerWaalsContact O-N 3.16Å; V356-Y360 HydrophobicContact CG1-CD2 3.92Å; V356-Y360 HydrophobicContact CG1-CE2 3.95Å; V356-Y360 WeakPolarHBondContact O-CD2 3.27Å; V356-Y360 PolarHBondContact O-N 3.33Å; V356-Y360 VanDerWaalsContact O-N 3.15Å
357	R	89.9	Confident	85.5	Confident	83 Å²	83	73 Å²	73	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-57.6	-39	178.4	-172	-171.5	71.6	149.9	2.4	112.9	L222 A353 K354 R355 D359 K361 M387 Y715	L222-R357 HydrophobicContact CD2-CB 4.39Å; A353-R357 WeakPolarHBondContact O-CB 3.19Å; A353-R357 PolarHBondContact O-N 3.34Å; K354-R357 PolarHBondContact O-N 3.46Å; R355-R357 PolarHBondContact O-N 3.22Å; R357-D359 VanDerWaalsContact C-N 3.33Å; R357-K361 PolarHBondContact O-N 3.21Å; R357-M387 HydrophobicContact CB-CE 4.3Å; R357-Y715 VanDerWaalsContact NH2-CE1 3.33Å
358	K	87.9	Confident	85.2	Confident	145 Å²	145	79.4 Å²	79.4	63%	0.63	39%	0.387	S	S	*	.	H	α-helix	trans	-64.9	-39.2	-179.6	-173.3	174.6	179.3	173.4	0	111.3	K354 R355 V356 K361	K354-K358 WeakPolarHBondContact O-CB 3.23Å; K354-K358 PolarHBondContact O-N 3.01Å; R355-K358 PolarHBondContact O-N 3.03Å; V356-K358 VanDerWaalsContact C-N 3.27Å; V356-K358 PolarHBondContact O-N 2.87Å; K358-K361 VanDerWaalsContact O-CB 3.23Å; K358-K361 WeakPolarHBondContact O-CB 3.45Å; K358-K361 PolarHBondContact O-N 3.47Å
359	D	89.5	Confident	85.3	Confident	41 Å²	41	74.8 Å²	74.8	22%	0.219	37%	0.366	C	S	.	.	H	α-helix	trans	-66.1	-46	178	-165.2	42.7	0	0	0	111.7	Y245 R355 V356 R357 K361 P369 Q370	Y245-D359 HydrophobicContact CE1-CB 4.07Å; Y245-D359 WeakPolarHBondContact CE1-OD2 3.37Å; Y245-D359 PolarHBondContact OH-OD2 3.36Å; R355-D359 PolarHBondContact O-N 3.26Å; V356-D359 PolarHBondContact O-N 3.1Å; V356-D359 VanDerWaalsContact O-N 3.16Å; R357-D359 VanDerWaalsContact C-N 3.33Å; D359-K361 PolarHBondContact O-N 3.38Å; D359-P369 WeakPolarHBondContact OD2-CA 3.21Å; D359-P369 WeakPolarHBondContact OD2-CB 3.27Å; D359-Q370 WeakPolarHBondContact OD2-CG 3.42Å; D359-Q370 PolarHBondContact OD2-N 3.15Å
360	Y	89.3	Confident	85.5	Confident	10 Å²	10	75.8 Å²	75.8	4%	0.039	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-73.2	-5	177.7	-77.6	-101.1	0	0	0	114.4	H240 Y245 V356 Y362 I363 P369 S380 W383 V385	H240-Y360 PolarHBondContact NE2-OH 3.14Å; Y245-Y360 HydrophobicContact CE2-CE2 4.2Å; Y245-Y360 WeakPolarHBondContact OH-CE2 3.46Å; V356-Y360 HydrophobicContact CG1-CD2 3.92Å; V356-Y360 HydrophobicContact CG1-CE2 3.95Å; V356-Y360 WeakPolarHBondContact O-CD2 3.27Å; V356-Y360 PolarHBondContact O-N 3.33Å; V356-Y360 VanDerWaalsContact O-N 3.15Å; Y360-Y362 VanDerWaalsContact C-N 3.33Å; Y360-Y362 PolarHBondContact O-N 2.83Å; Y360-I363 HydrophobicContact CD1-CD1 3.15Å; Y360-I363 HydrophobicContact CE1-CD1 3.77Å; Y360-I363 HydrophobicContact CG-CD1 3.87Å; Y360-P369 HydrophobicContact CD1-CB 4.45Å; Y360-P369 HydrophobicContact CD1-CG 4.49Å; Y360-P369 HydrophobicContact CD2-CB 4.26Å; Y360-P369 HydrophobicContact CE1-CB 4.17Å; Y360-P369 HydrophobicContact CE1-CG 3.99Å; Y360-P369 HydrophobicContact CE2-CB 4.08Å; Y360-P369 HydrophobicContact CG-CB 4.44Å; Y360-S380 WeakPolarHBondContact CE1-O 3.17Å; Y360-S380 WeakPolarHBondContact OH-CB 3.33Å; Y360-S380 PolarHBondContact OH-OG 2.83Å; Y360-W383 HydrophobicContact CD1-CB 4.26Å; Y360-W383 HydrophobicContact CE1-CB 3.95Å; Y360-W383 AromaticContact CE1-CE3 3.94Å; Y360-W383 HydrophobicContact CE1-CE3 3.94Å; Y360-W383 AromaticContact CZ-CE3 3.97Å; Y360-V385 HydrophobicContact CD1-CB 4.41Å; Y360-V385 HydrophobicContact CD1-CG2 3.44Å; Y360-V385 VanDerWaalsContact CD1-CG2 3.44Å; Y360-V385 HydrophobicContact CD2-CG2 4Å; Y360-V385 HydrophobicContact CE1-CG2 4.05Å; Y360-V385 HydrophobicContact CE2-CG2 4.45Å; Y360-V385 HydrophobicContact CG-CB 4.08Å; Y360-V385 HydrophobicContact CG-CG2 3.47Å; Y360-V385 VanDerWaalsContact CG-CG2 3.47Å
361	K	85.4	Confident	85.9	Confident	132 Å²	132	79 Å²	79	57%	0.574	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-62.5	-36.8	-174.8	-173	-179.3	176.1	-164.8	0	112.8	R357 K358 D359	R357-K361 PolarHBondContact O-N 3.21Å; K358-K361 VanDerWaalsContact O-CB 3.23Å; K358-K361 WeakPolarHBondContact O-CB 3.45Å; K358-K361 PolarHBondContact O-N 3.47Å; D359-K361 PolarHBondContact O-N 3.38Å
362	Y	83.3	Confident	86.3	Confident	113 Å²	113	72.2 Å²	72.2	44%	0.443	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-107.4	17.7	-171.1	-57.5	-68.4	0	0	0	114.1	Y360 H364 C365 V367	Y360-Y362 VanDerWaalsContact C-N 3.33Å; Y360-Y362 PolarHBondContact O-N 2.83Å; Y362-H364 PolarHBondContact O-N 2.81Å; Y362-C365 WeakPolarHBondContact O-CA 3.48Å; Y362-C365 WeakPolarHBondContact O-CB 3.47Å; Y362-C365 PolarHBondContact O-N 2.86Å; Y362-V367 PolarHBondContact O-N 3.35Å
363	I	84	Confident	86.4	Confident	26 Å²	26	74.8 Å²	74.8	13%	0.133	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-55.2	-39.2	175.1	-87.4	170.8	0	0	0	112.6	Y360 C365 G366 V367 P369 Y381	Y360-I363 HydrophobicContact CD1-CD1 3.15Å; Y360-I363 HydrophobicContact CE1-CD1 3.77Å; Y360-I363 HydrophobicContact CG-CD1 3.87Å; I363-C365 PolarHBondContact O-N 2.95Å; I363-G366 PolarHBondContact O-N 3.23Å; I363-V367 WeakPolarHBondContact CA-O 3.4Å; I363-P369 HydrophobicContact CD1-CB 4.42Å; I363-P369 HydrophobicContact CD1-CG 3.96Å; I363-P369 HydrophobicContact CG1-CG 4.36Å; I363-Y381 WeakPolarHBondContact CG2-O 3.34Å
364	H	75.5	Confident	86.6	Confident	137 Å²	137	75.3 Å²	75.3	63%	0.634	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-69.2	-16.6	178.9	-62.9	72.6	0	0	0	112.3	Y362 G366 R384	Y362-H364 PolarHBondContact O-N 2.81Å; H364-G366 VanDerWaalsContact C-N 3.33Å; H364-R384 PolarHBondContact NE2-NH2 3.4Å
365	C	79.6	Confident	86.7	Confident	99 Å²	99	73.6 Å²	73.6	67%	0.669	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-91.8	8.9	174.7	-54.9	0	0	0	0	112.5	Y362 I363 V367	Y362-C365 WeakPolarHBondContact O-CA 3.48Å; Y362-C365 WeakPolarHBondContact O-CB 3.47Å; Y362-C365 PolarHBondContact O-N 2.86Å; I363-C365 PolarHBondContact O-N 2.95Å; C365-V367 VanDerWaalsContact C-N 3.33Å; C365-V367 PolarHBondContact O-N 3.45Å
366	G	77.9	Confident	86.7	Confident	64 Å²	64	72 Å²	72	66%	0.66	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	4.8	-179.6	0	0	0	0	0	114.9	I363 H364 Q368	I363-G366 PolarHBondContact O-N 3.23Å; H364-G366 VanDerWaalsContact C-N 3.33Å; G366-Q368 PolarHBondContact O-N 2.96Å
367	V	83.4	Confident	86.7	Confident	77 Å²	77	76.6 Å²	76.6	47%	0.467	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-77.3	119.4	174.3	-176.8	0	0	0	0	108.8	Y362 I363 C365	Y362-V367 PolarHBondContact O-N 3.35Å; I363-V367 WeakPolarHBondContact CA-O 3.4Å; C365-V367 VanDerWaalsContact C-N 3.33Å; C365-V367 PolarHBondContact O-N 3.45Å
368	Q	83.6	Confident	86.7	Confident	134 Å²	134	72.7 Å²	72.7	63%	0.626	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-78.7	134.4	177.7	-65.9	-171.5	-10.6	0	0	110.6	G366	G366-Q368 PolarHBondContact O-N 2.96Å
369	P	88.4	Confident	86.8	Confident	8 Å²	8	70.1 Å²	70.1	5%	0.052	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-72	171.5	175.2	33.7	-36.7	0	0	0	110.7	D359 Y360 I363 Q371	D359-P369 WeakPolarHBondContact OD2-CA 3.21Å; D359-P369 WeakPolarHBondContact OD2-CB 3.27Å; Y360-P369 HydrophobicContact CD1-CB 4.45Å; Y360-P369 HydrophobicContact CD1-CG 4.49Å; Y360-P369 HydrophobicContact CD2-CB 4.26Å; Y360-P369 HydrophobicContact CE1-CB 4.17Å; Y360-P369 HydrophobicContact CE1-CG 3.99Å; Y360-P369 HydrophobicContact CE2-CB 4.08Å; Y360-P369 HydrophobicContact CG-CB 4.44Å; I363-P369 HydrophobicContact CD1-CB 4.42Å; I363-P369 HydrophobicContact CD1-CG 3.96Å; I363-P369 HydrophobicContact CG1-CG 4.36Å; P369-Q371 PolarHBondContact O-N 3.21Å
370	Q	88.9	Confident	86.8	Confident	105 Å²	105	68.1 Å²	68.1	49%	0.491	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-52.3	135.3	172.2	-65.8	-62.8	-30.2	0	0	111.3	A244 Y245 D359	A244-Q370 HydrophobicContact CB-CB 3.95Å; A244-Q370 VanDerWaalsContact O-CB 3.29Å; A244-Q370 WeakPolarHBondContact O-CB 3.48Å; Y245-Q370 HydrophobicContact CD1-CB 4.5Å; Y245-Q370 HydrophobicContact CD1-CG 4.3Å; Y245-Q370 HydrophobicContact CE1-CB 3.92Å; Y245-Q370 HydrophobicContact CE1-CG 3.77Å; D359-Q370 WeakPolarHBondContact OD2-CG 3.42Å; D359-Q370 PolarHBondContact OD2-N 3.15Å
371	Q	89.7	Confident	86.7	Confident	115 Å²	115	72.2 Å²	72.2	54%	0.537	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-102.5	162.6	-175.8	-59.1	-170	-3.3	0	0	111.4	P369 T375	P369-Q371 PolarHBondContact O-N 3.21Å; Q371-T375 WeakPolarHBondContact CA-OG1 3.24Å; Q371-T375 HydrophobicContact CB-CG2 4.48Å; Q371-T375 HydrophobicContact CG-CG2 4.32Å
372	S	92.5	Very high	86.8	Confident	21 Å²	21	73.1 Å²	73.1	15%	0.147	38%	0.382	C	S	.	.			trans	-142.7	168.9	-179.4	65.6	0	0	0	0	108.6	H240 E243 V374 T375	H240-S372 PolarHBondContact ND1-OG 2.99Å; E243-S372 WeakPolarHBondContact OE2-CB 3.1Å; S372-V374 PolarHBondContact O-N 3.41Å; S372-V374 VanDerWaalsContact O-N 3.11Å; S372-V374 WeakPolarHBondContact OG-CG2 3.32Å; S372-V374 PolarHBondContact OG-N 3.27Å; S372-T375 PolarHBondContact N-OG1 3.39Å; S372-T375 WeakPolarHBondContact O-CB 3.16Å; S372-T375 PolarHBondContact O-N 2.97Å; S372-T375 VanDerWaalsContact O-N 3.14Å; S372-T375 PolarHBondContact O-OG1 2.88Å; S372-T375 PolarHBondContact OG-N 3.46Å; S372-T375 PolarHBondContact OG-OG1 3.29Å
373	S	91.9	Very high	87.2	Confident	75 Å²	75	67.8 Å²	67.8	52%	0.524	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-25.3	174.5	65.9	0	0	0	0	113.3	K239 E243	K239-S373 WeakPolarHBondContact CE-OG 3.33Å; E243-S373 VanDerWaalsContact CD-OG 3.22Å; E243-S373 PolarHBondContact OE1-OG 3.46Å; E243-S373 VanDerWaalsContact OE1-OG 3.05Å; E243-S373 WeakPolarHBondContact OE2-CB 3.37Å; E243-S373 PolarHBondContact OE2-N 2.74Å; E243-S373 PolarHBondContact OE2-OG 2.73Å
374	V	91.4	Very high	87.5	Confident	10 Å²	10	70 Å²	70	6%	0.061	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	3.5	-177.6	-63.3	0	0	0	0	113.8	I236 K239 H240 S372 T376 I377 V378	I236-V374 HydrophobicContact CG2-CB 4.21Å; I236-V374 HydrophobicContact CG2-CG1 4.31Å; K239-V374 HydrophobicContact CD-CG1 3.96Å; K239-V374 HydrophobicContact CG-CG1 4.46Å; H240-V374 HydrophobicContact CB-CG2 3.62Å; S372-V374 PolarHBondContact O-N 3.41Å; S372-V374 VanDerWaalsContact O-N 3.11Å; S372-V374 WeakPolarHBondContact OG-CG2 3.32Å; S372-V374 PolarHBondContact OG-N 3.27Å; V374-T376 VanDerWaalsContact C-N 3.27Å; V374-T376 PolarHBondContact O-N 3.41Å; V374-I377 HydrophobicContact CG1-CD1 4.47Å; V374-I377 WeakPolarHBondContact O-CB 3.41Å; V374-I377 PolarHBondContact O-N 3.01Å; V374-V378 HydrophobicContact CB-CG1 4.41Å; V374-V378 HydrophobicContact CG2-CG1 4.27Å; V374-V378 WeakPolarHBondContact O-CG2 3.29Å; V374-V378 PolarHBondContact O-N 2.64Å
375	T	90	Very high	88.2	Confident	11 Å²	11	64.2 Å²	64.2	7%	0.067	34%	0.342	C	S	.	.	H	α-helix	trans	-57.8	-36.3	-173	-70.4	0	0	0	0	113.6	Q371 S372 K379 S380	Q371-T375 WeakPolarHBondContact CA-OG1 3.24Å; Q371-T375 HydrophobicContact CB-CG2 4.48Å; Q371-T375 HydrophobicContact CG-CG2 4.32Å; S372-T375 PolarHBondContact N-OG1 3.39Å; S372-T375 WeakPolarHBondContact O-CB 3.16Å; S372-T375 PolarHBondContact O-N 2.97Å; S372-T375 VanDerWaalsContact O-N 3.14Å; S372-T375 PolarHBondContact O-OG1 2.88Å; S372-T375 PolarHBondContact OG-N 3.46Å; S372-T375 PolarHBondContact OG-OG1 3.29Å; T375-K379 WeakPolarHBondContact O-CA 3.26Å; T375-K379 PolarHBondContact O-N 2.93Å; T375-S380 PolarHBondContact O-N 3.41Å
376	T	87.9	Confident	88.7	Confident	107 Å²	107	62.4 Å²	62.4	66%	0.656	33%	0.328	S	S	*	.	H	α-helix	trans	-69.4	-33	177.5	50.6	0	0	0	0	112.6	V374 K379	V374-T376 VanDerWaalsContact C-N 3.27Å; V374-T376 PolarHBondContact O-N 3.41Å; T376-K379 WeakPolarHBondContact O-CG 3.13Å
377	I	90.3	Very high	89.1	Confident	96 Å²	96	60.9 Å²	60.9	49%	0.492	30%	0.304	S	S	.	.	H	α-helix	trans	-74	-51.4	177.8	-58	171	0	0	0	109.7	V374 K379	V374-I377 HydrophobicContact CG1-CD1 4.47Å; V374-I377 WeakPolarHBondContact O-CB 3.41Å; V374-I377 PolarHBondContact O-N 3.01Å; I377-K379 PolarHBondContact O-N 3.35Å
378	V	90	Very high	89.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-74.8	-14.9	-178	-55.6	0	0	0	0	113.3	P228 I231 I236 H240 V374 S380 W383	P228-V378 WeakPolarHBondContact CD-O 3.48Å; I231-V378 HydrophobicContact CD1-CB 4.24Å; I231-V378 HydrophobicContact CD1-CG1 4.21Å; I236-V378 HydrophobicContact CG2-CG1 3.61Å; H240-V378 HydrophobicContact CB-CG2 4.41Å; V374-V378 HydrophobicContact CB-CG1 4.41Å; V374-V378 HydrophobicContact CG2-CG1 4.27Å; V374-V378 WeakPolarHBondContact O-CG2 3.29Å; V374-V378 PolarHBondContact O-N 2.64Å; V378-S380 VanDerWaalsContact C-N 3.29Å; V378-S380 PolarHBondContact O-N 2.82Å; V378-W383 HydrophobicContact CB-CH2 4.11Å; V378-W383 HydrophobicContact CB-CZ2 3.64Å; V378-W383 HydrophobicContact CG2-CH2 4.02Å; V378-W383 HydrophobicContact CG2-CZ2 3.89Å; V378-W383 PolarHBondContact O-NE1 3.34Å
379	K	90.6	Very high	89.3	Confident	91 Å²	91	52.4 Å²	52.4	40%	0.396	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	46.3	-177.4	-58.9	-178.1	-177.7	170.3	0	112.3	P228 T375 T376 I377 Y381 Y382	P228-K379 HydrophobicContact CG-CB 4.04Å; P228-K379 HydrophobicContact CG-CD 4.03Å; P228-K379 HydrophobicContact CG-CG 4.13Å; T375-K379 WeakPolarHBondContact O-CA 3.26Å; T375-K379 PolarHBondContact O-N 2.93Å; T376-K379 WeakPolarHBondContact O-CG 3.13Å; I377-K379 PolarHBondContact O-N 3.35Å; K379-Y381 HydrophobicContact CB-CE1 4.13Å; K379-Y381 HydrophobicContact CG-CE1 4.47Å; K379-Y381 PolarHBondContact O-N 3.48Å; K379-Y382 HydrophobicContact CB-CD2 4.19Å; K379-Y382 PolarHBondContact O-N 3.45Å
380	S	88.5	Confident	88.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.3	-25	-170.7	124.4	0	0	0	0	113.3	Y360 T375 V378 Y382 W383	Y360-S380 WeakPolarHBondContact CE1-O 3.17Å; Y360-S380 WeakPolarHBondContact OH-CB 3.33Å; Y360-S380 PolarHBondContact OH-OG 2.83Å; T375-S380 PolarHBondContact O-N 3.41Å; V378-S380 VanDerWaalsContact C-N 3.29Å; V378-S380 PolarHBondContact O-N 2.82Å; S380-Y382 PolarHBondContact O-N 2.86Å; S380-W383 VanDerWaalsContact O-CB 3.27Å; S380-W383 WeakPolarHBondContact O-CB 3.39Å; S380-W383 PolarHBondContact O-N 3.46Å
381	Y	87.3	Confident	88.6	Confident	96 Å²	96	51.8 Å²	51.8	38%	0.376	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-64.3	-17.2	175.2	54.3	-87	0	0	0	114.8	I363 K379	I363-Y381 WeakPolarHBondContact CG2-O 3.34Å; K379-Y381 HydrophobicContact CB-CE1 4.13Å; K379-Y381 HydrophobicContact CG-CE1 4.47Å; K379-Y381 PolarHBondContact O-N 3.48Å
382	Y	88.4	Confident	88.1	Confident	150 Å²	150	54 Å²	54	59%	0.588	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-94.2	-6.8	171.5	-70.6	-58.6	0	0	0	113.6	K379 S380	K379-Y382 HydrophobicContact CB-CD2 4.19Å; K379-Y382 PolarHBondContact O-N 3.45Å; S380-Y382 PolarHBondContact O-N 2.86Å
383	W	91.4	Very high	87.7	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.008	27%	0.265	C	S	.	.			trans	-69	144.1	-175.5	-67.5	-2.4	0	0	0	111.6	I224 T225 V227 I237 H240 F241 Y360 V378 S380 V385	I224-W383 HydrophobicContact CD1-CE3 4.44Å; I224-W383 HydrophobicContact CD1-CZ3 4.49Å; I224-W383 HydrophobicContact CG2-CB 3.89Å; I224-W383 HydrophobicContact CG2-CD2 3.85Å; I224-W383 HydrophobicContact CG2-CE3 3.97Å; I224-W383 HydrophobicContact CG2-CG 3.87Å; T225-W383 WeakPolarHBondContact O-CA 3.09Å; V227-W383 HydrophobicContact CG1-CZ2 4.47Å; V227-W383 HydrophobicContact CG2-CZ2 4.39Å; I237-W383 HydrophobicContact CG2-CH2 4.46Å; H240-W383 AromaticContact CD2-CH2 3.8Å; H240-W383 AromaticContact CD2-CZ3 3.55Å; H240-W383 AromaticContact NE2-CZ3 3.83Å; F241-W383 HydrophobicContact CE1-CZ3 4.49Å; F241-W383 HydrophobicContact CE2-CZ3 4.16Å; F241-W383 AromaticContact CZ-CZ3 3.74Å; F241-W383 HydrophobicContact CZ-CZ3 3.74Å; Y360-W383 HydrophobicContact CD1-CB 4.26Å; Y360-W383 HydrophobicContact CE1-CB 3.95Å; Y360-W383 AromaticContact CE1-CE3 3.94Å; Y360-W383 HydrophobicContact CE1-CE3 3.94Å; Y360-W383 AromaticContact CZ-CE3 3.97Å; V378-W383 HydrophobicContact CB-CH2 4.11Å; V378-W383 HydrophobicContact CB-CZ2 3.64Å; V378-W383 HydrophobicContact CG2-CH2 4.02Å; V378-W383 HydrophobicContact CG2-CZ2 3.89Å; V378-W383 PolarHBondContact O-NE1 3.34Å; S380-W383 VanDerWaalsContact O-CB 3.27Å; S380-W383 WeakPolarHBondContact O-CB 3.39Å; S380-W383 PolarHBondContact O-N 3.46Å; W383-V385 HydrophobicContact CB-CG2 4.47Å
384	R	90.1	Very high	87.4	Confident	72 Å²	72	50.4 Å²	50.4	27%	0.272	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119	165.7	165.9	-173.5	-61.8	-146.6	-9.8	108.7	I224 T225 Y226 H364 R403	I224-R384 WeakPolarHBondContact CA-O 3.11Å; T225-R384 PolarHBondContact N-O 2.89Å; T225-R384 PolarHBondContact O-N 2.92Å; T225-R384 VanDerWaalsContact O-N 3.1Å; T225-R384 VanDerWaalsContact OG1-CB 3.3Å; T225-R384 WeakPolarHBondContact OG1-CB 3.35Å; T225-R384 PolarHBondContact OG1-O 3.32Å; Y226-R384 HydrophobicContact CD2-CB 3.97Å; Y226-R384 HydrophobicContact CE2-CB 4Å; H364-R384 PolarHBondContact NE2-NH2 3.4Å; R384-R403 VanDerWaalsContact NH1-NH1 3.16Å; R384-R403 VanDerWaalsContact NH2-NH1 3.12Å
385	V	91.4	Very high	87.3	Confident	16 Å²	16	51.1 Å²	51.1	10%	0.097	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.3	-175.1	-178.8	0	0	0	0	109.6	L222 I224 Y360 W383	L222-V385 HydrophobicContact CB-CG1 4.24Å; L222-V385 HydrophobicContact CD1-CG1 3.7Å; L222-V385 HydrophobicContact CD2-CG1 4.28Å; L222-V385 HydrophobicContact CG-CG1 4.31Å; I224-V385 HydrophobicContact CD1-CG2 4.31Å; I224-V385 HydrophobicContact CG1-CG1 4.39Å; I224-V385 HydrophobicContact CG1-CG2 4.13Å; I224-V385 HydrophobicContact CG2-CG2 4.18Å; Y360-V385 HydrophobicContact CD1-CB 4.41Å; Y360-V385 HydrophobicContact CD1-CG2 3.44Å; Y360-V385 VanDerWaalsContact CD1-CG2 3.44Å; Y360-V385 HydrophobicContact CD2-CG2 4Å; Y360-V385 HydrophobicContact CE1-CG2 4.05Å; Y360-V385 HydrophobicContact CE2-CG2 4.45Å; Y360-V385 HydrophobicContact CG-CB 4.08Å; Y360-V385 HydrophobicContact CG-CG2 3.47Å; Y360-V385 VanDerWaalsContact CG-CG2 3.47Å; W383-V385 HydrophobicContact CB-CG2 4.47Å
386	T	89.1	Confident	87.3	Confident	60 Å²	60	52.7 Å²	52.7	37%	0.368	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	158.3	174.4	51.4	0	0	0	0	110.2	M223 A388	M223-T386 PolarHBondContact N-O 3.28Å; M223-T386 PolarHBondContact O-N 3.18Å; M223-T386 PolarHBondContact O-OG1 3.23Å; T386-A388 PolarHBondContact O-N 3.36Å
387	M	86.8	Confident	87.4	Confident	33 Å²	33	51.1 Å²	51.1	16%	0.163	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	139.5	169	-68.5	-58.8	-177.1	0	0	109.1	V218 L222 K354 R357	V218-M387 HydrophobicContact CG1-CE 3.87Å; V218-M387 HydrophobicContact CG1-SD 4.42Å; L222-M387 HydrophobicContact CD2-CE 4.3Å; L222-M387 HydrophobicContact CD2-SD 3.46Å; L222-M387 WeakPolarHBondContact CD2-SD 3.21Å; K354-M387 HydrophobicContact CB-CE 4.22Å; K354-M387 HydrophobicContact CG-CE 3.55Å; R357-M387 HydrophobicContact CB-CE 4.3Å
388	A	87	Confident	87.4	Confident	5 Å²	5	48.3 Å²	48.3	4%	0.041	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-68.2	132.2	176.7	0	0	0	0	0	109.9	T219 T221 M223 F344 T386 Y742	T219-A388 PolarHBondContact OG1-O 3.29Å; T221-A388 HydrophobicContact CG2-CB 3.87Å; T221-A388 VanDerWaalsContact O-CB 3.31Å; T221-A388 WeakPolarHBondContact O-CB 3.21Å; T221-A388 PolarHBondContact O-N 3.43Å; M223-A388 HydrophobicContact CB-CB 4.34Å; F344-A388 HydrophobicContact CD1-CB 3.95Å; F344-A388 HydrophobicContact CE1-CB 4.04Å; T386-A388 PolarHBondContact O-N 3.36Å; A388-Y742 HydrophobicContact CB-CE1 3.76Å
389	P	84.1	Confident	87.4	Confident	27 Å²	27	48.8 Å²	48.8	18%	0.175	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-66.3	162	171.1	31.2	-36.2	0	0	0	109.9	I394 T482 Y742	P389-I394 HydrophobicContact CG-CD1 4.06Å; P389-I394 HydrophobicContact CG-CG1 3.64Å; P389-T482 HydrophobicContact CB-CG2 4.04Å; P389-T482 HydrophobicContact CG-CG2 3.84Å; P389-Y742 VanDerWaalsContact O-CE1 3.26Å; P389-Y742 WeakPolarHBondContact O-CE1 3.23Å; P389-Y742 PolarHBondContact O-OH 3.32Å
390	H	80.6	Confident	87.3	Confident	80 Å²	80	45.3 Å²	45.3	37%	0.37	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-57.6	139	174.6	-174.7	-84.3	0	0	0	110.4	K392 D393	H390-K392 VanDerWaalsContact C-N 3.28Å; H390-K392 PolarHBondContact ND1-N 3.28Å; H390-K392 PolarHBondContact O-N 3.25Å; H390-K392 VanDerWaalsContact O-N 3.14Å; H390-D393 HydrophobicContact CB-CB 4.45Å; H390-D393 WeakPolarHBondContact O-CA 3.44Å; H390-D393 VanDerWaalsContact O-CB 3.24Å; H390-D393 WeakPolarHBondContact O-CB 3.31Å; H390-D393 PolarHBondContact O-N 2.94Å
391	P	81.5	Confident	87.2	Confident	20 Å²	20	45.7 Å²	45.7	13%	0.13	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-53.9	-38.7	-175.4	-24.5	26.3	0	0	0	114.9	D393 I394 L741 Y742	P391-D393 PolarHBondContact O-N 3.33Å; P391-I394 PolarHBondContact O-N 3.36Å; P391-L741 WeakPolarHBondContact CB-O 3.34Å; P391-L741 HydrophobicContact CG-CD2 3.5Å; P391-L741 VanDerWaalsContact CG-CD2 3.5Å; P391-L741 HydrophobicContact CG-CG 3.6Å; P391-L741 WeakPolarHBondContact CG-O 3.48Å; P391-Y742 HydrophobicContact CG-CD1 4.28Å; P391-Y742 HydrophobicContact CG-CE1 3.93Å; P391-Y742 HydrophobicContact CG-CE2 4.42Å
392	K	78.9	Confident	87.1	Confident	163 Å²	163	48.3 Å²	48.3	71%	0.709	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-66.9	-19.4	175.4	-64.4	-173.1	177.1	-170.7	0	114.2	H390	H390-K392 VanDerWaalsContact C-N 3.28Å; H390-K392 PolarHBondContact ND1-N 3.28Å; H390-K392 PolarHBondContact O-N 3.25Å; H390-K392 VanDerWaalsContact O-N 3.14Å
393	D	83.5	Confident	86.9	Confident	12 Å²	12	46.2 Å²	46.2	6%	0.064	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-83	-19	176.3	-171.4	26.4	0	0	0	111.9	H390 P391 T482 R483 S484	H390-D393 HydrophobicContact CB-CB 4.45Å; H390-D393 WeakPolarHBondContact O-CA 3.44Å; H390-D393 VanDerWaalsContact O-CB 3.24Å; H390-D393 WeakPolarHBondContact O-CB 3.31Å; H390-D393 PolarHBondContact O-N 2.94Å; P391-D393 PolarHBondContact O-N 3.33Å; D393-T482 CarbonylContact O-C 3.21Å; D393-T482 VanDerWaalsContact O-CA 3.23Å; D393-T482 WeakPolarHBondContact O-CA 3.33Å; D393-R483 PolarHBondContact O-N 3.39Å; D393-R483 WeakPolarHBondContact OD1-CA 3.46Å; D393-R483 VanDerWaalsContact OD1-CB 3.32Å; D393-R483 WeakPolarHBondContact OD1-CB 3.42Å; D393-R483 PolarHBondContact OD1-N 3.24Å; D393-S484 PolarHBondContact OD1-N 3.39Å; D393-S484 PolarHBondContact OD1-OG 3.47Å; D393-S484 VanDerWaalsContact OD2-CB 3.29Å; D393-S484 WeakPolarHBondContact OD2-CB 3.27Å; D393-S484 PolarHBondContact OD2-OG 3.39Å
394	I	87.4	Confident	86.7	Confident	8 Å²	8	53.8 Å²	53.8	4%	0.041	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-75.4	127.4	-179.9	-58.7	172.1	0	0	0	110	F344 P389 P391 W396 L399 Y742	F344-I394 HydrophobicContact CE1-CD1 4.2Å; F344-I394 HydrophobicContact CE2-CD1 4.41Å; F344-I394 HydrophobicContact CZ-CD1 3.69Å; P389-I394 HydrophobicContact CG-CD1 4.06Å; P389-I394 HydrophobicContact CG-CG1 3.64Å; P391-I394 PolarHBondContact O-N 3.36Å; I394-W396 HydrophobicContact CD1-CH2 4.44Å; I394-W396 HydrophobicContact CD1-CZ2 4.26Å; I394-W396 HydrophobicContact CG2-CD2 3.97Å; I394-W396 HydrophobicContact CG2-CE3 4.27Å; I394-W396 HydrophobicContact CG2-CG 4.34Å; I394-W396 HydrophobicContact CG2-CZ2 4.34Å; I394-W396 PolarHBondContact O-N 3.42Å; I394-L399 HydrophobicContact CG2-CD1 4.47Å; I394-Y742 HydrophobicContact CD1-CD1 3.9Å; I394-Y742 HydrophobicContact CD1-CE1 4.03Å
395	I	89.2	Confident	86.7	Confident	25 Å²	25	56 Å²	56	13%	0.128	26%	0.255	C	S	.	.			trans	-94.7	88.4	171.7	-53.9	166.8	0	0	0	108.2	K397 H398 L399 W481 R483	I395-K397 HydrophobicContact CG2-CB 4.42Å; I395-K397 PolarHBondContact O-N 2.97Å; I395-K397 VanDerWaalsContact O-N 3.11Å; I395-H398 HydrophobicContact CB-CB 4.41Å; I395-H398 HydrophobicContact CG2-CB 4.15Å; I395-H398 WeakPolarHBondContact CG2-ND1 3.3Å; I395-H398 PolarHBondContact O-N 2.96Å; I395-L399 PolarHBondContact O-N 3Å; I395-W481 PolarHBondContact N-O 3.28Å; I395-R483 HydrophobicContact CD1-CB 4.5Å; I395-R483 HydrophobicContact CD1-CG 3.84Å; I395-R483 HydrophobicContact CG1-CG 3.61Å
396	W	89.2	Confident	86.7	Confident	43 Å²	43	57.6 Å²	57.6	16%	0.163	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-52.8	-35.8	-176.7	-63.3	100.9	0	0	0	113.5	V259 I263 F344 I394 H398 L399 A744	V259-W396 HydrophobicContact CG2-CB 4.41Å; I263-W396 HydrophobicContact CD1-CB 3.86Å; F344-W396 HydrophobicContact CE2-CH2 4.15Å; F344-W396 HydrophobicContact CE2-CZ3 4.3Å; I394-W396 HydrophobicContact CD1-CH2 4.44Å; I394-W396 HydrophobicContact CD1-CZ2 4.26Å; I394-W396 HydrophobicContact CG2-CD2 3.97Å; I394-W396 HydrophobicContact CG2-CE3 4.27Å; I394-W396 HydrophobicContact CG2-CG 4.34Å; I394-W396 HydrophobicContact CG2-CZ2 4.34Å; I394-W396 PolarHBondContact O-N 3.42Å; W396-H398 PolarHBondContact O-N 3.36Å; W396-L399 HydrophobicContact CE3-CD2 3.9Å; W396-L399 HydrophobicContact CZ3-CD2 3.99Å; W396-L399 WeakPolarHBondContact O-CB 3.41Å; W396-L399 PolarHBondContact O-N 3.04Å; W396-A744 HydrophobicContact CB-CB 4.47Å; W396-A744 HydrophobicContact CD2-CB 3.91Å; W396-A744 HydrophobicContact CE3-CB 3.94Å; W396-A744 HydrophobicContact CG-CB 4.14Å
397	K	89.2	Confident	86.8	Confident	74 Å²	74	60.4 Å²	60.4	32%	0.322	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-60.6	-28.4	177.3	-166.5	171.2	-178	155.7	0	114	R260 D264 I395	R260-K397 HydrophobicContact CB-CG 4.44Å; R260-K397 HydrophobicContact CG-CG 3.91Å; R260-K397 PolarHBondContact NE-O 3.39Å; R260-K397 PolarHBondContact NH2-O 2.93Å; D264-K397 WeakPolarHBondContact OD1-CE 3.38Å; D264-K397 IonicContact OD1-NZ 2.7Å; D264-K397 PolarHBondContact OD1-NZ 3.19Å; D264-K397 WeakPolarHBondContact OD2-CE 3.42Å; D264-K397 IonicContact OD2-NZ 2.73Å; D264-K397 PolarHBondContact OD2-NZ 3.26Å; I395-K397 HydrophobicContact CG2-CB 4.42Å; I395-K397 PolarHBondContact O-N 2.97Å; I395-K397 VanDerWaalsContact O-N 3.11Å
398	H	91.1	Very high	87.1	Confident	38 Å²	38	61 Å²	61	18%	0.176	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-98.9	-11	-176.5	-61.4	168.1	0	0	0	113.1	I395 W396 S400 V401 H480 W481	I395-H398 HydrophobicContact CB-CB 4.41Å; I395-H398 HydrophobicContact CG2-CB 4.15Å; I395-H398 WeakPolarHBondContact CG2-ND1 3.3Å; I395-H398 PolarHBondContact O-N 2.96Å; W396-H398 PolarHBondContact O-N 3.36Å; H398-S400 PolarHBondContact O-N 2.81Å; H398-S400 VanDerWaalsContact O-N 3.13Å; H398-V401 WeakPolarHBondContact O-CB 3.08Å; H398-V401 WeakPolarHBondContact O-CG2 3.25Å; H398-V401 PolarHBondContact O-N 2.88Å; H398-H480 VanDerWaalsContact CB-O 3.26Å; H398-H480 WeakPolarHBondContact CB-O 3Å; H398-H480 PolarHBondContact ND1-O 3Å; H398-W481 VanDerWaalsContact O-CD1 3.26Å; H398-W481 PolarHBondContact O-NE1 3.12Å
399	L	89.7	Confident	87.4	Confident	9 Å²	9	66.2 Å²	66.2	5%	0.047	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.6	-174.3	-158.4	65	0	0	0	113.1	M223 C256 L340 L342 I394 I395 W396 V401 W481	M223-L399 HydrophobicContact CE-CD1 4.36Å; C256-L399 HydrophobicContact CB-CD2 4.21Å; L340-L399 HydrophobicContact CD1-CB 4.43Å; L340-L399 HydrophobicContact CD1-CD2 4.43Å; L340-L399 HydrophobicContact CD1-CG 4.24Å; L342-L399 HydrophobicContact CD2-CD1 3.49Å; L342-L399 VanDerWaalsContact CD2-CD1 3.49Å; L342-L399 HydrophobicContact CD2-CD2 3.57Å; L342-L399 HydrophobicContact CD2-CG 3.5Å; I394-L399 HydrophobicContact CG2-CD1 4.47Å; I395-L399 PolarHBondContact O-N 3Å; W396-L399 HydrophobicContact CE3-CD2 3.9Å; W396-L399 HydrophobicContact CZ3-CD2 3.99Å; W396-L399 WeakPolarHBondContact O-CB 3.41Å; W396-L399 PolarHBondContact O-N 3.04Å; L399-V401 VanDerWaalsContact C-N 3.3Å; L399-V401 PolarHBondContact O-N 3.23Å; L399-W481 HydrophobicContact CD1-CB 4.45Å; L399-W481 HydrophobicContact CD1-CD2 4.45Å; L399-W481 HydrophobicContact CD1-CG 4.29Å
400	S	88.4	Confident	87.8	Confident	18 Å²	18	67.3 Å²	67.3	13%	0.126	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-10.7	176.8	60.6	0	0	0	0	114.8	D258 R260 H398 R402	D258-S400 WeakPolarHBondContact OD1-CB 3.1Å; D258-S400 PolarHBondContact OD1-OG 3.33Å; R260-S400 PolarHBondContact NH2-OG 2.86Å; H398-S400 PolarHBondContact O-N 2.81Å; H398-S400 VanDerWaalsContact O-N 3.13Å; S400-R402 PolarHBondContact O-N 3Å; S400-R402 VanDerWaalsContact O-N 3.16Å
401	V	87.8	Confident	88.3	Confident	9 Å²	9	67.8 Å²	67.8	6%	0.055	30%	0.299	C	S	.	.			trans	-70.6	113.2	177	-176	0	0	0	0	109	H398 L399 W406 A479 W481	H398-V401 WeakPolarHBondContact O-CB 3.08Å; H398-V401 WeakPolarHBondContact O-CG2 3.25Å; H398-V401 PolarHBondContact O-N 2.88Å; L399-V401 VanDerWaalsContact C-N 3.3Å; L399-V401 PolarHBondContact O-N 3.23Å; V401-W406 HydrophobicContact CG1-CB 4Å; V401-A479 HydrophobicContact CG2-CB 4.22Å; V401-W481 PolarHBondContact O-NE1 3.26Å
402	R	84.4	Confident	88.9	Confident	151 Å²	151	69.7 Å²	69.7	57%	0.57	32%	0.317	S	S	*	.			trans	-71.5	153.1	178.2	-53.3	-176	-177.4	-175.1	1.5	111.3	S400 F404 F405 W406	S400-R402 PolarHBondContact O-N 3Å; S400-R402 VanDerWaalsContact O-N 3.16Å; R402-F404 PolarHBondContact O-N 3.33Å; R402-F405 HydrophobicContact CB-CD2 4.16Å; R402-F405 PolarHBondContact O-N 2.56Å; R402-W406 WeakPolarHBondContact O-CB 3.39Å; R402-W406 PolarHBondContact O-N 2.6Å
403	R	84.3	Confident	89.5	Confident	106 Å²	106	63.4 Å²	63.4	40%	0.4	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-39.4	-174.3	-162.9	171.2	-173.1	-152.8	-2.5	115	Y226 R384 W406 W407	Y226-R403 VanDerWaalsContact OH-CD 3.22Å; Y226-R403 WeakPolarHBondContact OH-CD 3.41Å; Y226-R403 PolarHBondContact OH-NH1 3.42Å; R384-R403 VanDerWaalsContact NH1-NH1 3.16Å; R384-R403 VanDerWaalsContact NH2-NH1 3.12Å; R403-W406 PolarHBondContact O-N 3.25Å; R403-W407 PolarHBondContact O-N 2.92Å
404	F	87.5	Confident	89.8	Confident	161 Å²	161	64.3 Å²	64.3	71%	0.706	30%	0.295	S	S	*	.	H	α-helix	trans	-64.7	-49.1	177.4	177.7	-97.8	0	0	0	111.6	R402 W406 W407 A408	R402-F404 PolarHBondContact O-N 3.33Å; F404-W406 VanDerWaalsContact C-N 3.29Å; F404-W406 PolarHBondContact O-N 2.98Å; F404-W407 PolarHBondContact O-N 3.31Å; F404-A408 PolarHBondContact O-N 2.92Å
405	F	88.9	Confident	89.9	Confident	117 Å²	117	67 Å²	67	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-64.4	-34.9	176.8	-70.4	-72.1	0	0	0	112.1	R402 R409	R402-F405 HydrophobicContact CB-CD2 4.16Å; R402-F405 PolarHBondContact O-N 2.56Å; F405-R409 WeakPolarHBondContact O-CB 3.18Å; F405-R409 VanDerWaalsContact O-CG 3.24Å; F405-R409 WeakPolarHBondContact O-CG 3.2Å; F405-R409 PolarHBondContact O-N 2.77Å
406	W	92.3	Very high	89.9	Confident	50 Å²	50	71.8 Å²	71.8	19%	0.189	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-48.9	171.8	179.3	85.7	0	0	0	111.7	V401 R402 R403 F404 A408 R409 F410 E478 H480	V401-W406 HydrophobicContact CG1-CB 4Å; R402-W406 WeakPolarHBondContact O-CB 3.39Å; R402-W406 PolarHBondContact O-N 2.6Å; R403-W406 PolarHBondContact O-N 3.25Å; F404-W406 VanDerWaalsContact C-N 3.29Å; F404-W406 PolarHBondContact O-N 2.98Å; W406-A408 PolarHBondContact O-N 2.82Å; W406-R409 PolarHBondContact O-N 2.87Å; W406-F410 HydrophobicContact CH2-CD2 4.4Å; W406-F410 HydrophobicContact CH2-CG 4.41Å; W406-F410 HydrophobicContact CZ2-CD2 4.31Å; W406-F410 WeakPolarHBondContact O-CB 3.22Å; W406-F410 PolarHBondContact O-N 2.86Å; W406-E478 PolarHBondContact NE1-O 3.3Å; W406-H480 AromaticContact CZ2-CE1 3.66Å; W406-H480 AromaticContact CZ2-ND1 3.92Å; W406-H480 AromaticContact NE1-ND1 3.96Å
407	W	92	Very high	89.7	Confident	119 Å²	119	69.9 Å²	69.9	45%	0.451	33%	0.325	S	S	.	.	H	α-helix	trans	-62.4	-41.8	177.2	-95.7	106.1	0	0	0	112.6	R403 F404 R409 F410 I411	R403-W407 PolarHBondContact O-N 2.92Å; F404-W407 PolarHBondContact O-N 3.31Å; W407-R409 PolarHBondContact O-N 3.17Å; W407-F410 HydrophobicContact CE3-CD1 4.1Å; W407-F410 HydrophobicContact CZ3-CD1 4Å; W407-F410 HydrophobicContact CZ3-CE1 4.25Å; W407-F410 PolarHBondContact O-N 2.93Å; W407-I411 HydrophobicContact CE3-CD1 3.97Å; W407-I411 HydrophobicContact CE3-CG1 4.06Å; W407-I411 HydrophobicContact CZ3-CG1 4.48Å; W407-I411 WeakPolarHBondContact O-CB 3.04Å; W407-I411 WeakPolarHBondContact O-CG1 3.46Å; W407-I411 PolarHBondContact O-N 2.92Å
408	A	92.8	Very high	89.3	Confident	47 Å²	47	71.5 Å²	71.5	39%	0.388	33%	0.333	S	S	.	.	H	α-helix	trans	-60.5	-45.4	176	0	0	0	0	0	111.4	F404 W406 A412	F404-A408 PolarHBondContact O-N 2.92Å; W406-A408 PolarHBondContact O-N 2.82Å; A408-A412 VanDerWaalsContact O-CB 3.24Å; A408-A412 WeakPolarHBondContact O-CB 3.26Å; A408-A412 PolarHBondContact O-N 2.94Å
409	R	92.7	Very high	88.8	Confident	114 Å²	114	74.6 Å²	74.6	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-61.7	-47.6	174.1	-73.6	173.1	-178.2	-173.4	-0.7	111.6	F405 W406 W407 I411 A412 I413	F405-R409 WeakPolarHBondContact O-CB 3.18Å; F405-R409 VanDerWaalsContact O-CG 3.24Å; F405-R409 WeakPolarHBondContact O-CG 3.2Å; F405-R409 PolarHBondContact O-N 2.77Å; W406-R409 PolarHBondContact O-N 2.87Å; W407-R409 PolarHBondContact O-N 3.17Å; R409-I411 PolarHBondContact O-N 3.16Å; R409-A412 PolarHBondContact O-N 2.81Å; R409-I413 HydrophobicContact CB-CD1 4.49Å; R409-I413 WeakPolarHBondContact O-CB 3.39Å; R409-I413 WeakPolarHBondContact O-CD1 3.41Å; R409-I413 WeakPolarHBondContact O-CG1 3.3Å; R409-I413 PolarHBondContact O-N 3.17Å
410	F	91.5	Very high	88.2	Confident	50 Å²	50	75.7 Å²	75.7	22%	0.219	35%	0.351	C	S	.	.	H	α-helix	trans	-58	-49.3	179.6	178.2	-94.5	0	0	0	111.5	W406 W407 N414 E478	W406-F410 HydrophobicContact CH2-CD2 4.4Å; W406-F410 HydrophobicContact CH2-CG 4.41Å; W406-F410 HydrophobicContact CZ2-CD2 4.31Å; W406-F410 WeakPolarHBondContact O-CB 3.22Å; W406-F410 PolarHBondContact O-N 2.86Å; W407-F410 HydrophobicContact CE3-CD1 4.1Å; W407-F410 HydrophobicContact CZ3-CD1 4Å; W407-F410 HydrophobicContact CZ3-CE1 4.25Å; W407-F410 PolarHBondContact O-N 2.93Å; F410-N414 WeakPolarHBondContact CD2-ND2 3.41Å; F410-N414 VanDerWaalsContact CE2-ND2 3.26Å; F410-N414 WeakPolarHBondContact CE2-ND2 3.5Å; F410-N414 WeakPolarHBondContact CZ-ND2 3.28Å; F410-N414 WeakPolarHBondContact O-CB 3.5Å; F410-N414 PolarHBondContact O-N 2.93Å; F410-N414 PolarHBondContact O-ND2 3.38Å; F410-E478 HydrophobicContact CD2-CG 4.12Å
411	I	92.6	Very high	87.4	Confident	90 Å²	90	75.4 Å²	75.4	46%	0.462	35%	0.348	S	S	.	.	H	α-helix	trans	-63.7	-50.1	178.2	-67.9	168.2	0	0	0	110.1	W407 R409 I413 N414 T415	W407-I411 HydrophobicContact CE3-CD1 3.97Å; W407-I411 HydrophobicContact CE3-CG1 4.06Å; W407-I411 HydrophobicContact CZ3-CG1 4.48Å; W407-I411 WeakPolarHBondContact O-CB 3.04Å; W407-I411 WeakPolarHBondContact O-CG1 3.46Å; W407-I411 PolarHBondContact O-N 2.92Å; R409-I411 PolarHBondContact O-N 3.16Å; I411-I413 VanDerWaalsContact C-N 3.35Å; I411-I413 PolarHBondContact O-N 3.1Å; I411-N414 PolarHBondContact O-N 2.93Å; I411-T415 VanDerWaalsContact O-CB 3.31Å; I411-T415 WeakPolarHBondContact O-CB 2.82Å; I411-T415 PolarHBondContact O-N 3.06Å; I411-T415 PolarHBondContact O-OG1 3.32Å
412	A	93.6	Very high	86.4	Confident	60 Å²	60	76.3 Å²	76.3	50%	0.496	35%	0.351	S	S	.	.	H	α-helix	trans	-57.8	-45.5	-178.7	0	0	0	0	0	112.5	A408 R409 F416	A408-A412 VanDerWaalsContact O-CB 3.24Å; A408-A412 WeakPolarHBondContact O-CB 3.26Å; A408-A412 PolarHBondContact O-N 2.94Å; R409-A412 PolarHBondContact O-N 2.81Å; A412-F416 WeakPolarHBondContact O-CB 3.15Å; A412-F416 PolarHBondContact O-N 3.2Å
413	I	92.4	Very high	85.6	Confident	30 Å²	30	73.9 Å²	73.9	15%	0.154	35%	0.345	C	S	.	.	H	α-helix	trans	-64.3	-48	178.2	-68.1	164.2	0	0	0	110.4	R409 I411 F416 L417 L477 E478	R409-I413 HydrophobicContact CB-CD1 4.49Å; R409-I413 WeakPolarHBondContact O-CB 3.39Å; R409-I413 WeakPolarHBondContact O-CD1 3.41Å; R409-I413 WeakPolarHBondContact O-CG1 3.3Å; R409-I413 PolarHBondContact O-N 3.17Å; I411-I413 VanDerWaalsContact C-N 3.35Å; I411-I413 PolarHBondContact O-N 3.1Å; I413-F416 PolarHBondContact O-N 3.39Å; I413-L417 HydrophobicContact CG2-CD1 4.09Å; I413-L417 HydrophobicContact CG2-CG 4.43Å; I413-L417 VanDerWaalsContact O-CG 3.26Å; I413-L417 WeakPolarHBondContact O-CG 3.5Å; I413-L417 PolarHBondContact O-N 2.88Å; I413-L477 HydrophobicContact CD1-CB 3.69Å; I413-E478 HydrophobicContact CD1-CG 4.06Å
414	N	89.6	Confident	84.5	Confident	31 Å²	31	71.1 Å²	71.1	17%	0.166	34%	0.338	C	S	.	.	H	α-helix	trans	-69.3	-35	-177.8	-75.5	-72.5	0	0	0	112.7	F410 I411 L417 F418 E478 K493	F410-N414 WeakPolarHBondContact CD2-ND2 3.41Å; F410-N414 VanDerWaalsContact CE2-ND2 3.26Å; F410-N414 WeakPolarHBondContact CE2-ND2 3.5Å; F410-N414 WeakPolarHBondContact CZ-ND2 3.28Å; F410-N414 WeakPolarHBondContact O-CB 3.5Å; F410-N414 PolarHBondContact O-N 2.93Å; F410-N414 PolarHBondContact O-ND2 3.38Å; I411-N414 PolarHBondContact O-N 2.93Å; N414-L417 PolarHBondContact O-N 3.5Å; N414-F418 WeakPolarHBondContact O-CB 3.47Å; N414-F418 PolarHBondContact O-N 2.88Å; N414-E478 PolarHBondContact ND2-OE1 2.87Å; N414-K493 WeakPolarHBondContact OD1-CE 3.14Å; N414-K493 PolarHBondContact OD1-NZ 2.8Å
415	T	88.6	Confident	83.2	Confident	64 Å²	64	64.7 Å²	64.7	39%	0.393	31%	0.312	S	S	.	.	H	α-helix	trans	-64.9	-44.3	171.3	-62.2	0	0	0	0	111.3	I411 L417 F418 F419	I411-T415 VanDerWaalsContact O-CB 3.31Å; I411-T415 WeakPolarHBondContact O-CB 2.82Å; I411-T415 PolarHBondContact O-N 3.06Å; I411-T415 PolarHBondContact O-OG1 3.32Å; T415-L417 PolarHBondContact O-N 3.41Å; T415-F418 PolarHBondContact O-N 3.05Å; T415-F419 HydrophobicContact CG2-CD2 3.81Å; T415-F419 HydrophobicContact CG2-CE2 3.51Å; T415-F419 WeakPolarHBondContact O-CD2 3.1Å; T415-F419 PolarHBondContact O-N 2.83Å; T415-F419 VanDerWaalsContact O-N 3.08Å
416	F	89.1	Confident	81.7	Confident	126 Å²	126	59.2 Å²	59.2	55%	0.553	29%	0.288	S	S	*	.	H	α-helix	trans	-59.8	-46	174.7	172.7	-101.5	0	0	0	111.8	A412 I413 F418 F419 L420	A412-F416 WeakPolarHBondContact O-CB 3.15Å; A412-F416 PolarHBondContact O-N 3.2Å; I413-F416 PolarHBondContact O-N 3.39Å; F416-F418 VanDerWaalsContact C-N 3.35Å; F416-F418 PolarHBondContact O-N 3.46Å; F416-F419 PolarHBondContact O-N 3.34Å; F416-L420 HydrophobicContact CE1-CD2 4.14Å; F416-L420 HydrophobicContact CZ-CD1 4.48Å; F416-L420 HydrophobicContact CZ-CD2 4.5Å; F416-L420 VanDerWaalsContact O-CB 3.3Å; F416-L420 WeakPolarHBondContact O-CB 3.14Å; F416-L420 PolarHBondContact O-N 3.48Å
417	L	85.2	Confident	79.8	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-43.1	176.7	-71.9	173.2	0	0	0	112.2	I413 N414 T415 F419 L420 F421 I470 S474	I413-L417 HydrophobicContact CG2-CD1 4.09Å; I413-L417 HydrophobicContact CG2-CG 4.43Å; I413-L417 VanDerWaalsContact O-CG 3.26Å; I413-L417 WeakPolarHBondContact O-CG 3.5Å; I413-L417 PolarHBondContact O-N 2.88Å; N414-L417 PolarHBondContact O-N 3.5Å; T415-L417 PolarHBondContact O-N 3.41Å; L417-F419 VanDerWaalsContact C-N 3.34Å; L417-F419 PolarHBondContact O-N 2.89Å; L417-L420 PolarHBondContact O-N 3.45Å; L417-F421 HydrophobicContact CB-CD2 4.3Å; L417-F421 HydrophobicContact CB-CE2 3.75Å; L417-F421 HydrophobicContact CB-CZ 4.24Å; L417-F421 HydrophobicContact CD2-CE2 4.17Å; L417-F421 HydrophobicContact CD2-CZ 3.8Å; L417-F421 HydrophobicContact CG-CE2 4.41Å; L417-F421 WeakPolarHBondContact O-CD2 3.16Å; L417-F421 VanDerWaalsContact O-CG 3.23Å; L417-F421 WeakPolarHBondContact O-CG 3.32Å; L417-F421 PolarHBondContact O-N 3.28Å; L417-I470 HydrophobicContact CD2-CG2 3.65Å; L417-S474 WeakPolarHBondContact CD1-OG 3.48Å
418	F	81.8	Confident	77.6	Confident	109 Å²	109	55.5 Å²	55.5	48%	0.478	29%	0.29	S	S	.	.	H	α-helix	trans	-56.1	-50.4	176.4	176.4	-97.2	0	0	0	111	N414 T415 F416 F421 F422	N414-F418 WeakPolarHBondContact O-CB 3.47Å; N414-F418 PolarHBondContact O-N 2.88Å; T415-F418 PolarHBondContact O-N 3.05Å; F416-F418 VanDerWaalsContact C-N 3.35Å; F416-F418 PolarHBondContact O-N 3.46Å; F418-F421 PolarHBondContact O-N 2.95Å; F418-F422 HydrophobicContact CZ-CD2 4.12Å; F418-F422 VanDerWaalsContact O-CB 3.3Å; F418-F422 WeakPolarHBondContact O-CB 3.2Å; F418-F422 PolarHBondContact O-N 3.02Å
419	F	78.7	Confident	75.7	Confident	103 Å²	103	55.4 Å²	55.4	45%	0.452	28%	0.283	S	S	.	.	H	α-helix	trans	-65.8	-42.1	177.1	-73.1	-59.1	0	0	0	112.8	T415 F416 L417 F421 F422 F423	T415-F419 HydrophobicContact CG2-CD2 3.81Å; T415-F419 HydrophobicContact CG2-CE2 3.51Å; T415-F419 WeakPolarHBondContact O-CD2 3.1Å; T415-F419 PolarHBondContact O-N 2.83Å; T415-F419 VanDerWaalsContact O-N 3.08Å; F416-F419 PolarHBondContact O-N 3.34Å; L417-F419 VanDerWaalsContact C-N 3.34Å; L417-F419 PolarHBondContact O-N 2.89Å; F419-F421 VanDerWaalsContact C-N 3.33Å; F419-F421 PolarHBondContact O-N 2.86Å; F419-F422 PolarHBondContact O-N 3.07Å; F419-F423 HydrophobicContact CB-CD2 4.15Å; F419-F423 HydrophobicContact CB-CE2 4.3Å; F419-F423 HydrophobicContact CD1-CD2 4.26Å; F419-F423 AromaticContact CD1-CE2 3.62Å; F419-F423 HydrophobicContact CD1-CE2 3.62Å; F419-F423 HydrophobicContact CE1-CE2 4.39Å; F419-F423 HydrophobicContact CG-CE2 4.36Å; F419-F423 WeakPolarHBondContact O-CB 3.36Å; F419-F423 WeakPolarHBondContact O-CD2 3.23Å; F419-F423 PolarHBondContact O-N 3.46Å
420	L	77.5	Confident	74	Confident	31 Å²	31	51.3 Å²	51.3	16%	0.162	27%	0.269	C	S	.	.	H	α-helix	trans	-56.5	-48.4	176.3	-177.9	70.5	0	0	0	110.8	F416 L417 L424 L467 I470	F416-L420 HydrophobicContact CE1-CD2 4.14Å; F416-L420 HydrophobicContact CZ-CD1 4.48Å; F416-L420 HydrophobicContact CZ-CD2 4.5Å; F416-L420 VanDerWaalsContact O-CB 3.3Å; F416-L420 WeakPolarHBondContact O-CB 3.14Å; F416-L420 PolarHBondContact O-N 3.48Å; L417-L420 PolarHBondContact O-N 3.45Å; L420-L424 HydrophobicContact CD1-CB 4.34Å; L420-L424 HydrophobicContact CD1-CD1 4.44Å; L420-L424 HydrophobicContact CD1-CD2 3.98Å; L420-L424 HydrophobicContact CG-CD2 4.49Å; L420-L424 WeakPolarHBondContact O-CA 3.16Å; L420-L424 WeakPolarHBondContact O-CB 3.4Å; L420-L424 PolarHBondContact O-N 3.42Å; L420-L467 HydrophobicContact CD2-CD1 4.43Å; L420-I470 HydrophobicContact CD2-CD1 3.92Å; L420-I470 HydrophobicContact CD2-CG2 3.79Å
421	F	72.6	Confident	72.3	Confident	12 Å²	12	52.2 Å²	52.2	5%	0.053	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-41.1	178.3	-59.7	-37.8	0	0	0	111.8	L417 F418 F419 F423 T425 L467 V471 F497	L417-F421 HydrophobicContact CB-CD2 4.3Å; L417-F421 HydrophobicContact CB-CE2 3.75Å; L417-F421 HydrophobicContact CB-CZ 4.24Å; L417-F421 HydrophobicContact CD2-CE2 4.17Å; L417-F421 HydrophobicContact CD2-CZ 3.8Å; L417-F421 HydrophobicContact CG-CE2 4.41Å; L417-F421 WeakPolarHBondContact O-CD2 3.16Å; L417-F421 VanDerWaalsContact O-CG 3.23Å; L417-F421 WeakPolarHBondContact O-CG 3.32Å; L417-F421 PolarHBondContact O-N 3.28Å; F418-F421 PolarHBondContact O-N 2.95Å; F419-F421 VanDerWaalsContact C-N 3.33Å; F419-F421 PolarHBondContact O-N 2.86Å; F421-F423 PolarHBondContact O-N 3.33Å; F421-T425 HydrophobicContact CB-CG2 4.47Å; F421-T425 VanDerWaalsContact O-CB 3.25Å; F421-T425 WeakPolarHBondContact O-CB 3.09Å; F421-T425 WeakPolarHBondContact O-CG2 3.49Å; F421-T425 PolarHBondContact O-N 3.33Å; F421-T425 PolarHBondContact O-OG1 3.44Å; F421-L467 HydrophobicContact CD1-CD1 3.38Å; F421-L467 HydrophobicContact CD1-CD2 3.42Å; F421-L467 VanDerWaalsContact CD1-CD2 3.42Å; F421-L467 HydrophobicContact CD1-CG 3.29Å; F421-L467 HydrophobicContact CE1-CB 4.46Å; F421-L467 HydrophobicContact CE1-CD1 3.3Å; F421-L467 HydrophobicContact CE1-CD2 3.91Å; F421-L467 HydrophobicContact CE1-CG 3.22Å; F421-L467 HydrophobicContact CG-CD2 4.44Å; F421-L467 HydrophobicContact CZ-CG 4.44Å; F421-V471 HydrophobicContact CE1-CG2 4.02Å; F421-V471 HydrophobicContact CE2-CG2 3.78Å; F421-V471 HydrophobicContact CZ-CB 4.42Å; F421-V471 HydrophobicContact CZ-CG2 3.19Å; F421-F497 AromaticContact CD2-CD1 3.25Å; F421-F497 HydrophobicContact CD2-CD1 3.25Å; F421-F497 AromaticContact CD2-CE1 3.32Å; F421-F497 HydrophobicContact CD2-CE1 3.32Å; F421-F497 HydrophobicContact CD2-CG 4.07Å; F421-F497 HydrophobicContact CD2-CZ 4.18Å; F421-F497 HydrophobicContact CE2-CB 4.3Å; F421-F497 AromaticContact CE2-CD1 3.32Å; F421-F497 HydrophobicContact CE2-CD1 3.32Å; F421-F497 HydrophobicContact CE2-CD2 4.12Å; F421-F497 AromaticContact CE2-CE1 3.52Å; F421-F497 HydrophobicContact CE2-CE1 3.52Å; F421-F497 HydrophobicContact CE2-CE2 4.29Å; F421-F497 AromaticContact CE2-CG 3.66Å; F421-F497 HydrophobicContact CE2-CG 3.66Å; F421-F497 HydrophobicContact CE2-CZ 4Å; F421-F497 HydrophobicContact CG-CD1 4.36Å
422	F	67.3	Low	70.3	Confident	29 Å²	29	53.3 Å²	53.3	13%	0.127	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-46.5	180	-153.7	-60.7	0	0	0	111.7	F418 F419 L513 F516	F418-F422 HydrophobicContact CZ-CD2 4.12Å; F418-F422 VanDerWaalsContact O-CB 3.3Å; F418-F422 WeakPolarHBondContact O-CB 3.2Å; F418-F422 PolarHBondContact O-N 3.02Å; F419-F422 PolarHBondContact O-N 3.07Å; F422-L513 HydrophobicContact CD1-CB 3.71Å; F422-L513 HydrophobicContact CD1-CD1 3.33Å; F422-L513 HydrophobicContact CD1-CG 3.98Å; F422-L513 HydrophobicContact CD2-CD1 4.4Å; F422-L513 HydrophobicContact CE1-CB 3.16Å; F422-L513 HydrophobicContact CE1-CD1 3.04Å; F422-L513 HydrophobicContact CE1-CG 3.6Å; F422-L513 HydrophobicContact CE2-CD1 4Å; F422-L513 HydrophobicContact CG-CD1 4.11Å; F422-L513 HydrophobicContact CZ-CB 4.05Å; F422-L513 HydrophobicContact CZ-CD1 3.34Å; F422-L513 HydrophobicContact CZ-CG 4.22Å; F422-F516 AromaticContact CE2-CD1 3.72Å; F422-F516 HydrophobicContact CE2-CD1 3.72Å; F422-F516 HydrophobicContact CE2-CE1 4.03Å; F422-F516 HydrophobicContact CE2-CG 4.19Å; F422-F516 HydrophobicContact CZ-CB 3.86Å; F422-F516 AromaticContact CZ-CD1 3.59Å; F422-F516 HydrophobicContact CZ-CD1 3.59Å; F422-F516 HydrophobicContact CZ-CE1 4.36Å; F422-F516 AromaticContact CZ-CG 3.82Å; F422-F516 HydrophobicContact CZ-CG 3.82Å
423	F	65.8	Low	68.4	Low	99 Å²	99	53 Å²	53	43%	0.434	27%	0.274	S	S	.	.	H	α-helix	trans	-87.7	-29.6	-173.8	-70.4	-68.8	0	0	0	114.4	F419 F421 L513	F419-F423 HydrophobicContact CB-CD2 4.15Å; F419-F423 HydrophobicContact CB-CE2 4.3Å; F419-F423 HydrophobicContact CD1-CD2 4.26Å; F419-F423 AromaticContact CD1-CE2 3.62Å; F419-F423 HydrophobicContact CD1-CE2 3.62Å; F419-F423 HydrophobicContact CE1-CE2 4.39Å; F419-F423 HydrophobicContact CG-CE2 4.36Å; F419-F423 WeakPolarHBondContact O-CB 3.36Å; F419-F423 WeakPolarHBondContact O-CD2 3.23Å; F419-F423 PolarHBondContact O-N 3.46Å; F421-F423 PolarHBondContact O-N 3.33Å; F423-L513 HydrophobicContact CD1-CD2 4.49Å; F423-L513 HydrophobicContact CE1-CD2 3.61Å; F423-L513 HydrophobicContact CZ-CD2 4.09Å
424	L	62.3	Low	66.6	Low	49 Å²	49	53.3 Å²	53.3	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-91.6	-22.7	-174.1	-148	83.8	0	0	0	113.2	L420 T426 I430 F463 L467	L420-L424 HydrophobicContact CD1-CB 4.34Å; L420-L424 HydrophobicContact CD1-CD1 4.44Å; L420-L424 HydrophobicContact CD1-CD2 3.98Å; L420-L424 HydrophobicContact CG-CD2 4.49Å; L420-L424 WeakPolarHBondContact O-CA 3.16Å; L420-L424 WeakPolarHBondContact O-CB 3.4Å; L420-L424 PolarHBondContact O-N 3.42Å; L424-T426 PolarHBondContact O-N 2.9Å; L424-I430 HydrophobicContact CD1-CD1 4.31Å; L424-I430 HydrophobicContact CG-CD1 4.3Å; L424-F463 HydrophobicContact CD1-CE1 4.18Å; L424-F463 HydrophobicContact CD1-CZ 4.45Å; L424-F463 HydrophobicContact CD2-CD1 3.59Å; L424-F463 HydrophobicContact CD2-CE1 3.43Å; L424-F463 VanDerWaalsContact CD2-CE1 3.43Å; L424-F463 HydrophobicContact CD2-CZ 4.39Å; L424-F463 HydrophobicContact CG-CD1 3.98Å; L424-F463 HydrophobicContact CG-CE1 3.58Å; L424-F463 HydrophobicContact CG-CZ 4.07Å; L424-L467 HydrophobicContact CD2-CD1 4.32Å
425	T	59	Low	64.8	Low	26 Å²	26	56.3 Å²	56.3	16%	0.16	29%	0.291	C	S	.	.	S	Bend	trans	-75.4	-1.2	179	58.5	0	0	0	0	113.9	F421 P427 L467 M501	F421-T425 HydrophobicContact CB-CG2 4.47Å; F421-T425 VanDerWaalsContact O-CB 3.25Å; F421-T425 WeakPolarHBondContact O-CB 3.09Å; F421-T425 WeakPolarHBondContact O-CG2 3.49Å; F421-T425 PolarHBondContact O-N 3.33Å; F421-T425 PolarHBondContact O-OG1 3.44Å; T425-P427 VanDerWaalsContact C-CD 3.48Å; T425-P427 WeakPolarHBondContact O-CD 3.43Å; T425-L467 HydrophobicContact CG2-CD2 3.39Å; T425-M501 HydrophobicContact CG2-CG 4.12Å
426	T	58.8	Low	63.2	Low	1 Å²	1	59.5 Å²	59.5	1%	0.006	30%	0.304	C	S	.	.			trans	-102.4	91.4	177.6	-41	0	0	0	0	111.2	L424 A428 I429 I430 T511 S512	L424-T426 PolarHBondContact O-N 2.9Å; T426-A428 HydrophobicContact CG2-CB 3.86Å; T426-A428 PolarHBondContact O-N 2.83Å; T426-I429 HydrophobicContact CG2-CB 3.95Å; T426-I429 HydrophobicContact CG2-CD1 3.85Å; T426-I429 HydrophobicContact CG2-CG1 3.63Å; T426-I429 VanDerWaalsContact CG2-N 3.32Å; T426-I429 PolarHBondContact O-N 2.88Å; T426-I430 PolarHBondContact O-N 3.39Å; T426-I430 VanDerWaalsContact O-N 3.13Å; T426-T511 WeakPolarHBondContact CA-O 3.41Å; T426-T511 WeakPolarHBondContact CB-O 3.32Å; T426-T511 WeakPolarHBondContact CG2-O 3.42Å; T426-T511 PolarHBondContact OG1-O 3.44Å; T426-S512 VanDerWaalsContact CG2-CA 3.47Å; T426-S512 WeakPolarHBondContact OG1-CA 3.33Å
427	P	51.3	Low	61.7	Low	33 Å²	33	61.3 Å²	61.3	21%	0.214	31%	0.308	C	S	.	.	H	α-helix	trans	-47.5	-34.1	167.5	-27	29.6	0	0	0	112.5	T425 M431 L460	T425-P427 VanDerWaalsContact C-CD 3.48Å; T425-P427 WeakPolarHBondContact O-CD 3.43Å; P427-M431 VanDerWaalsContact O-CB 3.25Å; P427-M431 WeakPolarHBondContact O-CB 3.3Å; P427-M431 WeakPolarHBondContact O-CG 3.29Å; P427-M431 PolarHBondContact O-N 3.18Å; P427-L460 HydrophobicContact CG-CD1 3.7Å
428	A	46.8	Very low	60.2	Low	58 Å²	58	65.1 Å²	65.1	48%	0.479	33%	0.328	S	S	.	.	H	α-helix	trans	-68.6	-36.3	177.7	0	0	0	0	0	114.7	T426 N432	T426-A428 HydrophobicContact CG2-CB 3.86Å; T426-A428 PolarHBondContact O-N 2.83Å; A428-N432 WeakPolarHBondContact O-CB 3.26Å; A428-N432 PolarHBondContact O-N 3.44Å
429	I	53.3	Low	58.9	Low	45 Å²	45	64 Å²	64	23%	0.231	33%	0.33	C	S	.	.	H	α-helix	trans	-71.7	-43.3	175.1	-72.6	165.6	0	0	0	108.4	T426 M431 N432 T433 L513	T426-I429 HydrophobicContact CG2-CB 3.95Å; T426-I429 HydrophobicContact CG2-CD1 3.85Å; T426-I429 HydrophobicContact CG2-CG1 3.63Å; T426-I429 VanDerWaalsContact CG2-N 3.32Å; T426-I429 PolarHBondContact O-N 2.88Å; I429-M431 PolarHBondContact O-N 3.18Å; I429-N432 PolarHBondContact O-N 3.44Å; I429-T433 VanDerWaalsContact O-CB 3.24Å; I429-T433 WeakPolarHBondContact O-CB 3.45Å; I429-T433 PolarHBondContact O-N 2.92Å; I429-T433 PolarHBondContact O-OG1 3.11Å; I429-L513 HydrophobicContact CD1-CB 4.16Å
430	I	55.5	Low	57.7	Low	29 Å²	29	60.2 Å²	60.2	15%	0.149	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-46.8	178	-63.6	174.7	0	0	0	110.2	L424 T426 T433 I434 M459 F463	L424-I430 HydrophobicContact CD1-CD1 4.31Å; L424-I430 HydrophobicContact CG-CD1 4.3Å; T426-I430 PolarHBondContact O-N 3.39Å; T426-I430 VanDerWaalsContact O-N 3.13Å; I430-T433 PolarHBondContact O-N 3.5Å; I430-I434 HydrophobicContact CG2-CD1 3.6Å; I430-I434 HydrophobicContact CG2-CG1 4.25Å; I430-I434 VanDerWaalsContact O-CB 3.3Å; I430-I434 WeakPolarHBondContact O-CB 3.31Å; I430-I434 WeakPolarHBondContact O-CG1 3.41Å; I430-I434 PolarHBondContact O-N 3.4Å; I430-M459 HydrophobicContact CB-CE 4.03Å; I430-M459 HydrophobicContact CG2-CE 3.57Å; I430-M459 HydrophobicContact CG2-SD 3.8Å; I430-F463 HydrophobicContact CD1-CD2 4.35Å; I430-F463 HydrophobicContact CD1-CE1 4.46Å; I430-F463 HydrophobicContact CD1-CE2 3.35Å; I430-F463 HydrophobicContact CD1-CZ 3.45Å; I430-F463 VanDerWaalsContact CD1-CZ 3.45Å
431	M	55.8	Low	56.7	Low	68 Å²	68	66 Å²	66	34%	0.335	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-45.7	175.9	-72.2	-63.2	-67.4	0	0	112	P427 I429 T433 I434 D435 P456 M459	P427-M431 VanDerWaalsContact O-CB 3.25Å; P427-M431 WeakPolarHBondContact O-CB 3.3Å; P427-M431 WeakPolarHBondContact O-CG 3.29Å; P427-M431 PolarHBondContact O-N 3.18Å; I429-M431 PolarHBondContact O-N 3.18Å; M431-T433 VanDerWaalsContact C-N 3.31Å; M431-T433 PolarHBondContact O-N 2.92Å; M431-I434 PolarHBondContact O-N 3.17Å; M431-D435 WeakPolarHBondContact O-CB 3.25Å; M431-D435 PolarHBondContact O-N 2.76Å; M431-P456 HydrophobicContact CE-CG 4.34Å; M431-P456 HydrophobicContact SD-CG 4.47Å; M431-M459 HydrophobicContact CG-CE 4.38Å; M431-M459 HydrophobicContact SD-CE 4.32Å
432	N	50.9	Low	55.9	Low	113 Å²	113	69.4 Å²	69.4	60%	0.604	36%	0.358	S	S	*	.	H	α-helix	trans	-65.2	-34.3	177.6	-167	9.2	0	0	0	112.1	A428 I429 M436	A428-N432 WeakPolarHBondContact O-CB 3.26Å; A428-N432 PolarHBondContact O-N 3.44Å; I429-N432 PolarHBondContact O-N 3.44Å; N432-M436 WeakPolarHBondContact O-CB 3.47Å; N432-M436 PolarHBondContact O-N 2.75Å
433	T	53.6	Low	55.2	Low	55 Å²	55	70 Å²	70	34%	0.337	36%	0.363	S	S	.	.	H	α-helix	trans	-72.8	-42.2	175.8	-49.1	0	0	0	0	110.9	I429 I430 M431 D435 M436 Y437	I429-T433 VanDerWaalsContact O-CB 3.24Å; I429-T433 WeakPolarHBondContact O-CB 3.45Å; I429-T433 PolarHBondContact O-N 2.92Å; I429-T433 PolarHBondContact O-OG1 3.11Å; I430-T433 PolarHBondContact O-N 3.5Å; M431-T433 VanDerWaalsContact C-N 3.31Å; M431-T433 PolarHBondContact O-N 2.92Å; T433-D435 VanDerWaalsContact C-N 3.28Å; T433-D435 PolarHBondContact O-N 3.45Å; T433-M436 HydrophobicContact CG2-CE 4.42Å; T433-M436 PolarHBondContact O-N 2.93Å; T433-Y437 HydrophobicContact CG2-CD2 3.69Å; T433-Y437 HydrophobicContact CG2-CE2 3.73Å; T433-Y437 VanDerWaalsContact O-CD2 3.28Å; T433-Y437 WeakPolarHBondContact O-CD2 3.32Å; T433-Y437 PolarHBondContact O-N 3.19Å
434	I	55.7	Low	54.7	Low	35 Å²	35	71 Å²	71	18%	0.179	37%	0.368	C	S	.	.	H	α-helix	trans	-59.3	-41.7	174.7	-75.5	170.2	0	0	0	110.7	I430 M431 N438 V439 T440 F455	I430-I434 HydrophobicContact CG2-CD1 3.6Å; I430-I434 HydrophobicContact CG2-CG1 4.25Å; I430-I434 VanDerWaalsContact O-CB 3.3Å; I430-I434 WeakPolarHBondContact O-CB 3.31Å; I430-I434 WeakPolarHBondContact O-CG1 3.41Å; I430-I434 PolarHBondContact O-N 3.4Å; M431-I434 PolarHBondContact O-N 3.17Å; I434-N438 PolarHBondContact O-N 2.8Å; I434-V439 HydrophobicContact CG2-CB 4.23Å; I434-V439 PolarHBondContact O-N 2.78Å; I434-V439 VanDerWaalsContact O-N 3.07Å; I434-T440 HydrophobicContact CG2-CG2 3.64Å; I434-F455 HydrophobicContact CD1-CE1 4.47Å
435	D	52.3	Low	54.5	Low	94 Å²	94	77.4 Å²	77.4	50%	0.503	40%	0.395	S	S	.	.	H	α-helix	trans	-69.9	-43.3	177.9	-154.5	30.9	0	0	0	111.3	M431 T433 Y437 N438	M431-D435 WeakPolarHBondContact O-CB 3.25Å; M431-D435 PolarHBondContact O-N 2.76Å; T433-D435 VanDerWaalsContact C-N 3.28Å; T433-D435 PolarHBondContact O-N 3.45Å; D435-Y437 VanDerWaalsContact C-N 3.31Å; D435-Y437 PolarHBondContact O-N 2.93Å; D435-N438 PolarHBondContact O-N 2.89Å
436	M	53.5	Low	54.6	Low	131 Å²	131	81.7 Å²	81.7	65%	0.645	42%	0.416	S	S	*	.	H	α-helix	trans	-61.4	-34.7	175.2	-172.4	-177.7	73.3	0	0	113.2	N432 T433	N432-M436 WeakPolarHBondContact O-CB 3.47Å; N432-M436 PolarHBondContact O-N 2.75Å; T433-M436 HydrophobicContact CG2-CE 4.42Å; T433-M436 PolarHBondContact O-N 2.93Å
437	Y	57.7	Low	54.5	Low	165 Å²	165	90 Å²	90	65%	0.647	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	8.4	175.7	-77.7	-79.4	0	0	0	113.8	T433 D435 V439	T433-Y437 HydrophobicContact CG2-CD2 3.69Å; T433-Y437 HydrophobicContact CG2-CE2 3.73Å; T433-Y437 VanDerWaalsContact O-CD2 3.28Å; T433-Y437 WeakPolarHBondContact O-CD2 3.32Å; T433-Y437 PolarHBondContact O-N 3.19Å; D435-Y437 VanDerWaalsContact C-N 3.31Å; D435-Y437 PolarHBondContact O-N 2.93Å; Y437-V439 PolarHBondContact O-N 2.83Å; Y437-V439 VanDerWaalsContact O-N 3.09Å
438	N	53.7	Low	54.8	Low	82 Å²	82	90 Å²	90	44%	0.439	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	23.4	179.1	-100	-45	0	0	0	114.2	I434 D435 T440 R441	I434-N438 PolarHBondContact O-N 2.8Å; D435-N438 PolarHBondContact O-N 2.89Å; N438-T440 PolarHBondContact O-N 3.3Å; N438-R441 HydrophobicContact CB-CG 4.5Å; N438-R441 PolarHBondContact O-N 2.76Å; N438-R441 PolarHBondContact OD1-NE 3.17Å
439	V	54.1	Low	55.2	Low	87 Å²	87	91.1 Å²	91.1	53%	0.527	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.7	-178	-176.9	0	0	0	0	111.4	I434 Y437 P442	I434-V439 HydrophobicContact CG2-CB 4.23Å; I434-V439 PolarHBondContact O-N 2.78Å; I434-V439 VanDerWaalsContact O-N 3.07Å; Y437-V439 PolarHBondContact O-N 2.83Å; Y437-V439 VanDerWaalsContact O-N 3.09Å; V439-P442 VanDerWaalsContact O-CD 3.27Å; V439-P442 WeakPolarHBondContact O-CD 3.41Å
440	T	53.5	Low	55.3	Low	23 Å²	23	94.5 Å²	94.5	14%	0.141	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-20.2	175.4	29.1	0	0	0	0	114.8	I434 N438 P442 I443 E444	I434-T440 HydrophobicContact CG2-CG2 3.64Å; N438-T440 PolarHBondContact O-N 3.3Å; T440-P442 VanDerWaalsContact C-CD 3.44Å; T440-I443 CarbonylContact O-C 3.59Å; T440-I443 WeakPolarHBondContact O-CA 3.4Å; T440-I443 WeakPolarHBondContact O-CB 3.49Å; T440-I443 PolarHBondContact O-N 3.23Å; T440-E444 PolarHBondContact O-N 3.31Å
441	R	56.6	Low	55.3	Low	152 Å²	152	95.6 Å²	95.6	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-56.3	-37.8	-177.4	-71.5	-169.5	178.8	-158.1	-3.6	115.7	N438 I443 K445	N438-R441 HydrophobicContact CB-CG 4.5Å; N438-R441 PolarHBondContact O-N 2.76Å; N438-R441 PolarHBondContact OD1-NE 3.17Å; R441-I443 VanDerWaalsContact C-N 3.3Å; R441-K445 PolarHBondContact O-N 2.75Å
442	P	55.5	Low	55.3	Low	83 Å²	83	96 Å²	96	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-68.2	-29.7	173	-16.2	30.5	0	0	0	112.8	V439 T440	V439-P442 VanDerWaalsContact O-CD 3.27Å; V439-P442 WeakPolarHBondContact O-CD 3.41Å; T440-P442 VanDerWaalsContact C-CD 3.44Å
443	I	54.5	Low	55.4	Low	43 Å²	43	97 Å²	97	22%	0.221	49%	0.49	C	S	.	.	H	α-helix	trans	-81.9	-37.3	-178	-61.5	171.3	0	0	0	110.8	T440 R441 K445 L446 V451	T440-I443 CarbonylContact O-C 3.59Å; T440-I443 WeakPolarHBondContact O-CA 3.4Å; T440-I443 WeakPolarHBondContact O-CB 3.49Å; T440-I443 PolarHBondContact O-N 3.23Å; R441-I443 VanDerWaalsContact C-N 3.3Å; I443-K445 VanDerWaalsContact C-N 3.31Å; I443-K445 PolarHBondContact O-N 3.37Å; I443-L446 WeakPolarHBondContact O-CB 3.29Å; I443-L446 PolarHBondContact O-N 2.84Å; I443-L446 VanDerWaalsContact O-N 3.08Å; I443-V451 HydrophobicContact CG2-CG1 3.75Å
444	E	55.4	Low	55.7	Low	118 Å²	118	100.2 Å²	100.2	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-63.9	-36.4	172.2	-72.7	178.9	161.4	0	0	111.9	T440 L446 Q447	T440-E444 PolarHBondContact O-N 3.31Å; E444-L446 PolarHBondContact O-N 3.21Å; E444-Q447 WeakPolarHBondContact O-CG 3.44Å; E444-Q447 PolarHBondContact O-N 3.15Å; E444-Q447 VanDerWaalsContact O-N 3.15Å
445	K	57.8	Low	56	Low	185 Å²	185	102.7 Å²	102.7	80%	0.804	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.6	172.1	-87.2	-174.3	176.4	-177.1	0	113.5	R441 I443 Q447	R441-K445 PolarHBondContact O-N 2.75Å; I443-K445 VanDerWaalsContact C-N 3.31Å; I443-K445 PolarHBondContact O-N 3.37Å; K445-Q447 VanDerWaalsContact C-N 3.27Å; K445-Q447 PolarHBondContact O-N 3.27Å
446	L	60.7	Low	56	Low	115 Å²	115	100.2 Å²	100.2	60%	0.602	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.9	178.8	-83.6	150.6	0	0	0	112.9	I443 E444 S448	I443-L446 WeakPolarHBondContact O-CB 3.29Å; I443-L446 PolarHBondContact O-N 2.84Å; I443-L446 VanDerWaalsContact O-N 3.08Å; E444-L446 PolarHBondContact O-N 3.21Å; L446-S448 PolarHBondContact O-N 3.36Å
447	Q	55.7	Low	56	Low	177 Å²	177	96.7 Å²	96.7	83%	0.827	49%	0.487	S	S	*	.			trans	35.3	29	173.3	-82.7	-166.1	-26.9	0	0	115.9	E444 K445 P449	E444-Q447 WeakPolarHBondContact O-CG 3.44Å; E444-Q447 PolarHBondContact O-N 3.15Å; E444-Q447 VanDerWaalsContact O-N 3.15Å; K445-Q447 VanDerWaalsContact C-N 3.27Å; K445-Q447 PolarHBondContact O-N 3.27Å; Q447-P449 WeakPolarHBondContact O-CD 3.2Å
448	S	59.1	Low	56.1	Low	33 Å²	33	93.1 Å²	93.1	23%	0.231	48%	0.482	C	S	.	.			trans	-102.2	116.7	-177	59.8	0	0	0	0	107.4	L446 I450 V451 T452	L446-S448 PolarHBondContact O-N 3.36Å; S448-I450 PolarHBondContact O-N 2.85Å; S448-V451 PolarHBondContact O-N 3.49Å; S448-V451 WeakPolarHBondContact OG-CB 3.39Å; S448-V451 WeakPolarHBondContact OG-CG2 3.31Å; S448-T452 PolarHBondContact O-N 3.47Å; S448-T452 PolarHBondContact O-OG1 3.1Å
449	P	55.1	Low	56.4	Low	81 Å²	81	90.6 Å²	90.6	53%	0.526	47%	0.468	S	S	.	.	H	α-helix	trans	-58	-24.1	178.5	19.5	-29.9	0	0	0	111.8	Q447 T452 Q453	Q447-P449 WeakPolarHBondContact O-CD 3.2Å; P449-T452 PolarHBondContact O-OG1 3.4Å; P449-Q453 WeakPolarHBondContact O-CB 3.49Å; P449-Q453 WeakPolarHBondContact O-CG 3.35Å; P449-Q453 PolarHBondContact O-N 3.42Å; P449-Q453 VanDerWaalsContact O-N 3.1Å
450	I	54.4	Low	56.6	Low	115 Å²	115	90.5 Å²	90.5	59%	0.59	46%	0.464	S	S	*	.	H	α-helix	trans	-63.6	-49.3	173.4	-60	165.4	0	0	0	110.9	S448 F454	S448-I450 PolarHBondContact O-N 2.85Å; I450-F454 HydrophobicContact CB-CD2 4.42Å; I450-F454 HydrophobicContact CG2-CD2 3.89Å; I450-F454 HydrophobicContact CG2-CE2 4.22Å; I450-F454 HydrophobicContact CG2-CG 4.42Å; I450-F454 WeakPolarHBondContact O-CB 3.28Å; I450-F454 WeakPolarHBondContact O-CD2 3.48Å; I450-F454 PolarHBondContact O-N 2.95Å
451	V	56.2	Low	57.1	Low	52 Å²	52	97.8 Å²	97.8	32%	0.315	49%	0.489	S	S	.	.	H	α-helix	trans	-71.2	-41.1	-176.1	177.4	0	0	0	0	111.2	I443 S448 Q453 F455	I443-V451 HydrophobicContact CG2-CG1 3.75Å; S448-V451 PolarHBondContact O-N 3.49Å; S448-V451 WeakPolarHBondContact OG-CB 3.39Å; S448-V451 WeakPolarHBondContact OG-CG2 3.31Å; V451-Q453 PolarHBondContact O-N 3.14Å; V451-F455 WeakPolarHBondContact O-CB 3.41Å; V451-F455 PolarHBondContact O-N 2.97Å; V451-F455 VanDerWaalsContact O-N 3.07Å
452	T	54.5	Low	57.6	Low	76 Å²	76	91.4 Å²	91.4	47%	0.466	47%	0.47	S	S	.	.	H	α-helix	trans	-70.4	-29.2	-179	52.3	0	0	0	0	113.5	S448 P449	S448-T452 PolarHBondContact O-N 3.47Å; S448-T452 PolarHBondContact O-OG1 3.1Å; P449-T452 PolarHBondContact O-OG1 3.4Å
453	Q	53.1	Low	58.2	Low	135 Å²	135	89.3 Å²	89.3	63%	0.631	45%	0.453	S	S	*	.	H	α-helix	trans	-91.5	-34.1	178.7	-66.2	176.7	-7.8	0	0	113.1	P449 V451	P449-Q453 WeakPolarHBondContact O-CB 3.49Å; P449-Q453 WeakPolarHBondContact O-CG 3.35Å; P449-Q453 PolarHBondContact O-N 3.42Å; P449-Q453 VanDerWaalsContact O-N 3.1Å; V451-Q453 PolarHBondContact O-N 3.14Å
454	F	60.3	Low	58.7	Low	123 Å²	123	90.2 Å²	90.2	54%	0.539	46%	0.461	S	S	.	.	H	α-helix	trans	-87.2	-27.8	-177.2	-74.8	-105	0	0	0	113.4	I450 S457 V458	I450-F454 HydrophobicContact CB-CD2 4.42Å; I450-F454 HydrophobicContact CG2-CD2 3.89Å; I450-F454 HydrophobicContact CG2-CE2 4.22Å; I450-F454 HydrophobicContact CG2-CG 4.42Å; I450-F454 WeakPolarHBondContact O-CB 3.28Å; I450-F454 WeakPolarHBondContact O-CD2 3.48Å; I450-F454 PolarHBondContact O-N 2.95Å; F454-S457 PolarHBondContact O-N 3.12Å; F454-V458 WeakPolarHBondContact O-CG2 3.25Å; F454-V458 PolarHBondContact O-N 3.35Å
455	F	61.7	Low	59.5	Low	86 Å²	86	87.9 Å²	87.9	38%	0.377	45%	0.454	S	S	.	.	H	α-helix	trans	-58.8	-47.3	-177	179.5	-96	0	0	0	113.3	I434 V451 S457 V458 M459	I434-F455 HydrophobicContact CD1-CE1 4.47Å; V451-F455 WeakPolarHBondContact O-CB 3.41Å; V451-F455 PolarHBondContact O-N 2.97Å; V451-F455 VanDerWaalsContact O-N 3.07Å; F455-S457 VanDerWaalsContact C-N 3.3Å; F455-S457 PolarHBondContact O-N 3.38Å; F455-V458 PolarHBondContact O-N 2.94Å; F455-M459 HydrophobicContact CE1-SD 4.09Å; F455-M459 HydrophobicContact CZ-SD 4.32Å; F455-M459 WeakPolarHBondContact O-CB 3.4Å; F455-M459 PolarHBondContact O-N 3.04Å
456	P	52.5	Low	60.4	Low	42 Å²	42	83.2 Å²	83.2	27%	0.273	44%	0.437	S	S	.	.	H	α-helix	trans	-61.9	-37	176.4	-22.6	35	0	0	0	112.9	M431 L460	M431-P456 HydrophobicContact CE-CG 4.34Å; M431-P456 HydrophobicContact SD-CG 4.47Å; P456-L460 WeakPolarHBondContact O-CB 3.25Å; P456-L460 PolarHBondContact O-N 3.33Å
457	S	53.3	Low	61.1	Low	57 Å²	57	77.8 Å²	77.8	40%	0.399	41%	0.409	S	S	.	.	H	α-helix	trans	-71.1	-42.3	179.9	-58.5	0	0	0	0	112.7	F454 F455 W461	F454-S457 PolarHBondContact O-N 3.12Å; F455-S457 VanDerWaalsContact C-N 3.3Å; F455-S457 PolarHBondContact O-N 3.38Å; S457-W461 WeakPolarHBondContact O-CB 3.32Å; S457-W461 PolarHBondContact O-N 3.02Å
458	V	60.9	Low	62.1	Low	90 Å²	90	70 Å²	70	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-67.1	-39	174.7	172.5	0	0	0	0	110.7	F454 F455 W461 G462	F454-V458 WeakPolarHBondContact O-CG2 3.25Å; F454-V458 PolarHBondContact O-N 3.35Å; F455-V458 PolarHBondContact O-N 2.94Å; V458-W461 PolarHBondContact O-N 2.72Å; V458-G462 PolarHBondContact O-N 3.47Å
459	M	59.7	Low	63.1	Low	29 Å²	29	72.2 Å²	72.2	14%	0.143	38%	0.382	C	S	.	.	H	α-helix	trans	-64.9	-45.2	177	-171	174.8	79.2	0	0	111.4	I430 M431 F455 G462 F463	I430-M459 HydrophobicContact CB-CE 4.03Å; I430-M459 HydrophobicContact CG2-CE 3.57Å; I430-M459 HydrophobicContact CG2-SD 3.8Å; M431-M459 HydrophobicContact CG-CE 4.38Å; M431-M459 HydrophobicContact SD-CE 4.32Å; F455-M459 HydrophobicContact CE1-SD 4.09Å; F455-M459 HydrophobicContact CZ-SD 4.32Å; F455-M459 WeakPolarHBondContact O-CB 3.4Å; F455-M459 PolarHBondContact O-N 3.04Å; M459-G462 PolarHBondContact O-N 3.19Å; M459-F463 HydrophobicContact CE-CE2 4.27Å; M459-F463 HydrophobicContact CG-CD2 3.99Å; M459-F463 HydrophobicContact CG-CE2 3.4Å; M459-F463 HydrophobicContact CG-CZ 4.09Å; M459-F463 WeakPolarHBondContact O-CD2 3.24Å; M459-F463 PolarHBondContact O-N 3.38Å; M459-F463 HydrophobicContact SD-CE2 4.05Å
460	L	58.1	Low	64.6	Low	86 Å²	86	70.9 Å²	70.9	45%	0.45	37%	0.37	S	S	.	.	H	α-helix	trans	-59.9	-46.8	173.6	178.8	62.9	0	0	0	111.4	P427 P456 G462 F463 T464	P427-L460 HydrophobicContact CG-CD1 3.7Å; P456-L460 WeakPolarHBondContact O-CB 3.25Å; P456-L460 PolarHBondContact O-N 3.33Å; L460-G462 PolarHBondContact O-N 2.87Å; L460-F463 PolarHBondContact O-N 3.47Å; L460-T464 WeakPolarHBondContact O-CG2 3.35Å; L460-T464 PolarHBondContact O-N 3.19Å
461	W	63.4	Low	66.1	Low	175 Å²	175	65.6 Å²	65.6	66%	0.663	34%	0.343	S	S	*	.	H	α-helix	trans	-60.4	-44.5	176.6	-178.1	79.6	0	0	0	112	S457 V458 F463 T464 V465	S457-W461 WeakPolarHBondContact O-CB 3.32Å; S457-W461 PolarHBondContact O-N 3.02Å; V458-W461 PolarHBondContact O-N 2.72Å; W461-F463 VanDerWaalsContact C-N 3.34Å; W461-F463 PolarHBondContact O-N 3.04Å; W461-T464 WeakPolarHBondContact CA-OG1 3.43Å; W461-T464 PolarHBondContact O-N 2.82Å; W461-T464 VanDerWaalsContact O-N 3.13Å; W461-T464 PolarHBondContact O-OG1 3.45Å; W461-V465 HydrophobicContact CD2-CG2 4.46Å; W461-V465 HydrophobicContact CZ2-CG2 4.2Å; W461-V465 PolarHBondContact O-N 2.84Å; W461-V465 VanDerWaalsContact O-N 3.16Å
462	G	67.9	Low	67.5	Low	18 Å²	18	64.3 Å²	64.3	19%	0.186	33%	0.333	C	S	.	.	H	α-helix	trans	-56.5	-45.4	174.9	0	0	0	0	0	112.4	V458 M459 L460 V465 I466	V458-G462 PolarHBondContact O-N 3.47Å; M459-G462 PolarHBondContact O-N 3.19Å; L460-G462 PolarHBondContact O-N 2.87Å; G462-V465 PolarHBondContact O-N 3.36Å; G462-I466 WeakPolarHBondContact O-CB 3.23Å; G462-I466 VanDerWaalsContact O-CG1 3.23Å; G462-I466 WeakPolarHBondContact O-CG1 3.47Å; G462-I466 PolarHBondContact O-N 3.33Å
463	F	68.1	Low	69.1	Low	40 Å²	40	66.5 Å²	66.5	18%	0.175	34%	0.336	C	S	.	.	H	α-helix	trans	-64.5	-41.1	175.2	-69.3	-50	0	0	0	112.4	L424 I430 M459 L460 W461 V465 I466 L467	L424-F463 HydrophobicContact CD1-CE1 4.18Å; L424-F463 HydrophobicContact CD1-CZ 4.45Å; L424-F463 HydrophobicContact CD2-CD1 3.59Å; L424-F463 HydrophobicContact CD2-CE1 3.43Å; L424-F463 VanDerWaalsContact CD2-CE1 3.43Å; L424-F463 HydrophobicContact CD2-CZ 4.39Å; L424-F463 HydrophobicContact CG-CD1 3.98Å; L424-F463 HydrophobicContact CG-CE1 3.58Å; L424-F463 HydrophobicContact CG-CZ 4.07Å; I430-F463 HydrophobicContact CD1-CD2 4.35Å; I430-F463 HydrophobicContact CD1-CE1 4.46Å; I430-F463 HydrophobicContact CD1-CE2 3.35Å; I430-F463 HydrophobicContact CD1-CZ 3.45Å; I430-F463 VanDerWaalsContact CD1-CZ 3.45Å; M459-F463 HydrophobicContact CE-CE2 4.27Å; M459-F463 HydrophobicContact CG-CD2 3.99Å; M459-F463 HydrophobicContact CG-CE2 3.4Å; M459-F463 HydrophobicContact CG-CZ 4.09Å; M459-F463 WeakPolarHBondContact O-CD2 3.24Å; M459-F463 PolarHBondContact O-N 3.38Å; M459-F463 HydrophobicContact SD-CE2 4.05Å; L460-F463 PolarHBondContact O-N 3.47Å; W461-F463 VanDerWaalsContact C-N 3.34Å; W461-F463 PolarHBondContact O-N 3.04Å; F463-V465 PolarHBondContact O-N 3.28Å; F463-I466 PolarHBondContact O-N 3.01Å; F463-L467 WeakPolarHBondContact O-CB 3.46Å; F463-L467 PolarHBondContact O-N 2.95Å
464	T	65.6	Low	70.9	Confident	62 Å²	62	60.3 Å²	60.3	38%	0.38	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-27.3	178.2	59.6	0	0	0	0	113.9	L460 W461 P468 M501	L460-T464 WeakPolarHBondContact O-CG2 3.35Å; L460-T464 PolarHBondContact O-N 3.19Å; W461-T464 WeakPolarHBondContact CA-OG1 3.43Å; W461-T464 PolarHBondContact O-N 2.82Å; W461-T464 VanDerWaalsContact O-N 3.13Å; W461-T464 PolarHBondContact O-OG1 3.45Å; T464-P468 WeakPolarHBondContact O-CD 3.42Å; T464-P468 WeakPolarHBondContact O-CG 3.38Å; T464-M501 HydrophobicContact CG2-CE 4.33Å
465	V	71	Confident	72.2	Confident	69 Å²	69	54.4 Å²	54.4	42%	0.418	28%	0.282	S	S	.	.	H	α-helix	trans	-89.3	-42.5	177.7	176.7	0	0	0	0	112.2	W461 G462 F463	W461-V465 HydrophobicContact CD2-CG2 4.46Å; W461-V465 HydrophobicContact CZ2-CG2 4.2Å; W461-V465 PolarHBondContact O-N 2.84Å; W461-V465 VanDerWaalsContact O-N 3.16Å; G462-V465 PolarHBondContact O-N 3.36Å; F463-V465 PolarHBondContact O-N 3.28Å
466	I	77.4	Confident	73.4	Confident	87 Å²	87	54 Å²	54	45%	0.446	28%	0.28	S	S	.	.	H	α-helix	trans	-71.7	-38.2	-175.4	-69	169.1	0	0	0	111.2	G462 F463 L469 I470	G462-I466 WeakPolarHBondContact O-CB 3.23Å; G462-I466 VanDerWaalsContact O-CG1 3.23Å; G462-I466 WeakPolarHBondContact O-CG1 3.47Å; G462-I466 PolarHBondContact O-N 3.33Å; F463-I466 PolarHBondContact O-N 3.01Å; I466-L469 WeakPolarHBondContact O-CB 3.36Å; I466-L469 PolarHBondContact O-N 2.64Å; I466-L469 VanDerWaalsContact O-N 3.1Å; I466-I470 HydrophobicContact CG2-CD1 3.64Å; I466-I470 HydrophobicContact CG2-CG1 4.04Å; I466-I470 WeakPolarHBondContact O-CG1 3.2Å; I466-I470 PolarHBondContact O-N 2.78Å
467	L	76.2	Confident	75.2	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-45.2	-170.7	-149.3	62.9	0	0	0	113.5	L420 F421 L424 T425 F463 L469 I470 V471 M501	L420-L467 HydrophobicContact CD2-CD1 4.43Å; F421-L467 HydrophobicContact CD1-CD1 3.38Å; F421-L467 HydrophobicContact CD1-CD2 3.42Å; F421-L467 VanDerWaalsContact CD1-CD2 3.42Å; F421-L467 HydrophobicContact CD1-CG 3.29Å; F421-L467 HydrophobicContact CE1-CB 4.46Å; F421-L467 HydrophobicContact CE1-CD1 3.3Å; F421-L467 HydrophobicContact CE1-CD2 3.91Å; F421-L467 HydrophobicContact CE1-CG 3.22Å; F421-L467 HydrophobicContact CG-CD2 4.44Å; F421-L467 HydrophobicContact CZ-CG 4.44Å; L424-L467 HydrophobicContact CD2-CD1 4.32Å; T425-L467 HydrophobicContact CG2-CD2 3.39Å; F463-L467 WeakPolarHBondContact O-CB 3.46Å; F463-L467 PolarHBondContact O-N 2.95Å; L467-L469 VanDerWaalsContact C-N 3.29Å; L467-L469 PolarHBondContact O-N 2.99Å; L467-I470 PolarHBondContact O-N 3.36Å; L467-V471 WeakPolarHBondContact O-CG2 3.28Å; L467-V471 PolarHBondContact O-N 2.71Å; L467-V471 VanDerWaalsContact O-N 3.12Å; L467-M501 HydrophobicContact CB-CE 3.85Å; L467-M501 HydrophobicContact CB-SD 3.92Å; L467-M501 HydrophobicContact CD2-CE 3.4Å; L467-M501 VanDerWaalsContact CD2-CE 3.4Å; L467-M501 HydrophobicContact CD2-CG 3.96Å; L467-M501 HydrophobicContact CD2-SD 3.38Å; L467-M501 WeakPolarHBondContact CD2-SD 3.36Å; L467-M501 HydrophobicContact CG-CE 4.23Å; L467-M501 HydrophobicContact CG-SD 4.04Å
468	P	74.8	Confident	76.9	Confident	12 Å²	12	54.9 Å²	54.9	8%	0.078	28%	0.278	C	S	.	.	H	α-helix	trans	-57.8	-37.1	170.5	-27.9	38.2	0	0	0	114	T464 V471 Y472 L498 W602	T464-P468 WeakPolarHBondContact O-CD 3.42Å; T464-P468 WeakPolarHBondContact O-CG 3.38Å; P468-V471 PolarHBondContact O-N 2.91Å; P468-Y472 WeakPolarHBondContact O-CB 3.38Å; P468-Y472 PolarHBondContact O-N 2.82Å; P468-L498 HydrophobicContact CB-CD2 3.84Å; P468-L498 HydrophobicContact CG-CD2 3.64Å; P468-W602 HydrophobicContact CB-CH2 4.23Å; P468-W602 HydrophobicContact CB-CZ2 3.6Å
469	L	81.3	Confident	78.3	Confident	81 Å²	81	51 Å²	51	42%	0.424	26%	0.255	S	S	.	.	H	α-helix	trans	-66.5	-39.3	177.5	-65.3	173.8	0	0	0	111.2	I466 L467 Y472 F473	I466-L469 WeakPolarHBondContact O-CB 3.36Å; I466-L469 PolarHBondContact O-N 2.64Å; I466-L469 VanDerWaalsContact O-N 3.1Å; L467-L469 VanDerWaalsContact C-N 3.29Å; L467-L469 PolarHBondContact O-N 2.99Å; L469-Y472 WeakPolarHBondContact O-CB 3.4Å; L469-Y472 PolarHBondContact O-N 2.77Å; L469-F473 HydrophobicContact CB-CD2 4.42Å; L469-F473 HydrophobicContact CB-CE2 4.36Å; L469-F473 WeakPolarHBondContact O-CD2 3.46Å; L469-F473 PolarHBondContact O-N 3.49Å
470	I	85.8	Confident	79.8	Confident	52 Å²	52	49.8 Å²	49.8	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-43.6	175.6	-65.1	174	0	0	0	110.7	L417 L420 I466 L467 Y472 F473 S474	L417-I470 HydrophobicContact CD2-CG2 3.65Å; L420-I470 HydrophobicContact CD2-CD1 3.92Å; L420-I470 HydrophobicContact CD2-CG2 3.79Å; I466-I470 HydrophobicContact CG2-CD1 3.64Å; I466-I470 HydrophobicContact CG2-CG1 4.04Å; I466-I470 WeakPolarHBondContact O-CG1 3.2Å; I466-I470 PolarHBondContact O-N 2.78Å; L467-I470 PolarHBondContact O-N 3.36Å; I470-Y472 VanDerWaalsContact C-N 3.31Å; I470-Y472 PolarHBondContact O-N 3Å; I470-F473 PolarHBondContact O-N 3.3Å; I470-S474 WeakPolarHBondContact O-CB 3.17Å; I470-S474 PolarHBondContact O-N 2.93Å
471	V	87.1	Confident	81.3	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.024	24%	0.242	C	C	.	.	H	α-helix	trans	-58.4	-46	174.6	-173.9	0	0	0	0	110.3	F421 L467 P468 S474 K493 C494 F497	F421-V471 HydrophobicContact CE1-CG2 4.02Å; F421-V471 HydrophobicContact CE2-CG2 3.78Å; F421-V471 HydrophobicContact CZ-CB 4.42Å; F421-V471 HydrophobicContact CZ-CG2 3.19Å; L467-V471 WeakPolarHBondContact O-CG2 3.28Å; L467-V471 PolarHBondContact O-N 2.71Å; L467-V471 VanDerWaalsContact O-N 3.12Å; P468-V471 PolarHBondContact O-N 2.91Å; V471-S474 PolarHBondContact O-N 3.38Å; V471-S474 PolarHBondContact O-OG 3.13Å; V471-K493 HydrophobicContact CG1-CD 4.49Å; V471-K493 HydrophobicContact CG1-CG 3.92Å; V471-C494 HydrophobicContact CG1-CB 4.42Å; V471-F497 HydrophobicContact CG1-CB 4.27Å; V471-F497 HydrophobicContact CG1-CD2 3.97Å; V471-F497 HydrophobicContact CG1-CG 4.47Å; V471-F497 HydrophobicContact CG2-CB 3.92Å; V471-F497 HydrophobicContact CG2-CD2 4.49Å; V471-F497 HydrophobicContact CG2-CG 4.32Å
472	Y	86.2	Confident	82.5	Confident	26 Å²	26	42.5 Å²	42.5	10%	0.102	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-52.5	178.1	168.5	-102.8	0	0	0	112.3	P468 L469 I470 S474 A475 F476 M490 R598	P468-Y472 WeakPolarHBondContact O-CB 3.38Å; P468-Y472 PolarHBondContact O-N 2.82Å; L469-Y472 WeakPolarHBondContact O-CB 3.4Å; L469-Y472 PolarHBondContact O-N 2.77Å; I470-Y472 VanDerWaalsContact C-N 3.31Å; I470-Y472 PolarHBondContact O-N 3Å; Y472-S474 PolarHBondContact O-N 3.46Å; Y472-A475 PolarHBondContact O-N 3.15Å; Y472-F476 HydrophobicContact CD1-CE2 4.3Å; Y472-F476 HydrophobicContact CD2-CE2 4.13Å; Y472-F476 AromaticContact CE1-CE2 3.76Å; Y472-F476 HydrophobicContact CE1-CE2 3.76Å; Y472-F476 HydrophobicContact CE1-CZ 4.44Å; Y472-F476 AromaticContact CE2-CE2 3.57Å; Y472-F476 HydrophobicContact CE2-CE2 3.57Å; Y472-F476 HydrophobicContact CE2-CZ 4.02Å; Y472-F476 HydrophobicContact CG-CE2 4.47Å; Y472-F476 AromaticContact CZ-CE2 3.35Å; Y472-F476 AromaticContact CZ-CZ 3.73Å; Y472-F476 WeakPolarHBondContact O-CD2 3.47Å; Y472-F476 WeakPolarHBondContact OH-CZ 3.36Å; Y472-M490 HydrophobicContact CD2-CG 4.43Å; Y472-M490 HydrophobicContact CD2-SD 3.45Å; Y472-M490 WeakPolarHBondContact CD2-SD 3.45Å; Y472-M490 HydrophobicContact CE2-CE 4.33Å; Y472-M490 HydrophobicContact CE2-SD 3.44Å; Y472-M490 WeakPolarHBondContact CE2-SD 3.47Å; Y472-R598 HydrophobicContact CD2-CB 4.24Å; Y472-R598 HydrophobicContact CD2-CG 4.05Å; Y472-R598 HydrophobicContact CE2-CB 4.11Å; Y472-R598 HydrophobicContact CE2-CG 4.2Å
473	F	87.6	Confident	83.4	Confident	121 Å²	121	46.5 Å²	46.5	53%	0.531	23%	0.228	S	C	.	.	H	α-helix	trans	-63.4	-31.1	-179.7	-76.9	-61.4	0	0	0	112.8	L469 I470 A475 F476 L477	L469-F473 HydrophobicContact CB-CD2 4.42Å; L469-F473 HydrophobicContact CB-CE2 4.36Å; L469-F473 WeakPolarHBondContact O-CD2 3.46Å; L469-F473 PolarHBondContact O-N 3.49Å; I470-F473 PolarHBondContact O-N 3.3Å; F473-A475 PolarHBondContact O-N 2.95Å; F473-F476 WeakPolarHBondContact O-CB 3.41Å; F473-F476 PolarHBondContact O-N 2.89Å; F473-L477 PolarHBondContact O-N 3.33Å
474	S	90.9	Very high	84.3	Confident	5 Å²	5	44.9 Å²	44.9	4%	0.035	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-30.2	178.7	79.4	0	0	0	0	113.6	L417 I470 V471 Y472 F476 L477 E478 K493	L417-S474 WeakPolarHBondContact CD1-OG 3.48Å; I470-S474 WeakPolarHBondContact O-CB 3.17Å; I470-S474 PolarHBondContact O-N 2.93Å; V471-S474 PolarHBondContact O-N 3.38Å; V471-S474 PolarHBondContact O-OG 3.13Å; Y472-S474 PolarHBondContact O-N 3.46Å; S474-F476 VanDerWaalsContact C-N 3.26Å; S474-F476 PolarHBondContact O-N 3.3Å; S474-L477 PolarHBondContact O-N 3.44Å; S474-E478 WeakPolarHBondContact O-CG 3.36Å; S474-E478 PolarHBondContact O-N 2.84Å; S474-K493 WeakPolarHBondContact OG-CE 3.33Å; S474-K493 PolarHBondContact OG-NZ 2.87Å
475	A	87.4	Confident	85.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-26.4	177.1	0	0	0	0	0	112.4	Y472 F473 M490	Y472-A475 PolarHBondContact O-N 3.15Å; F473-A475 PolarHBondContact O-N 2.95Å; A475-M490 HydrophobicContact CB-CB 4.12Å; A475-M490 HydrophobicContact CB-CG 4.44Å
476	F	87.4	Confident	86.3	Confident	76 Å²	76	41.6 Å²	41.6	33%	0.333	20%	0.202	S	C	.	.	H	α-helix	trans	-76.3	-35.4	173.6	-65.4	-92.8	0	0	0	112	Y472 F473 S474 E478 A479 Q486 M490	Y472-F476 HydrophobicContact CD1-CE2 4.3Å; Y472-F476 HydrophobicContact CD2-CE2 4.13Å; Y472-F476 AromaticContact CE1-CE2 3.76Å; Y472-F476 HydrophobicContact CE1-CE2 3.76Å; Y472-F476 HydrophobicContact CE1-CZ 4.44Å; Y472-F476 AromaticContact CE2-CE2 3.57Å; Y472-F476 HydrophobicContact CE2-CE2 3.57Å; Y472-F476 HydrophobicContact CE2-CZ 4.02Å; Y472-F476 HydrophobicContact CG-CE2 4.47Å; Y472-F476 AromaticContact CZ-CE2 3.35Å; Y472-F476 AromaticContact CZ-CZ 3.73Å; Y472-F476 WeakPolarHBondContact O-CD2 3.47Å; Y472-F476 WeakPolarHBondContact OH-CZ 3.36Å; F473-F476 WeakPolarHBondContact O-CB 3.41Å; F473-F476 PolarHBondContact O-N 2.89Å; S474-F476 VanDerWaalsContact C-N 3.26Å; S474-F476 PolarHBondContact O-N 3.3Å; F476-E478 PolarHBondContact O-N 2.95Å; F476-A479 PolarHBondContact O-N 3.43Å; F476-Q486 VanDerWaalsContact CE1-NE2 3.32Å; F476-M490 HydrophobicContact CE2-SD 4.41Å
477	L	89.2	Confident	86.8	Confident	119 Å²	119	38 Å²	38	62%	0.623	18%	0.184	S	C	*	.	H	α-helix	trans	-66.7	-22	178.6	-63.3	177.7	0	0	0	113.2	I413 F473 S474 A479	I413-L477 HydrophobicContact CD1-CB 3.69Å; F473-L477 PolarHBondContact O-N 3.33Å; S474-L477 PolarHBondContact O-N 3.44Å; L477-A479 VanDerWaalsContact C-N 3.28Å; L477-A479 PolarHBondContact O-N 3.04Å
478	E	89.4	Confident	87.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.1	177.6	-70.4	170.1	-172.9	0	0	113.5	W406 F410 I413 N414 S474 F476 H480 V489 K493	W406-E478 PolarHBondContact NE1-O 3.3Å; F410-E478 HydrophobicContact CD2-CG 4.12Å; I413-E478 HydrophobicContact CD1-CG 4.06Å; N414-E478 PolarHBondContact ND2-OE1 2.87Å; S474-E478 WeakPolarHBondContact O-CG 3.36Å; S474-E478 PolarHBondContact O-N 2.84Å; F476-E478 PolarHBondContact O-N 2.95Å; E478-H480 IonicContact OE2-CD2 2.73Å; E478-H480 IonicContact OE2-CE1 3.15Å; E478-H480 IonicContact OE2-NE2 3.31Å; E478-H480 PolarHBondContact OE2-NE2 3.38Å; E478-V489 WeakPolarHBondContact OE2-CG1 3.17Å; E478-K493 IonicContact OE1-NZ 3.4Å; E478-K493 PolarHBondContact OE1-NZ 3.21Å
479	A	89.9	Confident	88.2	Confident	8 Å²	8	40.9 Å²	40.9	7%	0.066	20%	0.2	C	C	.	.			trans	54.1	63.1	177.1	0	0	0	0	0	114.8	V401 F476 L477	V401-A479 HydrophobicContact CG2-CB 4.22Å; F476-A479 PolarHBondContact O-N 3.43Å; L477-A479 VanDerWaalsContact C-N 3.28Å; L477-A479 PolarHBondContact O-N 3.04Å
480	H	90.5	Very high	88.6	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.019	18%	0.18	C	C	.	.			trans	-69	150.3	174.9	-65.7	-89.2	0	0	0	112.6	H398 W406 E478 S485 Q486	H398-H480 VanDerWaalsContact CB-O 3.26Å; H398-H480 WeakPolarHBondContact CB-O 3Å; H398-H480 PolarHBondContact ND1-O 3Å; W406-H480 AromaticContact CZ2-CE1 3.66Å; W406-H480 AromaticContact CZ2-ND1 3.92Å; W406-H480 AromaticContact NE1-ND1 3.96Å; E478-H480 IonicContact OE2-CD2 2.73Å; E478-H480 IonicContact OE2-CE1 3.15Å; E478-H480 IonicContact OE2-NE2 3.31Å; E478-H480 PolarHBondContact OE2-NE2 3.38Å; H480-S485 PolarHBondContact ND1-OG 2.89Å; H480-Q486 HydrophobicContact CB-CB 3.94Å
481	W	90.4	Very high	88.8	Confident	79 Å²	79	34.6 Å²	34.6	30%	0.299	17%	0.167	S	C	.	.	S	Bend	trans	-72.8	-29.4	178.7	-67.5	-12.8	0	0	0	114.2	M223 T225 I395 H398 L399 V401	M223-W481 HydrophobicContact CE-CE3 3.63Å; M223-W481 HydrophobicContact CE-CZ3 3.76Å; T225-W481 HydrophobicContact CG2-CH2 4.11Å; T225-W481 HydrophobicContact CG2-CZ3 4.05Å; I395-W481 PolarHBondContact N-O 3.28Å; H398-W481 VanDerWaalsContact O-CD1 3.26Å; H398-W481 PolarHBondContact O-NE1 3.12Å; L399-W481 HydrophobicContact CD1-CB 4.45Å; L399-W481 HydrophobicContact CD1-CD2 4.45Å; L399-W481 HydrophobicContact CD1-CG 4.29Å; V401-W481 PolarHBondContact O-NE1 3.26Å
482	T	88.9	Confident	88.9	Confident	28 Å²	28	38.1 Å²	38.1	17%	0.172	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-123.8	147.7	180	64.3	0	0	0	0	111.7	P389 D393 S484 S485 Q486	P389-T482 HydrophobicContact CB-CG2 4.04Å; P389-T482 HydrophobicContact CG-CG2 3.84Å; D393-T482 CarbonylContact O-C 3.21Å; D393-T482 VanDerWaalsContact O-CA 3.23Å; D393-T482 WeakPolarHBondContact O-CA 3.33Å; T482-S484 VanDerWaalsContact C-N 3.27Å; T482-S484 PolarHBondContact O-N 2.94Å; T482-S485 PolarHBondContact O-N 3.07Å; T482-S485 WeakPolarHBondContact OG1-CB 3.45Å; T482-S485 PolarHBondContact OG1-N 3.28Å; T482-Q486 PolarHBondContact O-N 3.01Å; T482-Q486 VanDerWaalsContact O-N 3.1Å
483	R	86.3	Confident	89.1	Confident	103 Å²	103	37.5 Å²	37.5	39%	0.389	18%	0.181	S	C	.	.	H	α-helix	trans	-64.2	-35.9	176.1	-60.1	-178.2	-178.7	-176.9	6.1	110.7	D393 I395 Q486 N487 D593 L648	D393-R483 PolarHBondContact O-N 3.39Å; D393-R483 WeakPolarHBondContact OD1-CA 3.46Å; D393-R483 VanDerWaalsContact OD1-CB 3.32Å; D393-R483 WeakPolarHBondContact OD1-CB 3.42Å; D393-R483 PolarHBondContact OD1-N 3.24Å; I395-R483 HydrophobicContact CD1-CB 4.5Å; I395-R483 HydrophobicContact CD1-CG 3.84Å; I395-R483 HydrophobicContact CG1-CG 3.61Å; R483-Q486 PolarHBondContact O-N 3.35Å; R483-N487 WeakPolarHBondContact O-CB 3.5Å; R483-N487 PolarHBondContact O-N 2.91Å; R483-N487 PolarHBondContact O-ND2 3.37Å; R483-D593 IonicContact CZ-OD2 2.74Å; R483-D593 IonicContact NH1-OD2 3.82Å; R483-D593 PolarHBondContact NH1-OD2 3.28Å; R483-L648 HydrophobicContact CB-CD2 4.33Å
484	S	87.4	Confident	89.1	Confident	5 Å²	5	31.8 Å²	31.8	4%	0.035	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-47.3	174.8	-63.1	0	0	0	0	112.5	D393 T482 N487 L488 N649	D393-S484 PolarHBondContact OD1-N 3.39Å; D393-S484 PolarHBondContact OD1-OG 3.47Å; D393-S484 VanDerWaalsContact OD2-CB 3.29Å; D393-S484 WeakPolarHBondContact OD2-CB 3.27Å; D393-S484 PolarHBondContact OD2-OG 3.39Å; T482-S484 VanDerWaalsContact C-N 3.27Å; T482-S484 PolarHBondContact O-N 2.94Å; S484-N487 PolarHBondContact O-N 3.1Å; S484-L488 VanDerWaalsContact O-CB 3.3Å; S484-L488 WeakPolarHBondContact O-CB 3.38Å; S484-L488 PolarHBondContact O-N 2.98Å; S484-N649 PolarHBondContact OG-N 3.36Å
485	S	88.1	Confident	89.1	Confident	46 Å²	46	32.8 Å²	32.8	32%	0.322	16%	0.159	S	C	.	.	H	α-helix	trans	-64	-42.9	177.9	-177.7	0	0	0	0	111.2	H480 T482 L488 V489	H480-S485 PolarHBondContact ND1-OG 2.89Å; T482-S485 PolarHBondContact O-N 3.07Å; T482-S485 WeakPolarHBondContact OG1-CB 3.45Å; T482-S485 PolarHBondContact OG1-N 3.28Å; S485-L488 PolarHBondContact O-N 3.03Å; S485-V489 WeakPolarHBondContact O-CG2 3.36Å; S485-V489 PolarHBondContact O-N 2.81Å
486	Q	89.4	Confident	89.2	Confident	17 Å²	17	37.7 Å²	37.7	8%	0.079	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-49.3	177.4	-170.1	178.1	3.1	0	0	111.9	F476 H480 T482 R483 L488 V489 M490	F476-Q486 VanDerWaalsContact CE1-NE2 3.32Å; H480-Q486 HydrophobicContact CB-CB 3.94Å; T482-Q486 PolarHBondContact O-N 3.01Å; T482-Q486 VanDerWaalsContact O-N 3.1Å; R483-Q486 PolarHBondContact O-N 3.35Å; Q486-L488 PolarHBondContact O-N 2.96Å; Q486-V489 PolarHBondContact O-N 3.28Å; Q486-M490 VanDerWaalsContact O-CB 3.32Å; Q486-M490 WeakPolarHBondContact O-CB 3.38Å; Q486-M490 PolarHBondContact O-N 3.35Å
487	N	88.9	Confident	89.1	Confident	10 Å²	10	36 Å²	36	5%	0.053	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-38.1	178.1	-82.5	-76	0	0	0	112.1	R483 S484 M490 V491 G597 I652	R483-N487 WeakPolarHBondContact O-CB 3.5Å; R483-N487 PolarHBondContact O-N 2.91Å; R483-N487 PolarHBondContact O-ND2 3.37Å; S484-N487 PolarHBondContact O-N 3.1Å; N487-M490 WeakPolarHBondContact O-CB 3.21Å; N487-M490 PolarHBondContact O-N 3.18Å; N487-M490 WeakPolarHBondContact OD1-CE 3.24Å; N487-V491 WeakPolarHBondContact O-CG2 3.43Å; N487-V491 PolarHBondContact O-N 2.97Å; N487-G597 PolarHBondContact OD1-N 3.46Å; N487-I652 HydrophobicContact CB-CD1 3.67Å
488	L	89.3	Confident	88.8	Confident	38 Å²	38	30.6 Å²	30.6	20%	0.199	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-45.5	177.9	-176.6	66.6	0	0	0	112	S484 S485 Q486 M490 V491 H492 Q651 I652 A655	S484-L488 VanDerWaalsContact O-CB 3.3Å; S484-L488 WeakPolarHBondContact O-CB 3.38Å; S484-L488 PolarHBondContact O-N 2.98Å; S485-L488 PolarHBondContact O-N 3.03Å; Q486-L488 PolarHBondContact O-N 2.96Å; L488-M490 VanDerWaalsContact C-N 3.33Å; L488-V491 PolarHBondContact O-N 3.03Å; L488-H492 PolarHBondContact O-N 2.97Å; L488-H492 PolarHBondContact O-ND1 3Å; L488-Q651 HydrophobicContact CD1-CB 4.44Å; L488-Q651 HydrophobicContact CD2-CB 4.5Å; L488-I652 HydrophobicContact CB-CG1 4.15Å; L488-I652 HydrophobicContact CD1-CG1 4.27Å; L488-A655 HydrophobicContact CD1-CB 3.79Å
489	V	90	Very high	88.6	Confident	36 Å²	36	31.2 Å²	31.2	22%	0.218	15%	0.152	C	C	.	.	H	α-helix	trans	-66	-40	175.7	172.9	0	0	0	0	110.3	E478 S485 Q486 V491 H492 K493	E478-V489 WeakPolarHBondContact OE2-CG1 3.17Å; S485-V489 WeakPolarHBondContact O-CG2 3.36Å; S485-V489 PolarHBondContact O-N 2.81Å; Q486-V489 PolarHBondContact O-N 3.28Å; V489-V491 PolarHBondContact O-N 2.86Å; V489-H492 PolarHBondContact O-N 2.89Å; V489-K493 WeakPolarHBondContact O-CB 3.49Å; V489-K493 PolarHBondContact O-N 3.48Å
490	M	89.8	Confident	88.2	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-57.4	-45.6	175.4	-177.4	166.9	70.3	0	0	112.4	Y472 A475 F476 Q486 N487 L488 C494 Q595 R598	Y472-M490 HydrophobicContact CD2-CG 4.43Å; Y472-M490 HydrophobicContact CD2-SD 3.45Å; Y472-M490 WeakPolarHBondContact CD2-SD 3.45Å; Y472-M490 HydrophobicContact CE2-CE 4.33Å; Y472-M490 HydrophobicContact CE2-SD 3.44Å; Y472-M490 WeakPolarHBondContact CE2-SD 3.47Å; A475-M490 HydrophobicContact CB-CB 4.12Å; A475-M490 HydrophobicContact CB-CG 4.44Å; F476-M490 HydrophobicContact CE2-SD 4.41Å; Q486-M490 VanDerWaalsContact O-CB 3.32Å; Q486-M490 WeakPolarHBondContact O-CB 3.38Å; Q486-M490 PolarHBondContact O-N 3.35Å; N487-M490 WeakPolarHBondContact O-CB 3.21Å; N487-M490 PolarHBondContact O-N 3.18Å; N487-M490 WeakPolarHBondContact OD1-CE 3.24Å; L488-M490 VanDerWaalsContact C-N 3.33Å; M490-C494 WeakPolarHBondContact O-CB 3.47Å; M490-C494 PolarHBondContact O-N 3.21Å; M490-C494 PolarHBondContact O-SG 3.14Å; M490-Q595 HydrophobicContact CE-CB 4.44Å; M490-R598 HydrophobicContact CE-CB 4.19Å; M490-R598 HydrophobicContact SD-CB 4.46Å
491	V	90.8	Very high	87.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.3	-52.9	176	169.4	0	0	0	0	111.5	N487 L488 V489 Y495 G597 I652 A655 Q659	N487-V491 WeakPolarHBondContact O-CG2 3.43Å; N487-V491 PolarHBondContact O-N 2.97Å; L488-V491 PolarHBondContact O-N 3.03Å; V489-V491 PolarHBondContact O-N 2.86Å; V491-Y495 WeakPolarHBondContact O-CB 3.44Å; V491-Y495 PolarHBondContact O-N 3.37Å; V491-Y495 VanDerWaalsContact O-N 3.07Å; V491-G597 WeakPolarHBondContact CG2-O 3.49Å; V491-I652 HydrophobicContact CG2-CG2 4.01Å; V491-A655 HydrophobicContact CG1-CB 4.28Å; V491-Q659 PolarHBondContact O-NE2 3.1Å
492	H	90	Very high	86.8	Confident	77 Å²	77	32.8 Å²	32.8	36%	0.356	16%	0.162	S	C	.	.	H	α-helix	trans	-66.4	-47.9	-176.4	-71.1	88.8	0	0	0	111.6	L488 V489 Y495 I496 A655	L488-H492 PolarHBondContact O-N 2.97Å; L488-H492 PolarHBondContact O-ND1 3Å; V489-H492 PolarHBondContact O-N 2.89Å; H492-Y495 PolarHBondContact O-N 3.19Å; H492-I496 WeakPolarHBondContact O-CB 3.23Å; H492-I496 VanDerWaalsContact O-CG1 3.23Å; H492-I496 WeakPolarHBondContact O-CG1 3.36Å; H492-I496 PolarHBondContact O-N 2.78Å; H492-A655 VanDerWaalsContact CE1-CB 3.41Å; H492-A655 WeakPolarHBondContact CE1-CB 3.41Å
493	K	89.5	Confident	86.2	Confident	13 Å²	13	31.4 Å²	31.4	6%	0.057	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-51.8	-176.5	-172.9	175.8	-176.3	173.5	0	111.2	N414 V471 S474 E478 V489 Y495 I496 F497	N414-K493 WeakPolarHBondContact OD1-CE 3.14Å; N414-K493 PolarHBondContact OD1-NZ 2.8Å; V471-K493 HydrophobicContact CG1-CD 4.49Å; V471-K493 HydrophobicContact CG1-CG 3.92Å; S474-K493 WeakPolarHBondContact OG-CE 3.33Å; S474-K493 PolarHBondContact OG-NZ 2.87Å; E478-K493 IonicContact OE1-NZ 3.4Å; E478-K493 PolarHBondContact OE1-NZ 3.21Å; V489-K493 WeakPolarHBondContact O-CB 3.49Å; V489-K493 PolarHBondContact O-N 3.48Å; K493-Y495 VanDerWaalsContact C-N 3.35Å; K493-Y495 PolarHBondContact O-N 3.07Å; K493-I496 PolarHBondContact O-N 2.71Å; K493-F497 HydrophobicContact CG-CD2 3.73Å; K493-F497 HydrophobicContact CG-CE2 3.79Å; K493-F497 WeakPolarHBondContact O-CB 3.3Å; K493-F497 WeakPolarHBondContact O-CD2 3.21Å; K493-F497 PolarHBondContact O-N 3.45Å; K493-F497 VanDerWaalsContact O-N 3.07Å
494	C	88.4	Confident	85.8	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.007	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-45	178.6	-64.5	0	0	0	0	110.9	V471 M490 L498 A601 W602	V471-C494 HydrophobicContact CG1-CB 4.42Å; M490-C494 WeakPolarHBondContact O-CB 3.47Å; M490-C494 PolarHBondContact O-N 3.21Å; M490-C494 PolarHBondContact O-SG 3.14Å; C494-L498 WeakPolarHBondContact O-CB 3.45Å; C494-L498 WeakPolarHBondContact O-CD1 3.41Å; C494-L498 WeakPolarHBondContact O-CG 3.49Å; C494-L498 PolarHBondContact O-N 3.05Å; C494-A601 HydrophobicContact CB-CB 3.51Å; C494-W602 HydrophobicContact CB-CZ3 4.2Å
495	Y	90.3	Very high	85	Confident	27 Å²	27	29.4 Å²	29.4	11%	0.106	15%	0.15	C	C	.	.	H	α-helix	trans	-62	-50.7	179.2	177.2	-104.9	0	0	0	112.9	V491 H492 K493 F497 L498 V499 M604 S608 Q659	V491-Y495 WeakPolarHBondContact O-CB 3.44Å; V491-Y495 PolarHBondContact O-N 3.37Å; V491-Y495 VanDerWaalsContact O-N 3.07Å; H492-Y495 PolarHBondContact O-N 3.19Å; K493-Y495 VanDerWaalsContact C-N 3.35Å; K493-Y495 PolarHBondContact O-N 3.07Å; Y495-F497 PolarHBondContact O-N 3.11Å; Y495-L498 PolarHBondContact O-N 3.13Å; Y495-V499 HydrophobicContact CD2-CG2 3.92Å; Y495-V499 HydrophobicContact CE1-CG2 4.23Å; Y495-V499 HydrophobicContact CE2-CG2 3.55Å; Y495-V499 HydrophobicContact CG-CG2 4.4Å; Y495-V499 WeakPolarHBondContact O-CB 3.37Å; Y495-V499 WeakPolarHBondContact O-CG2 3.06Å; Y495-V499 PolarHBondContact O-N 3.25Å; Y495-M604 HydrophobicContact CD2-CB 3.74Å; Y495-M604 HydrophobicContact CE2-CB 3.75Å; Y495-S608 WeakPolarHBondContact CE2-OG 3.38Å; Y495-S608 PolarHBondContact OH-OG 3.45Å; Y495-Q659 VanDerWaalsContact CB-NE2 3.32Å; Y495-Q659 HydrophobicContact CD1-CB 4.39Å; Y495-Q659 HydrophobicContact CD1-CG 3.74Å; Y495-Q659 HydrophobicContact CE1-CB 4.1Å; Y495-Q659 HydrophobicContact CE1-CG 3.83Å; Y495-Q659 HydrophobicContact CE2-CB 4.42Å; Y495-Q659 HydrophobicContact CG-CG 4.15Å
496	I	88.9	Confident	84	Confident	103 Å²	103	29.3 Å²	29.3	53%	0.528	15%	0.148	S	C	.	.	H	α-helix	trans	-61	-46.8	-178.3	-69.2	167.2	0	0	0	110.6	H492 K493 F500	H492-I496 WeakPolarHBondContact O-CB 3.23Å; H492-I496 VanDerWaalsContact O-CG1 3.23Å; H492-I496 WeakPolarHBondContact O-CG1 3.36Å; H492-I496 PolarHBondContact O-N 2.78Å; K493-I496 PolarHBondContact O-N 2.71Å; I496-F500 VanDerWaalsContact O-CB 3.24Å; I496-F500 WeakPolarHBondContact O-CB 3.18Å; I496-F500 PolarHBondContact O-N 3.22Å
497	F	85	Confident	83.1	Confident	39 Å²	39	28.5 Å²	28.5	17%	0.171	15%	0.145	C	C	.	.	H	α-helix	trans	-68.3	-39.6	179.8	-79.1	-64.6	0	0	0	112.4	F421 V471 K493 Y495 F500 M501	F421-F497 AromaticContact CD2-CD1 3.25Å; F421-F497 HydrophobicContact CD2-CD1 3.25Å; F421-F497 AromaticContact CD2-CE1 3.32Å; F421-F497 HydrophobicContact CD2-CE1 3.32Å; F421-F497 HydrophobicContact CD2-CG 4.07Å; F421-F497 HydrophobicContact CD2-CZ 4.18Å; F421-F497 HydrophobicContact CE2-CB 4.3Å; F421-F497 AromaticContact CE2-CD1 3.32Å; F421-F497 HydrophobicContact CE2-CD1 3.32Å; F421-F497 HydrophobicContact CE2-CD2 4.12Å; F421-F497 AromaticContact CE2-CE1 3.52Å; F421-F497 HydrophobicContact CE2-CE1 3.52Å; F421-F497 HydrophobicContact CE2-CE2 4.29Å; F421-F497 AromaticContact CE2-CG 3.66Å; F421-F497 HydrophobicContact CE2-CG 3.66Å; F421-F497 HydrophobicContact CE2-CZ 4Å; F421-F497 HydrophobicContact CG-CD1 4.36Å; V471-F497 HydrophobicContact CG1-CB 4.27Å; V471-F497 HydrophobicContact CG1-CD2 3.97Å; V471-F497 HydrophobicContact CG1-CG 4.47Å; V471-F497 HydrophobicContact CG2-CB 3.92Å; V471-F497 HydrophobicContact CG2-CD2 4.49Å; V471-F497 HydrophobicContact CG2-CG 4.32Å; K493-F497 HydrophobicContact CG-CD2 3.73Å; K493-F497 HydrophobicContact CG-CE2 3.79Å; K493-F497 WeakPolarHBondContact O-CB 3.3Å; K493-F497 WeakPolarHBondContact O-CD2 3.21Å; K493-F497 PolarHBondContact O-N 3.45Å; K493-F497 VanDerWaalsContact O-N 3.07Å; Y495-F497 PolarHBondContact O-N 3.11Å; F497-F500 PolarHBondContact O-N 2.78Å; F497-M501 WeakPolarHBondContact O-CB 3.35Å; F497-M501 PolarHBondContact O-N 2.6Å
498	L	84.3	Confident	82	Confident	6 Å²	6	29.3 Å²	29.3	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-65.2	-46.8	176.5	-76	173.1	0	0	0	111.8	P468 C494 Y495 F500 M501 V502 W602 N605	P468-L498 HydrophobicContact CB-CD2 3.84Å; P468-L498 HydrophobicContact CG-CD2 3.64Å; C494-L498 WeakPolarHBondContact O-CB 3.45Å; C494-L498 WeakPolarHBondContact O-CD1 3.41Å; C494-L498 WeakPolarHBondContact O-CG 3.49Å; C494-L498 PolarHBondContact O-N 3.05Å; Y495-L498 PolarHBondContact O-N 3.13Å; L498-F500 VanDerWaalsContact C-N 3.33Å; L498-F500 PolarHBondContact O-N 3.14Å; L498-M501 PolarHBondContact O-N 2.96Å; L498-V502 HydrophobicContact CD2-CG2 4.27Å; L498-V502 WeakPolarHBondContact O-CA 3.41Å; L498-V502 WeakPolarHBondContact O-CB 3.48Å; L498-V502 WeakPolarHBondContact O-CG2 3.43Å; L498-V502 PolarHBondContact O-N 3.37Å; L498-W602 HydrophobicContact CD1-CD2 4.04Å; L498-W602 HydrophobicContact CD1-CE3 4.1Å; L498-W602 HydrophobicContact CD1-CG 4.46Å; L498-W602 HydrophobicContact CD1-CZ3 4.45Å; L498-N605 HydrophobicContact CB-CB 4.2Å; L498-N605 HydrophobicContact CD1-CB 4.34Å
499	V	85.5	Confident	80.4	Confident	14 Å²	14	29.3 Å²	29.3	9%	0.085	16%	0.158	C	C	.	.	I	π-helix	trans	-62.4	-43.3	177.7	170.5	0	0	0	0	110.6	Y495 V503 I504 L666	Y495-V499 HydrophobicContact CD2-CG2 3.92Å; Y495-V499 HydrophobicContact CE1-CG2 4.23Å; Y495-V499 HydrophobicContact CE2-CG2 3.55Å; Y495-V499 HydrophobicContact CG-CG2 4.4Å; Y495-V499 WeakPolarHBondContact O-CB 3.37Å; Y495-V499 WeakPolarHBondContact O-CG2 3.06Å; Y495-V499 PolarHBondContact O-N 3.25Å; V499-V503 HydrophobicContact CG1-CB 4.48Å; V499-V503 WeakPolarHBondContact O-CA 3.19Å; V499-V503 VanDerWaalsContact O-CB 3.23Å; V499-V503 WeakPolarHBondContact O-CB 3.18Å; V499-V503 PolarHBondContact O-N 2.95Å; V499-I504 HydrophobicContact CG1-CD1 4.24Å; V499-I504 HydrophobicContact CG1-CG1 4.35Å; V499-I504 PolarHBondContact O-N 3.39Å; V499-L666 HydrophobicContact CG1-CD2 4.32Å
500	F	80.6	Confident	78.8	Confident	72 Å²	72	28 Å²	28	32%	0.316	15%	0.149	S	C	.	.	I	π-helix	trans	-62.6	-49	177.8	-176.9	-108.6	0	0	0	112.2	I496 F497 L498 I504 L505	I496-F500 VanDerWaalsContact O-CB 3.24Å; I496-F500 WeakPolarHBondContact O-CB 3.18Å; I496-F500 PolarHBondContact O-N 3.22Å; F497-F500 PolarHBondContact O-N 2.78Å; L498-F500 VanDerWaalsContact C-N 3.33Å; L498-F500 PolarHBondContact O-N 3.14Å; F500-I504 HydrophobicContact CD2-CB 4.34Å; F500-I504 HydrophobicContact CD2-CD1 4.37Å; F500-I504 HydrophobicContact CD2-CG2 4.42Å; F500-I504 PolarHBondContact O-N 3.36Å; F500-L505 HydrophobicContact CD1-CD1 4.08Å; F500-L505 HydrophobicContact CD1-CG 4.28Å; F500-L505 HydrophobicContact CE1-CD1 3.67Å; F500-L505 HydrophobicContact CE1-CD2 4.1Å; F500-L505 HydrophobicContact CE1-CG 3.93Å; F500-L505 HydrophobicContact CE2-CD2 4.09Å; F500-L505 HydrophobicContact CE2-CG 4.32Å; F500-L505 HydrophobicContact CZ-CD1 4.13Å; F500-L505 HydrophobicContact CZ-CD2 3.67Å; F500-L505 HydrophobicContact CZ-CG 3.95Å; F500-L505 WeakPolarHBondContact O-CG 3.33Å; F500-L505 PolarHBondContact O-N 3Å
501	M	76.1	Confident	77	Confident	28 Å²	28	31 Å²	31	14%	0.138	17%	0.169	C	C	.	.	I	π-helix	trans	-73.5	-46.1	-176.3	-179	-151.3	169.4	0	0	113.3	T425 T464 L467 F497 L498 P506	T425-M501 HydrophobicContact CG2-CG 4.12Å; T464-M501 HydrophobicContact CG2-CE 4.33Å; L467-M501 HydrophobicContact CB-CE 3.85Å; L467-M501 HydrophobicContact CB-SD 3.92Å; L467-M501 HydrophobicContact CD2-CE 3.4Å; L467-M501 VanDerWaalsContact CD2-CE 3.4Å; L467-M501 HydrophobicContact CD2-CG 3.96Å; L467-M501 HydrophobicContact CD2-SD 3.38Å; L467-M501 WeakPolarHBondContact CD2-SD 3.36Å; L467-M501 HydrophobicContact CG-CE 4.23Å; L467-M501 HydrophobicContact CG-SD 4.04Å; F497-M501 WeakPolarHBondContact O-CB 3.35Å; F497-M501 PolarHBondContact O-N 2.6Å; L498-M501 PolarHBondContact O-N 2.96Å; M501-P506 WeakPolarHBondContact O-CD 3.41Å; M501-P506 VanDerWaalsContact O-CG 3.32Å; M501-P506 WeakPolarHBondContact O-CG 3.23Å
502	V	74.6	Confident	75.4	Confident	23 Å²	23	31.9 Å²	31.9	14%	0.139	17%	0.174	C	C	.	.	I	π-helix	trans	-86.3	-35.9	-171.6	179.2	0	0	0	0	110.5	L498 P506 F545 Y548	L498-V502 HydrophobicContact CD2-CG2 4.27Å; L498-V502 WeakPolarHBondContact O-CA 3.41Å; L498-V502 WeakPolarHBondContact O-CB 3.48Å; L498-V502 WeakPolarHBondContact O-CG2 3.43Å; L498-V502 PolarHBondContact O-N 3.37Å; V502-P506 WeakPolarHBondContact O-CG 3.11Å; V502-F545 HydrophobicContact CG1-CE1 4.44Å; V502-F545 WeakPolarHBondContact O-CE1 3.42Å; V502-F545 VanDerWaalsContact O-CZ 3.3Å; V502-F545 WeakPolarHBondContact O-CZ 3.48Å; V502-Y548 HydrophobicContact CG1-CE1 4.33Å; V502-Y548 HydrophobicContact CG1-CE2 4.21Å
503	V	76.9	Confident	73.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.169	C	C	.	.	I	π-helix	trans	-104.2	-58.6	-172.6	-163.6	0	0	0	0	111.4	V499 S507 V609 L666	V499-V503 HydrophobicContact CG1-CB 4.48Å; V499-V503 WeakPolarHBondContact O-CA 3.19Å; V499-V503 VanDerWaalsContact O-CB 3.23Å; V499-V503 WeakPolarHBondContact O-CB 3.18Å; V499-V503 PolarHBondContact O-N 2.95Å; V503-S507 WeakPolarHBondContact O-CB 3.46Å; V503-S507 PolarHBondContact O-N 3.47Å; V503-S507 PolarHBondContact O-OG 2.89Å; V503-V609 HydrophobicContact CG2-CG2 3.43Å; V503-V609 VanDerWaalsContact CG2-CG2 3.43Å; V503-L666 HydrophobicContact CB-CD2 4.5Å; V503-L666 HydrophobicContact CG1-CD2 3.81Å
504	I	77.3	Confident	71.8	Confident	48 Å²	48	33.5 Å²	33.5	25%	0.246	19%	0.186	C	C	.	.	I	π-helix	trans	-70.8	-54.9	-168.7	-60.2	176.6	0	0	0	111.9	V499 F500 S507 M508	V499-I504 HydrophobicContact CG1-CD1 4.24Å; V499-I504 HydrophobicContact CG1-CG1 4.35Å; V499-I504 PolarHBondContact O-N 3.39Å; F500-I504 HydrophobicContact CD2-CB 4.34Å; F500-I504 HydrophobicContact CD2-CD1 4.37Å; F500-I504 HydrophobicContact CD2-CG2 4.42Å; F500-I504 PolarHBondContact O-N 3.36Å; I504-S507 PolarHBondContact O-N 3.3Å; I504-M508 HydrophobicContact CG2-CG 4.36Å; I504-M508 HydrophobicContact CG2-SD 3.66Å; I504-M508 WeakPolarHBondContact O-CG 3.49Å; I504-M508 PolarHBondContact O-N 2.88Å
505	L	71.9	Confident	70.4	Confident	18 Å²	18	34.7 Å²	34.7	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-47.4	-175.1	-67.7	178.3	0	0	0	113.6	F500 M508 G509 L510	F500-L505 HydrophobicContact CD1-CD1 4.08Å; F500-L505 HydrophobicContact CD1-CG 4.28Å; F500-L505 HydrophobicContact CE1-CD1 3.67Å; F500-L505 HydrophobicContact CE1-CD2 4.1Å; F500-L505 HydrophobicContact CE1-CG 3.93Å; F500-L505 HydrophobicContact CE2-CD2 4.09Å; F500-L505 HydrophobicContact CE2-CG 4.32Å; F500-L505 HydrophobicContact CZ-CD1 4.13Å; F500-L505 HydrophobicContact CZ-CD2 3.67Å; F500-L505 HydrophobicContact CZ-CG 3.95Å; F500-L505 WeakPolarHBondContact O-CG 3.33Å; F500-L505 PolarHBondContact O-N 3Å; L505-M508 PolarHBondContact O-N 3.39Å; L505-G509 PolarHBondContact O-N 2.57Å; L505-L510 HydrophobicContact CD2-CB 4.35Å; L505-L510 PolarHBondContact O-N 2.78Å
506	P	67.6	Low	68.9	Low	43 Å²	43	35.7 Å²	35.7	28%	0.279	20%	0.198	S	C	.	.	H	α-helix	trans	-67.1	-39.9	178.7	-21.8	36.8	0	0	0	111.4	M501 V502 M508 G509	M501-P506 WeakPolarHBondContact O-CD 3.41Å; M501-P506 VanDerWaalsContact O-CG 3.32Å; M501-P506 WeakPolarHBondContact O-CG 3.23Å; V502-P506 WeakPolarHBondContact O-CG 3.11Å; P506-M508 PolarHBondContact O-N 3.22Å; P506-G509 PolarHBondContact O-N 2.98Å; P506-G509 VanDerWaalsContact O-N 3.13Å
507	S	69.1	Low	67.6	Low	1 Å²	1	34.2 Å²	34.2	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-71.7	-14.2	179.9	-52.6	0	0	0	0	113.7	V503 I504 V536 F545 Y613	V503-S507 WeakPolarHBondContact O-CB 3.46Å; V503-S507 PolarHBondContact O-N 3.47Å; V503-S507 PolarHBondContact O-OG 2.89Å; I504-S507 PolarHBondContact O-N 3.3Å; S507-V536 WeakPolarHBondContact O-CG1 3.28Å; S507-F545 WeakPolarHBondContact OG-CE2 3.48Å; S507-Y613 WeakPolarHBondContact CB-OH 3.46Å; S507-Y613 PolarHBondContact OG-OH 2.94Å
508	M	65.6	Low	66.7	Low	26 Å²	26	38 Å²	38	13%	0.128	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-4.9	172.2	-64.6	-177.8	77.3	0	0	112.6	I504 L505 P506 L510 W519 W670	I504-M508 HydrophobicContact CG2-CG 4.36Å; I504-M508 HydrophobicContact CG2-SD 3.66Å; I504-M508 WeakPolarHBondContact O-CG 3.49Å; I504-M508 PolarHBondContact O-N 2.88Å; L505-M508 PolarHBondContact O-N 3.39Å; P506-M508 PolarHBondContact O-N 3.22Å; M508-L510 HydrophobicContact CB-CB 4.2Å; M508-L510 HydrophobicContact CB-CD1 3.78Å; M508-L510 HydrophobicContact CB-CG 3.69Å; M508-L510 HydrophobicContact CE-CD1 3.59Å; M508-L510 HydrophobicContact CG-CD1 4.45Å; M508-L510 PolarHBondContact O-N 3.4Å; M508-L510 VanDerWaalsContact O-N 3.14Å; M508-L510 HydrophobicContact SD-CD1 3.86Å; M508-W519 HydrophobicContact CE-CH2 4.26Å; M508-W519 HydrophobicContact CE-CZ2 3.94Å; M508-W670 HydrophobicContact CG-CH2 4.08Å
509	G	57.1	Low	65.7	Low	39 Å²	39	41.4 Å²	41.4	40%	0.402	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	11.4	-170.7	0	0	0	0	0	113.8	L505 P506 T511	L505-G509 PolarHBondContact O-N 2.57Å; P506-G509 PolarHBondContact O-N 2.98Å; P506-G509 VanDerWaalsContact O-N 3.13Å; G509-T511 PolarHBondContact O-N 2.99Å
510	L	55	Low	64.8	Low	7 Å²	7	44.8 Å²	44.8	4%	0.037	23%	0.234	C	C	.	.			trans	-84.3	55.3	-176.8	-65.7	178.1	0	0	0	110.4	L505 M508 S512 V515 F516 W519	L505-L510 HydrophobicContact CD2-CB 4.35Å; L505-L510 PolarHBondContact O-N 2.78Å; M508-L510 HydrophobicContact CB-CB 4.2Å; M508-L510 HydrophobicContact CB-CD1 3.78Å; M508-L510 HydrophobicContact CB-CG 3.69Å; M508-L510 HydrophobicContact CE-CD1 3.59Å; M508-L510 HydrophobicContact CG-CD1 4.45Å; M508-L510 PolarHBondContact O-N 3.4Å; M508-L510 VanDerWaalsContact O-N 3.14Å; M508-L510 HydrophobicContact SD-CD1 3.86Å; L510-S512 PolarHBondContact O-N 2.99Å; L510-V515 HydrophobicContact CD2-CG1 3.78Å; L510-F516 HydrophobicContact CD1-CD2 4.18Å; L510-W519 HydrophobicContact CD1-CD2 4.23Å; L510-W519 HydrophobicContact CD1-CE3 4.22Å; L510-W519 HydrophobicContact CD2-CB 4.13Å; L510-W519 HydrophobicContact CD2-CG 4.23Å
511	T	52.8	Low	64.3	Low	67 Å²	67	48.9 Å²	48.9	41%	0.411	25%	0.252	S	S	.	.			trans	-75.1	-10.4	-175.1	53.6	0	0	0	0	112.9	T426 G509	T426-T511 WeakPolarHBondContact CA-O 3.41Å; T426-T511 WeakPolarHBondContact CB-O 3.32Å; T426-T511 WeakPolarHBondContact CG2-O 3.42Å; T426-T511 PolarHBondContact OG1-O 3.44Å; G509-T511 PolarHBondContact O-N 2.99Å
512	S	56	Low	63.9	Low	17 Å²	17	50.5 Å²	50.5	12%	0.119	26%	0.261	C	S	.	.	S	Bend	trans	-129.6	151.1	-175.5	76.4	0	0	0	0	116.3	T426 L510 V515 F516	T426-S512 VanDerWaalsContact CG2-CA 3.47Å; T426-S512 WeakPolarHBondContact OG1-CA 3.33Å; L510-S512 PolarHBondContact O-N 2.99Å; S512-V515 PolarHBondContact O-N 3.38Å; S512-V515 WeakPolarHBondContact OG-CB 3.35Å; S512-V515 WeakPolarHBondContact OG-CG2 3.47Å; S512-V515 PolarHBondContact OG-N 2.86Å; S512-F516 WeakPolarHBondContact O-CB 3.35Å; S512-F516 PolarHBondContact O-N 2.92Å
513	L	50.9	Low	63.3	Low	46 Å²	46	55.8 Å²	55.8	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-58.5	-46.2	175.1	-177.1	71.9	0	0	0	113.2	F422 F423 I429 V515 F516 L517	F422-L513 HydrophobicContact CD1-CB 3.71Å; F422-L513 HydrophobicContact CD1-CD1 3.33Å; F422-L513 HydrophobicContact CD1-CG 3.98Å; F422-L513 HydrophobicContact CD2-CD1 4.4Å; F422-L513 HydrophobicContact CE1-CB 3.16Å; F422-L513 HydrophobicContact CE1-CD1 3.04Å; F422-L513 HydrophobicContact CE1-CG 3.6Å; F422-L513 HydrophobicContact CE2-CD1 4Å; F422-L513 HydrophobicContact CG-CD1 4.11Å; F422-L513 HydrophobicContact CZ-CB 4.05Å; F422-L513 HydrophobicContact CZ-CD1 3.34Å; F422-L513 HydrophobicContact CZ-CG 4.22Å; F423-L513 HydrophobicContact CD1-CD2 4.49Å; F423-L513 HydrophobicContact CE1-CD2 3.61Å; F423-L513 HydrophobicContact CZ-CD2 4.09Å; I429-L513 HydrophobicContact CD1-CB 4.16Å; L513-V515 VanDerWaalsContact C-N 3.33Å; L513-V515 PolarHBondContact O-N 3.5Å; L513-F516 PolarHBondContact O-N 3.19Å; L513-L517 HydrophobicContact CD1-CD1 3.78Å; L513-L517 HydrophobicContact CD1-CD2 4.48Å; L513-L517 HydrophobicContact CD1-CG 3.9Å; L513-L517 HydrophobicContact CD2-CD1 4.3Å; L513-L517 HydrophobicContact CG-CD1 3.76Å; L513-L517 HydrophobicContact CG-CG 4.16Å; L513-L517 WeakPolarHBondContact O-CB 3.32Å; L513-L517 WeakPolarHBondContact O-CG 3.14Å; L513-L517 PolarHBondContact O-N 3.47Å
514	D	54.2	Low	62.7	Low	79 Å²	79	64.5 Å²	64.5	42%	0.422	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-44.3	179.7	177.5	70.2	0	0	0	110.6	R518	D514-R518 VanDerWaalsContact CG-NH2 3.31Å; D514-R518 VanDerWaalsContact O-CB 3.3Å; D514-R518 WeakPolarHBondContact O-CB 3.42Å; D514-R518 WeakPolarHBondContact O-CG 3.25Å; D514-R518 PolarHBondContact O-N 3.36Å; D514-R518 IonicContact OD1-CZ 3.89Å; D514-R518 VanDerWaalsContact OD1-CZ 3.25Å; D514-R518 IonicContact OD1-NE 2.71Å; D514-R518 PolarHBondContact OD1-NE 3.44Å; D514-R518 IonicContact OD1-NH2 3.01Å; D514-R518 PolarHBondContact OD1-NH2 2.94Å; D514-R518 IonicContact OD2-CZ 2.88Å; D514-R518 IonicContact OD2-NE 3.9Å; D514-R518 PolarHBondContact OD2-NE 3.49Å; D514-R518 IonicContact OD2-NH1 3.59Å; D514-R518 IonicContact OD2-NH2 2.81Å; D514-R518 PolarHBondContact OD2-NH2 2.84Å
515	V	58.6	Low	62	Low	25 Å²	25	64.1 Å²	64.1	15%	0.152	32%	0.317	C	S	.	.	H	α-helix	trans	-68.5	-37.8	176.3	174.6	0	0	0	0	112.1	L510 S512 L513 W519 Y525	L510-V515 HydrophobicContact CD2-CG1 3.78Å; S512-V515 PolarHBondContact O-N 3.38Å; S512-V515 WeakPolarHBondContact OG-CB 3.35Å; S512-V515 WeakPolarHBondContact OG-CG2 3.47Å; S512-V515 PolarHBondContact OG-N 2.86Å; L513-V515 VanDerWaalsContact C-N 3.33Å; L513-V515 PolarHBondContact O-N 3.5Å; V515-W519 WeakPolarHBondContact O-CB 3.34Å; V515-W519 PolarHBondContact O-N 2.93Å; V515-Y525 HydrophobicContact CG1-CE1 4.49Å; V515-Y525 WeakPolarHBondContact CG1-OH 3.45Å
516	F	59.9	Low	61.3	Low	49 Å²	49	66.9 Å²	66.9	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-67.1	-45	176.7	176.5	-96.9	0	0	0	112.4	F422 L510 S512 L513 W519 L520	F422-F516 AromaticContact CE2-CD1 3.72Å; F422-F516 HydrophobicContact CE2-CD1 3.72Å; F422-F516 HydrophobicContact CE2-CE1 4.03Å; F422-F516 HydrophobicContact CE2-CG 4.19Å; F422-F516 HydrophobicContact CZ-CB 3.86Å; F422-F516 AromaticContact CZ-CD1 3.59Å; F422-F516 HydrophobicContact CZ-CD1 3.59Å; F422-F516 HydrophobicContact CZ-CE1 4.36Å; F422-F516 AromaticContact CZ-CG 3.82Å; F422-F516 HydrophobicContact CZ-CG 3.82Å; L510-F516 HydrophobicContact CD1-CD2 4.18Å; S512-F516 WeakPolarHBondContact O-CB 3.35Å; S512-F516 PolarHBondContact O-N 2.92Å; L513-F516 PolarHBondContact O-N 3.19Å; F516-W519 HydrophobicContact CD2-CE3 4.22Å; F516-W519 HydrophobicContact CE2-CE3 4.18Å; F516-W519 HydrophobicContact CE2-CZ3 4.04Å; F516-W519 PolarHBondContact O-N 3.34Å; F516-L520 HydrophobicContact CE1-CD2 4.24Å; F516-L520 HydrophobicContact CZ-CD2 4.5Å; F516-L520 WeakPolarHBondContact O-CB 3.25Å; F516-L520 PolarHBondContact O-N 3Å
517	L	61.4	Low	60.8	Low	72 Å²	72	71.9 Å²	71.9	38%	0.377	35%	0.351	S	S	.	.	H	α-helix	trans	-69.5	-39.2	179	-70.7	178.3	0	0	0	111.7	L513 W519 L520 F521	L513-L517 HydrophobicContact CD1-CD1 3.78Å; L513-L517 HydrophobicContact CD1-CD2 4.48Å; L513-L517 HydrophobicContact CD1-CG 3.9Å; L513-L517 HydrophobicContact CD2-CD1 4.3Å; L513-L517 HydrophobicContact CG-CD1 3.76Å; L513-L517 HydrophobicContact CG-CG 4.16Å; L513-L517 WeakPolarHBondContact O-CB 3.32Å; L513-L517 WeakPolarHBondContact O-CG 3.14Å; L513-L517 PolarHBondContact O-N 3.47Å; L517-W519 VanDerWaalsContact C-N 3.35Å; L517-L520 PolarHBondContact O-N 2.82Å; L517-F521 HydrophobicContact CD2-CD2 4.1Å; L517-F521 HydrophobicContact CD2-CE2 3.87Å; L517-F521 WeakPolarHBondContact O-CB 3.35Å; L517-F521 PolarHBondContact O-N 3.13Å
518	R	65.4	Low	60.1	Low	119 Å²	119	77.4 Å²	77.4	45%	0.449	38%	0.377	S	S	.	.	H	α-helix	trans	-63.2	-42.7	170.8	-70.8	175.8	-164.9	-160.1	7.9	111	D514 L520 D522 Y525	D514-R518 VanDerWaalsContact CG-NH2 3.31Å; D514-R518 VanDerWaalsContact O-CB 3.3Å; D514-R518 WeakPolarHBondContact O-CB 3.42Å; D514-R518 WeakPolarHBondContact O-CG 3.25Å; D514-R518 PolarHBondContact O-N 3.36Å; D514-R518 IonicContact OD1-CZ 3.89Å; D514-R518 VanDerWaalsContact OD1-CZ 3.25Å; D514-R518 IonicContact OD1-NE 2.71Å; D514-R518 PolarHBondContact OD1-NE 3.44Å; D514-R518 IonicContact OD1-NH2 3.01Å; D514-R518 PolarHBondContact OD1-NH2 2.94Å; D514-R518 IonicContact OD2-CZ 2.88Å; D514-R518 IonicContact OD2-NE 3.9Å; D514-R518 PolarHBondContact OD2-NE 3.49Å; D514-R518 IonicContact OD2-NH1 3.59Å; D514-R518 IonicContact OD2-NH2 2.81Å; D514-R518 PolarHBondContact OD2-NH2 2.84Å; R518-L520 VanDerWaalsContact C-N 3.32Å; R518-L520 PolarHBondContact O-N 2.84Å; R518-D522 HydrophobicContact CB-CB 4.27Å; R518-D522 VanDerWaalsContact O-CA 3.32Å; R518-D522 WeakPolarHBondContact O-CA 3.31Å; R518-D522 WeakPolarHBondContact O-CB 3.47Å; R518-D522 PolarHBondContact O-N 3.33Å; R518-Y525 HydrophobicContact CB-CD1 4.14Å; R518-Y525 HydrophobicContact CB-CD2 4.4Å; R518-Y525 HydrophobicContact CB-CG 4.06Å
519	W	63.9	Low	59.4	Low	76 Å²	76	76.3 Å²	76.3	29%	0.288	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-39.8	173.9	173.3	76.3	0	0	0	113.2	M508 L510 V515 F516 L517 Y525 L526 F533	M508-W519 HydrophobicContact CE-CH2 4.26Å; M508-W519 HydrophobicContact CE-CZ2 3.94Å; L510-W519 HydrophobicContact CD1-CD2 4.23Å; L510-W519 HydrophobicContact CD1-CE3 4.22Å; L510-W519 HydrophobicContact CD2-CB 4.13Å; L510-W519 HydrophobicContact CD2-CG 4.23Å; V515-W519 WeakPolarHBondContact O-CB 3.34Å; V515-W519 PolarHBondContact O-N 2.93Å; F516-W519 HydrophobicContact CD2-CE3 4.22Å; F516-W519 HydrophobicContact CE2-CE3 4.18Å; F516-W519 HydrophobicContact CE2-CZ3 4.04Å; F516-W519 PolarHBondContact O-N 3.34Å; L517-W519 VanDerWaalsContact C-N 3.35Å; W519-Y525 HydrophobicContact CB-CD1 4.44Å; W519-Y525 HydrophobicContact CB-CE1 4.33Å; W519-L526 HydrophobicContact CG-CD2 4.47Å; W519-F533 AromaticContact CD1-CE2 3.9Å; W519-F533 AromaticContact CD1-CZ 3.46Å; W519-F533 VanDerWaalsContact CD1-CZ 3.46Å; W519-F533 HydrophobicContact CG-CZ 4.43Å; W519-F533 AromaticContact NE1-CZ 3.8Å
520	L	65.3	Low	59.1	Low	86 Å²	86	77 Å²	77	45%	0.45	37%	0.371	S	S	.	.	H	α-helix	trans	-77.3	-34.4	-177.2	-166.6	73.6	0	0	0	113.1	F516 L517 R518	F516-L520 HydrophobicContact CE1-CD2 4.24Å; F516-L520 HydrophobicContact CZ-CD2 4.5Å; F516-L520 WeakPolarHBondContact O-CB 3.25Å; F516-L520 PolarHBondContact O-N 3Å; L517-L520 PolarHBondContact O-N 2.82Å; R518-L520 VanDerWaalsContact C-N 3.32Å; R518-L520 PolarHBondContact O-N 2.84Å
521	F	70.2	Confident	58.9	Low	158 Å²	158	79.6 Å²	79.6	69%	0.693	38%	0.384	S	S	*	.	H	α-helix	trans	-122	-14.6	-168.7	-64	-63.5	0	0	0	115.4	L517	L517-F521 HydrophobicContact CD2-CD2 4.1Å; L517-F521 HydrophobicContact CD2-CE2 3.87Å; L517-F521 WeakPolarHBondContact O-CB 3.35Å; L517-F521 PolarHBondContact O-N 3.13Å
522	D	68.2	Low	58.7	Low	61 Å²	61	83.6 Å²	83.6	33%	0.326	39%	0.391	S	S	.	.			trans	-104.1	106	-178.5	-172.3	-8.5	0	0	0	111.6	R518 Y524 Y525 L526	R518-D522 HydrophobicContact CB-CB 4.27Å; R518-D522 VanDerWaalsContact O-CA 3.32Å; R518-D522 WeakPolarHBondContact O-CA 3.31Å; R518-D522 WeakPolarHBondContact O-CB 3.47Å; R518-D522 PolarHBondContact O-N 3.33Å; D522-Y524 VanDerWaalsContact C-N 3.33Å; D522-Y524 PolarHBondContact O-N 2.96Å; D522-Y524 PolarHBondContact OD1-N 3.48Å; D522-Y525 PolarHBondContact O-N 3.07Å; D522-Y525 PolarHBondContact OD1-N 3.5Å; D522-L526 PolarHBondContact O-N 3.34Å
523	I	62.9	Low	58.5	Low	135 Å²	135	83.7 Å²	83.7	69%	0.692	39%	0.39	S	S	*	.	H	α-helix	trans	-67.8	-32.7	-178	-58.7	173.7	0	0	0	111.4	L526	I523-L526 PolarHBondContact O-N 3.26Å
524	Y	62.7	Low	58.5	Low	183 Å²	183	84.6 Å²	84.6	72%	0.718	39%	0.393	S	S	*	.	H	α-helix	trans	-74.6	-31.6	179.4	-65.3	-80.7	0	0	0	111.6	D522 L526 E527 Q528	D522-Y524 VanDerWaalsContact C-N 3.33Å; D522-Y524 PolarHBondContact O-N 2.96Å; D522-Y524 PolarHBondContact OD1-N 3.48Å; Y524-L526 VanDerWaalsContact C-N 3.3Å; Y524-L526 PolarHBondContact O-N 3.07Å; Y524-E527 PolarHBondContact O-N 3.32Å; Y524-Q528 PolarHBondContact O-N 3.33Å
525	Y	62.8	Low	58.3	Low	40 Å²	40	81.6 Å²	81.6	16%	0.157	38%	0.378	C	S	.	.	H	α-helix	trans	-62.1	-36.9	172.4	-175.1	-101.4	0	0	0	111.9	V515 R518 W519 D522 E527 Q528 A529 R532	V515-Y525 HydrophobicContact CG1-CE1 4.49Å; V515-Y525 WeakPolarHBondContact CG1-OH 3.45Å; R518-Y525 HydrophobicContact CB-CD1 4.14Å; R518-Y525 HydrophobicContact CB-CD2 4.4Å; R518-Y525 HydrophobicContact CB-CG 4.06Å; W519-Y525 HydrophobicContact CB-CD1 4.44Å; W519-Y525 HydrophobicContact CB-CE1 4.33Å; D522-Y525 PolarHBondContact O-N 3.07Å; D522-Y525 PolarHBondContact OD1-N 3.5Å; Y525-E527 PolarHBondContact O-N 3Å; Y525-Q528 PolarHBondContact O-N 3.3Å; Y525-A529 HydrophobicContact CD1-CB 4.22Å; Y525-A529 HydrophobicContact CE1-CB 4Å; Y525-A529 WeakPolarHBondContact O-CA 3.41Å; Y525-A529 WeakPolarHBondContact O-CB 3.44Å; Y525-A529 PolarHBondContact O-N 3.28Å; Y525-R532 PolarHBondContact OH-NH1 2.99Å; Y525-R532 VanDerWaalsContact OH-NH1 3.16Å
526	L	57.8	Low	58	Low	75 Å²	75	81.2 Å²	81.2	39%	0.393	38%	0.375	S	S	.	.	H	α-helix	trans	-64.5	-36.7	178.9	-71.1	169.7	0	0	0	113.1	W519 D522 I523 Y524 A529 S530	W519-L526 HydrophobicContact CG-CD2 4.47Å; D522-L526 PolarHBondContact O-N 3.34Å; I523-L526 PolarHBondContact O-N 3.26Å; Y524-L526 VanDerWaalsContact C-N 3.3Å; Y524-L526 PolarHBondContact O-N 3.07Å; L526-A529 PolarHBondContact O-N 2.95Å; L526-S530 PolarHBondContact O-N 2.8Å; L526-S530 VanDerWaalsContact O-N 3.15Å
527	E	56	Low	57.5	Low	149 Å²	149	80.1 Å²	80.1	70%	0.696	37%	0.371	S	S	*	.	H	α-helix	trans	-68.6	-41	-179	-156.8	169.9	-161.9	0	0	111.1	Y524 Y525 S530	Y524-E527 PolarHBondContact O-N 3.32Å; Y525-E527 PolarHBondContact O-N 3Å; E527-S530 PolarHBondContact O-OG 3.41Å
528	Q	54.5	Low	57.3	Low	116 Å²	116	78.3 Å²	78.3	54%	0.542	36%	0.361	S	S	.	.	H	α-helix	trans	-81.5	-25.7	177.3	-141.4	153.7	17.1	0	0	113.1	Y524 Y525 S530	Y524-Q528 PolarHBondContact O-N 3.33Å; Y525-Q528 PolarHBondContact O-N 3.3Å; Q528-S530 VanDerWaalsContact C-N 3.35Å
529	A	50.7	Low	56.8	Low	4 Å²	4	73.1 Å²	73.1	3%	0.033	34%	0.343	C	S	.	.	H	α-helix	trans	-78.8	-13.9	175.5	0	0	0	0	0	113.2	Y525 L526 I531 R532 F533	Y525-A529 HydrophobicContact CD1-CB 4.22Å; Y525-A529 HydrophobicContact CE1-CB 4Å; Y525-A529 WeakPolarHBondContact O-CA 3.41Å; Y525-A529 WeakPolarHBondContact O-CB 3.44Å; Y525-A529 PolarHBondContact O-N 3.28Å; L526-A529 PolarHBondContact O-N 2.95Å; A529-I531 PolarHBondContact O-N 3.01Å; A529-R532 CarbonylContact O-C 3.59Å; A529-R532 WeakPolarHBondContact O-CA 3.48Å; A529-R532 WeakPolarHBondContact O-CB 3.26Å; A529-R532 PolarHBondContact O-N 3.26Å; A529-F533 HydrophobicContact CB-CD2 3.7Å; A529-F533 HydrophobicContact CB-CE2 3.4Å; A529-F533 HydrophobicContact CB-CZ 4.33Å; A529-F533 WeakPolarHBondContact O-CB 3.29Å; A529-F533 WeakPolarHBondContact O-CD2 3.47Å; A529-F533 WeakPolarHBondContact O-CG 3.47Å; A529-F533 PolarHBondContact O-N 3.24Å
530	S	51.4	Low	56.6	Low	54 Å²	54	71.2 Å²	71.2	38%	0.378	34%	0.338	S	S	.	.	H	α-helix	trans	-52.8	-41.4	174.7	63.7	0	0	0	0	112.7	L526 E527 Q528 F533 Q534	L526-S530 PolarHBondContact O-N 2.8Å; L526-S530 VanDerWaalsContact O-N 3.15Å; E527-S530 PolarHBondContact O-OG 3.41Å; Q528-S530 VanDerWaalsContact C-N 3.35Å; S530-F533 PolarHBondContact O-N 3.4Å; S530-Q534 WeakPolarHBondContact O-CG 3.26Å; S530-Q534 PolarHBondContact O-N 3.41Å; S530-Q534 VanDerWaalsContact O-N 3.08Å
531	I	50.3	Low	56.7	Low	61 Å²	61	69.5 Å²	69.5	31%	0.313	33%	0.329	S	S	.	.	H	α-helix	trans	-68.7	-37.1	174	-59.2	169	0	0	0	110.8	A529 C535	A529-I531 PolarHBondContact O-N 3.01Å; I531-C535 PolarHBondContact O-SG 2.93Å
532	R	49.8	Very low	57	Low	150 Å²	150	62.2 Å²	62.2	57%	0.566	30%	0.299	S	S	*	.	H	α-helix	trans	-71.9	-33.3	177.4	-159.3	179.4	-172.2	179.9	4.4	112.6	Y525 A529 C535 V536	Y525-R532 PolarHBondContact OH-NH1 2.99Å; Y525-R532 VanDerWaalsContact OH-NH1 3.16Å; A529-R532 CarbonylContact O-C 3.59Å; A529-R532 WeakPolarHBondContact O-CA 3.48Å; A529-R532 WeakPolarHBondContact O-CB 3.26Å; A529-R532 PolarHBondContact O-N 3.26Å; R532-C535 VanDerWaalsContact O-CB 3.29Å; R532-C535 WeakPolarHBondContact O-CB 3.49Å; R532-C535 PolarHBondContact O-N 2.98Å; R532-V536 PolarHBondContact O-N 3.09Å
533	F	52.3	Low	57.3	Low	20 Å²	20	59.3 Å²	59.3	9%	0.088	28%	0.283	C	S	.	.	H	α-helix	trans	-75.9	-29.6	176	-73.2	-61.1	0	0	0	112.1	W519 A529 S530 C535 V536 F673 L677	W519-F533 AromaticContact CD1-CE2 3.9Å; W519-F533 AromaticContact CD1-CZ 3.46Å; W519-F533 VanDerWaalsContact CD1-CZ 3.46Å; W519-F533 HydrophobicContact CG-CZ 4.43Å; W519-F533 AromaticContact NE1-CZ 3.8Å; A529-F533 HydrophobicContact CB-CD2 3.7Å; A529-F533 HydrophobicContact CB-CE2 3.4Å; A529-F533 HydrophobicContact CB-CZ 4.33Å; A529-F533 WeakPolarHBondContact O-CB 3.29Å; A529-F533 WeakPolarHBondContact O-CD2 3.47Å; A529-F533 WeakPolarHBondContact O-CG 3.47Å; A529-F533 PolarHBondContact O-N 3.24Å; S530-F533 PolarHBondContact O-N 3.4Å; F533-C535 PolarHBondContact O-N 3.44Å; F533-V536 HydrophobicContact CD1-CG2 3.87Å; F533-V536 WeakPolarHBondContact O-CB 3.48Å; F533-V536 PolarHBondContact O-N 3.15Å; F533-F673 HydrophobicContact CD1-CZ 4.23Å; F533-L677 HydrophobicContact CB-CD1 3.98Å; F533-L677 HydrophobicContact CB-CD2 3.88Å; F533-L677 WeakPolarHBondContact O-CD1 3.29Å
534	Q	50.5	Low	58	Low	65 Å²	65	57.9 Å²	57.9	30%	0.304	27%	0.272	S	S	.	.	H	α-helix	trans	-59.1	-30	165.8	-77	176.9	-13.1	0	0	111.8	S530 L677	S530-Q534 WeakPolarHBondContact O-CG 3.26Å; S530-Q534 PolarHBondContact O-N 3.41Å; S530-Q534 VanDerWaalsContact O-N 3.08Å; Q534-L677 PolarHBondContact NE2-O 3.27Å
535	C	50.1	Low	59	Low	15 Å²	15	49.2 Å²	49.2	10%	0.101	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.1	172.1	-44.4	0	0	0	0	114.3	C22 I531 R532 F533 F537 L538	C22-C535 HydrophobicContact CB-CB 4.45Å; C22-C535 WeakPolarHBondContact CB-SG 3.45Å; C22-C535 WeakPolarHBondContact SG-CA 3.44Å; C22-C535 WeakPolarHBondContact SG-CB 3.2Å; C22-C535 CovalentContact SG-SG 2.01Å; C22-C535 PolarHBondContact SG-SG 3.42Å; I531-C535 PolarHBondContact O-SG 2.93Å; R532-C535 VanDerWaalsContact O-CB 3.29Å; R532-C535 WeakPolarHBondContact O-CB 3.49Å; R532-C535 PolarHBondContact O-N 2.98Å; F533-C535 PolarHBondContact O-N 3.44Å; C535-F537 VanDerWaalsContact C-N 3.29Å; C535-F537 PolarHBondContact O-N 2.94Å; C535-L538 HydrophobicContact CB-CD1 4.18Å; C535-L538 VanDerWaalsContact O-CB 3.25Å; C535-L538 WeakPolarHBondContact O-CB 3.14Å; C535-L538 WeakPolarHBondContact O-CD1 3.4Å; C535-L538 WeakPolarHBondContact O-CG 3.32Å; C535-L538 PolarHBondContact O-N 2.98Å
536	V	51.2	Low	60.1	Low	17 Å²	17	47.3 Å²	47.3	10%	0.103	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-23.1	-176.1	165.8	0	0	0	0	112.4	S507 R532 F533 L538 N541 F673	S507-V536 WeakPolarHBondContact O-CG1 3.28Å; R532-V536 PolarHBondContact O-N 3.09Å; F533-V536 HydrophobicContact CD1-CG2 3.87Å; F533-V536 WeakPolarHBondContact O-CB 3.48Å; F533-V536 PolarHBondContact O-N 3.15Å; V536-L538 PolarHBondContact O-N 3.47Å; V536-N541 PolarHBondContact O-ND2 2.97Å; V536-F673 HydrophobicContact CG1-CE1 4.36Å
537	F	51.1	Low	61.3	Low	27 Å²	27	44.5 Å²	44.5	12%	0.118	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	28.2	166.8	-70.8	-74.6	0	0	0	113	V176 C535 P539 W670 F673 F674 L677	V176-F537 HydrophobicContact CG2-CB 4.42Å; V176-F537 WeakPolarHBondContact CG2-O 3.12Å; C535-F537 VanDerWaalsContact C-N 3.29Å; C535-F537 PolarHBondContact O-N 2.94Å; F537-P539 WeakPolarHBondContact O-CD 3.3Å; F537-P539 VanDerWaalsContact O-N 3.17Å; F537-W670 AromaticContact CE1-CE3 3.89Å; F537-W670 HydrophobicContact CE1-CE3 3.89Å; F537-W670 AromaticContact CZ-CE3 3.85Å; F537-W670 HydrophobicContact CZ-CE3 3.85Å; F537-W670 HydrophobicContact CZ-CZ3 4.47Å; F537-F673 HydrophobicContact CD2-CD1 4.36Å; F537-F673 HydrophobicContact CD2-CE1 4.44Å; F537-F673 HydrophobicContact CE1-CD1 4.46Å; F537-F673 HydrophobicContact CE2-CB 4.48Å; F537-F673 AromaticContact CE2-CD1 3.25Å; F537-F673 HydrophobicContact CE2-CD1 3.25Å; F537-F673 AromaticContact CE2-CE1 3.7Å; F537-F673 HydrophobicContact CE2-CE1 3.7Å; F537-F673 HydrophobicContact CE2-CG 4.13Å; F537-F673 HydrophobicContact CZ-CB 4.2Å; F537-F673 AromaticContact CZ-CD1 3.35Å; F537-F673 HydrophobicContact CZ-CD1 3.35Å; F537-F673 HydrophobicContact CZ-CE1 4.13Å; F537-F673 HydrophobicContact CZ-CG 4.19Å; F537-F674 HydrophobicContact CD1-CD2 4.49Å; F537-F674 HydrophobicContact CD2-CD2 4.12Å; F537-F674 HydrophobicContact CE1-CB 4.36Å; F537-F674 HydrophobicContact CE2-CB 3.88Å; F537-F674 HydrophobicContact CE2-CD2 4.28Å; F537-F674 HydrophobicContact CG-CD2 4.19Å; F537-F674 HydrophobicContact CZ-CB 3.74Å; F537-L677 HydrophobicContact CD2-CD1 4.21Å; F537-L677 HydrophobicContact CE2-CD1 4.01Å
538	L	56.3	Low	62.7	Low	34 Å²	34	40.3 Å²	40.3	18%	0.178	20%	0.195	C	C	.	.			trans	-48.7	125.7	170.5	-103.8	153.6	0	0	0	108.6	S25 C535 V536 D540 N541	S25-L538 WeakPolarHBondContact O-CD2 3.42Å; C535-L538 HydrophobicContact CB-CD1 4.18Å; C535-L538 VanDerWaalsContact O-CB 3.25Å; C535-L538 WeakPolarHBondContact O-CB 3.14Å; C535-L538 WeakPolarHBondContact O-CD1 3.4Å; C535-L538 WeakPolarHBondContact O-CG 3.32Å; C535-L538 PolarHBondContact O-N 2.98Å; V536-L538 PolarHBondContact O-N 3.47Å; L538-D540 HydrophobicContact CB-CB 4.46Å; L538-D540 PolarHBondContact O-N 2.87Å; L538-N541 WeakPolarHBondContact O-CB 3.37Å; L538-N541 PolarHBondContact O-N 3.15Å
539	P	54.4	Low	64.4	Low	10 Å²	10	34.8 Å²	34.8	7%	0.065	17%	0.169	C	C	.	.	H	α-helix	trans	-56.6	-20.5	178.1	-26.7	35	0	0	0	113.6	F170 A171 T174 V176 F537 N541 G542 A543	F170-P539 HydrophobicContact CD1-CB 4.34Å; F170-P539 WeakPolarHBondContact CD1-O 3.5Å; F170-P539 WeakPolarHBondContact CE1-O 3.35Å; A171-P539 VanDerWaalsContact CA-CB 3.41Å; A171-P539 HydrophobicContact CB-CB 3.54Å; A171-P539 HydrophobicContact CB-CG 3.53Å; T174-P539 HydrophobicContact CG2-CB 4.08Å; V176-P539 HydrophobicContact CB-CG 4.26Å; V176-P539 HydrophobicContact CG1-CG 4.43Å; V176-P539 HydrophobicContact CG2-CG 4.25Å; F537-P539 WeakPolarHBondContact O-CD 3.3Å; F537-P539 VanDerWaalsContact O-N 3.17Å; P539-N541 VanDerWaalsContact C-N 3.27Å; P539-N541 PolarHBondContact O-N 3.09Å; P539-G542 WeakPolarHBondContact O-CA 3.4Å; P539-G542 PolarHBondContact O-N 3.29Å; P539-G542 VanDerWaalsContact O-N 3.09Å; P539-A543 PolarHBondContact O-N 3.48Å; P539-A543 VanDerWaalsContact O-N 3.09Å
540	D	59.5	Low	66.2	Low	36 Å²	36	34.6 Å²	34.6	19%	0.193	17%	0.167	C	C	.	.	H	α-helix	trans	-57.6	-33.2	169.7	-70.1	0.9	0	0	0	113.3	S27 L538 A543 F544	S27-D540 WeakPolarHBondContact CB-OD2 3.3Å; S27-D540 PolarHBondContact N-OD2 2.94Å; S27-D540 PolarHBondContact OG-OD2 3.47Å; L538-D540 HydrophobicContact CB-CB 4.46Å; L538-D540 PolarHBondContact O-N 2.87Å; D540-A543 PolarHBondContact O-N 3.44Å; D540-F544 PolarHBondContact O-N 3.02Å
541	N	68.1	Low	67.9	Low	49 Å²	49	34.5 Å²	34.5	26%	0.262	16%	0.164	S	C	.	.	H	α-helix	trans	-67.8	-38.6	173.7	-71.7	-17.8	0	0	0	111.3	V536 L538 P539 A543 F544 F545	V536-N541 PolarHBondContact O-ND2 2.97Å; L538-N541 WeakPolarHBondContact O-CB 3.37Å; L538-N541 PolarHBondContact O-N 3.15Å; P539-N541 VanDerWaalsContact C-N 3.27Å; P539-N541 PolarHBondContact O-N 3.09Å; N541-A543 VanDerWaalsContact C-N 3.35Å; N541-A543 PolarHBondContact O-N 3.15Å; N541-F544 WeakPolarHBondContact O-CB 3.34Å; N541-F544 PolarHBondContact O-N 3.04Å; N541-F545 WeakPolarHBondContact O-CD2 3.47Å; N541-F545 PolarHBondContact O-N 3.01Å; N541-F545 VanDerWaalsContact O-N 3.13Å
542	G	75.8	Confident	69.8	Low	5 Å²	5	32.4 Å²	32.4	5%	0.052	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-43.5	172.6	0	0	0	0	0	111.9	P539 F544 F545 V546	P539-G542 WeakPolarHBondContact O-CA 3.4Å; P539-G542 PolarHBondContact O-N 3.29Å; P539-G542 VanDerWaalsContact O-N 3.09Å; G542-F544 PolarHBondContact O-N 2.83Å; G542-F545 PolarHBondContact O-N 3.2Å; G542-V546 WeakPolarHBondContact O-CG2 3.48Å; G542-V546 PolarHBondContact O-N 3.36Å
543	A	76.2	Confident	71.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.5	-40.5	177.3	0	0	0	0	0	112	F170 P539 D540 N541 V546 N547	F170-A543 HydrophobicContact CD1-CB 3.84Å; F170-A543 HydrophobicContact CD2-CB 4.25Å; F170-A543 HydrophobicContact CE1-CB 3.68Å; F170-A543 HydrophobicContact CE2-CB 4.09Å; F170-A543 HydrophobicContact CG-CB 4.14Å; F170-A543 VanDerWaalsContact CZ-CA 3.42Å; F170-A543 HydrophobicContact CZ-CB 3.8Å; F170-A543 VanDerWaalsContact CZ-N 3.32Å; P539-A543 PolarHBondContact O-N 3.48Å; P539-A543 VanDerWaalsContact O-N 3.09Å; D540-A543 PolarHBondContact O-N 3.44Å; N541-A543 VanDerWaalsContact C-N 3.35Å; N541-A543 PolarHBondContact O-N 3.15Å; A543-V546 PolarHBondContact O-N 3.06Å; A543-N547 WeakPolarHBondContact O-CB 3.39Å; A543-N547 VanDerWaalsContact O-CG 3.26Å; A543-N547 PolarHBondContact O-N 2.93Å; A543-N547 PolarHBondContact O-ND2 3.31Å; A543-N547 VanDerWaalsContact O-ND2 3.15Å
544	F	77.3	Confident	73.7	Confident	105 Å²	105	24.9 Å²	24.9	46%	0.461	13%	0.128	S	C	.	.	H	α-helix	trans	-57.3	-49.5	174	172.8	-96.1	0	0	0	112.1	D540 N541 G542 N547 Y548	D540-F544 PolarHBondContact O-N 3.02Å; N541-F544 WeakPolarHBondContact O-CB 3.34Å; N541-F544 PolarHBondContact O-N 3.04Å; G542-F544 PolarHBondContact O-N 2.83Å; F544-N547 PolarHBondContact O-N 3.36Å; F544-Y548 WeakPolarHBondContact O-CB 3.34Å; F544-Y548 PolarHBondContact O-N 3.04Å
545	F	82.5	Confident	75.4	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.009	12%	0.123	C	C	.	.	H	α-helix	trans	-69.3	-33.9	-179.4	-75.9	-67.2	0	0	0	113.1	V502 S507 N541 G542 Y548 V549 V609 Y613 I620	V502-F545 HydrophobicContact CG1-CE1 4.44Å; V502-F545 WeakPolarHBondContact O-CE1 3.42Å; V502-F545 VanDerWaalsContact O-CZ 3.3Å; V502-F545 WeakPolarHBondContact O-CZ 3.48Å; S507-F545 WeakPolarHBondContact OG-CE2 3.48Å; N541-F545 WeakPolarHBondContact O-CD2 3.47Å; N541-F545 PolarHBondContact O-N 3.01Å; N541-F545 VanDerWaalsContact O-N 3.13Å; G542-F545 PolarHBondContact O-N 3.2Å; F545-Y548 WeakPolarHBondContact O-CB 2.78Å; F545-Y548 PolarHBondContact O-N 3.42Å; F545-V549 WeakPolarHBondContact O-CG2 3.42Å; F545-V549 PolarHBondContact O-N 3.5Å; F545-V609 HydrophobicContact CB-CG1 4.09Å; F545-V609 HydrophobicContact CD1-CG1 3.72Å; F545-V609 HydrophobicContact CD1-CG2 4.44Å; F545-V609 HydrophobicContact CG-CG1 4.17Å; F545-Y613 HydrophobicContact CB-CD2 4.41Å; F545-Y613 HydrophobicContact CD1-CE2 4.47Å; F545-Y613 HydrophobicContact CD2-CD2 4.05Å; F545-Y613 HydrophobicContact CD2-CE1 4.09Å; F545-Y613 AromaticContact CD2-CE2 3.36Å; F545-Y613 HydrophobicContact CD2-CE2 3.36Å; F545-Y613 AromaticContact CD2-CZ 3.39Å; F545-Y613 AromaticContact CE2-CE2 3.56Å; F545-Y613 HydrophobicContact CE2-CE2 3.56Å; F545-Y613 AromaticContact CE2-CZ 3.53Å; F545-Y613 WeakPolarHBondContact CE2-OH 3.04Å; F545-Y613 HydrophobicContact CG-CD2 4.19Å; F545-Y613 AromaticContact CG-CE2 3.88Å; F545-Y613 HydrophobicContact CG-CE2 3.88Å; F545-Y613 HydrophobicContact CZ-CE2 4.2Å; F545-I620 HydrophobicContact CB-CD1 4.01Å
546	V	87	Confident	77.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.5	-47.6	171.1	171.7	0	0	0	0	110.5	V38 F170 G542 A543 Y548 V549 I550 I619 I620 F623	V38-V546 HydrophobicContact CG1-CG1 3.81Å; V38-V546 HydrophobicContact CG2-CB 4.42Å; V38-V546 HydrophobicContact CG2-CG1 3.96Å; F170-V546 HydrophobicContact CZ-CG2 4.28Å; G542-V546 WeakPolarHBondContact O-CG2 3.48Å; G542-V546 PolarHBondContact O-N 3.36Å; A543-V546 PolarHBondContact O-N 3.06Å; V546-Y548 VanDerWaalsContact C-N 3.32Å; V546-Y548 PolarHBondContact O-N 2.8Å; V546-V549 PolarHBondContact O-N 2.99Å; V546-I550 HydrophobicContact CG1-CD1 3.84Å; V546-I550 VanDerWaalsContact O-CG1 3.31Å; V546-I550 WeakPolarHBondContact O-CG1 3.04Å; V546-I550 PolarHBondContact O-N 3.26Å; V546-I619 HydrophobicContact CG1-CG2 4.44Å; V546-I620 HydrophobicContact CG2-CB 3.93Å; V546-I620 HydrophobicContact CG2-CG1 4.13Å; V546-F623 HydrophobicContact CG1-CD2 3.77Å; V546-F623 HydrophobicContact CG1-CE2 3.92Å
547	N	83.1	Confident	79.1	Confident	16 Å²	16	23.4 Å²	23.4	9%	0.086	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-39.1	176.4	-73.2	-30.7	0	0	0	112.3	G36 V38 V41 A543 F544 I550 T551	G36-N547 PolarHBondContact O-ND2 3.11Å; V38-N547 WeakPolarHBondContact CA-OD1 3.29Å; V41-N547 WeakPolarHBondContact CB-OD1 2.97Å; V41-N547 HydrophobicContact CG1-CB 4.08Å; A543-N547 WeakPolarHBondContact O-CB 3.39Å; A543-N547 VanDerWaalsContact O-CG 3.26Å; A543-N547 PolarHBondContact O-N 2.93Å; A543-N547 PolarHBondContact O-ND2 3.31Å; A543-N547 VanDerWaalsContact O-ND2 3.15Å; F544-N547 PolarHBondContact O-N 3.36Å; N547-I550 PolarHBondContact O-N 2.79Å; N547-T551 WeakPolarHBondContact O-CB 3.32Å; N547-T551 PolarHBondContact O-N 3.31Å; N547-T551 PolarHBondContact O-OG1 3.33Å
548	Y	84.9	Confident	80.9	Confident	60 Å²	60	22.2 Å²	22.2	24%	0.235	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-48.5	174	168.1	-97.3	0	0	0	111.7	V502 F544 F545 V546 T551 A552 N605 V606 V609	V502-Y548 HydrophobicContact CG1-CE1 4.33Å; V502-Y548 HydrophobicContact CG1-CE2 4.21Å; F544-Y548 WeakPolarHBondContact O-CB 3.34Å; F544-Y548 PolarHBondContact O-N 3.04Å; F545-Y548 WeakPolarHBondContact O-CB 2.78Å; F545-Y548 PolarHBondContact O-N 3.42Å; V546-Y548 VanDerWaalsContact C-N 3.32Å; V546-Y548 PolarHBondContact O-N 2.8Å; Y548-T551 PolarHBondContact O-N 3.42Å; Y548-A552 WeakPolarHBondContact O-CB 3.33Å; Y548-A552 PolarHBondContact O-N 3.41Å; Y548-N605 PolarHBondContact OH-ND2 3.13Å; Y548-V606 HydrophobicContact CE1-CG2 4.31Å; Y548-V609 HydrophobicContact CE1-CG2 4.3Å
549	V	90.7	Very high	82.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.4	-40.2	179.2	175.9	0	0	0	0	111.4	F545 V546 T551 A552 A553 V606 V609 V610 I620 F623	F545-V549 WeakPolarHBondContact O-CG2 3.42Å; F545-V549 PolarHBondContact O-N 3.5Å; V546-V549 PolarHBondContact O-N 2.99Å; V549-T551 VanDerWaalsContact C-N 3.33Å; V549-T551 PolarHBondContact O-N 3.48Å; V549-A552 PolarHBondContact O-N 3.33Å; V549-A553 VanDerWaalsContact O-CB 3.25Å; V549-A553 WeakPolarHBondContact O-CB 3.33Å; V549-A553 PolarHBondContact O-N 2.99Å; V549-V606 HydrophobicContact CG1-CG1 4.31Å; V549-V606 HydrophobicContact CG2-CG1 4.28Å; V549-V609 HydrophobicContact CG2-CG1 4.01Å; V549-V610 HydrophobicContact CG1-CG2 4.39Å; V549-V610 HydrophobicContact CG2-CG2 4.25Å; V549-I620 HydrophobicContact CB-CG1 4.5Å; V549-I620 HydrophobicContact CG2-CD1 3.99Å; V549-I620 HydrophobicContact CG2-CG1 4.04Å; V549-F623 HydrophobicContact CG1-CB 4.11Å
550	I	88.6	Confident	83.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-46.5	174.2	-70.6	166.5	0	0	0	110.8	V38 L42 N45 V546 N547 A553 L554 F623	V38-I550 HydrophobicContact CG1-CD1 3.72Å; L42-I550 HydrophobicContact CB-CD1 4.47Å; L42-I550 HydrophobicContact CB-CG2 4.43Å; L42-I550 HydrophobicContact CD1-CG2 3.8Å; N45-I550 HydrophobicContact CB-CG2 4.19Å; V546-I550 HydrophobicContact CG1-CD1 3.84Å; V546-I550 VanDerWaalsContact O-CG1 3.31Å; V546-I550 WeakPolarHBondContact O-CG1 3.04Å; V546-I550 PolarHBondContact O-N 3.26Å; N547-I550 PolarHBondContact O-N 2.79Å; I550-A553 PolarHBondContact O-N 3.42Å; I550-L554 HydrophobicContact CG2-CD1 4.23Å; I550-L554 PolarHBondContact O-N 3.12Å; I550-F623 HydrophobicContact CD1-CD1 3.97Å; I550-F623 HydrophobicContact CD1-CD2 4.1Å; I550-F623 HydrophobicContact CD1-CE1 3.85Å; I550-F623 HydrophobicContact CD1-CE2 4Å; I550-F623 HydrophobicContact CD1-CG 4.09Å; I550-F623 HydrophobicContact CD1-CZ 3.86Å; I550-F623 HydrophobicContact CG1-CB 4.08Å; I550-F623 HydrophobicContact CG1-CD1 3.5Å; I550-F623 HydrophobicContact CG1-CD2 4.13Å; I550-F623 HydrophobicContact CG1-CE1 3.88Å; I550-F623 HydrophobicContact CG1-CE2 4.46Å; I550-F623 HydrophobicContact CG1-CG 3.64Å; I550-F623 HydrophobicContact CG1-CZ 4.34Å
551	T	87.4	Confident	85.2	Confident	52 Å²	52	23.9 Å²	23.9	32%	0.319	13%	0.128	S	C	.	.	H	α-helix	trans	-64.6	-42.2	179.5	-56.7	0	0	0	0	110.9	N45 N547 Y548 V549 L555 G556	N45-T551 PolarHBondContact ND2-OG1 3.02Å; N45-T551 WeakPolarHBondContact OD1-CA 3.19Å; N547-T551 WeakPolarHBondContact O-CB 3.32Å; N547-T551 PolarHBondContact O-N 3.31Å; N547-T551 PolarHBondContact O-OG1 3.33Å; Y548-T551 PolarHBondContact O-N 3.42Å; V549-T551 VanDerWaalsContact C-N 3.33Å; V549-T551 PolarHBondContact O-N 3.48Å; T551-L555 HydrophobicContact CG2-CB 4.31Å; T551-L555 HydrophobicContact CG2-CD1 4.2Å; T551-L555 WeakPolarHBondContact O-CA 3.41Å; T551-L555 WeakPolarHBondContact O-CB 3.18Å; T551-L555 PolarHBondContact O-N 3.36Å; T551-G556 PolarHBondContact O-N 3.31Å
552	A	89.1	Confident	86	Confident	18 Å²	18	22.2 Å²	22.2	15%	0.149	12%	0.119	C	C	.	.	I	π-helix	trans	-64.7	-39.3	174.7	0	0	0	0	0	112.3	Y548 V549 G556 T557 V606 Y627	Y548-A552 WeakPolarHBondContact O-CB 3.33Å; Y548-A552 PolarHBondContact O-N 3.41Å; V549-A552 PolarHBondContact O-N 3.33Å; A552-G556 VanDerWaalsContact O-CA 3.27Å; A552-G556 WeakPolarHBondContact O-CA 3.38Å; A552-G556 PolarHBondContact O-N 3.07Å; A552-T557 PolarHBondContact O-N 3.41Å; A552-V606 HydrophobicContact CB-CG2 4.32Å; A552-Y627 HydrophobicContact CB-CD2 4.07Å; A552-Y627 HydrophobicContact CB-CE2 4.13Å
553	A	93	Very high	86.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	I	π-helix	trans	-65.6	-43.8	-179.2	0	0	0	0	0	112.8	V549 I550 T557 L626 Y627	V549-A553 VanDerWaalsContact O-CB 3.25Å; V549-A553 WeakPolarHBondContact O-CB 3.33Å; V549-A553 PolarHBondContact O-N 2.99Å; I550-A553 PolarHBondContact O-N 3.42Å; A553-T557 WeakPolarHBondContact O-CG2 3.29Å; A553-T557 PolarHBondContact O-OG1 2.97Å; A553-L626 HydrophobicContact CB-CD2 4.35Å; A553-L626 HydrophobicContact CB-CG 4.25Å; A553-Y627 HydrophobicContact CB-CD2 4.34Å
554	L	90.8	Very high	86.6	Confident	11 Å²	11	27.7 Å²	27.7	6%	0.058	14%	0.144	C	C	.	.	I	π-helix	trans	-95.5	-69.8	-174.8	-65.2	174.7	0	0	0	110.8	L42 N45 I46 W49 I550 T557 G558 L626	L42-L554 HydrophobicContact CD1-CD1 4.14Å; N45-L554 HydrophobicContact CB-CB 4.16Å; N45-L554 HydrophobicContact CB-CD1 3.71Å; I46-L554 HydrophobicContact CG1-CD1 3.67Å; W49-L554 HydrophobicContact CB-CB 4.12Å; W49-L554 HydrophobicContact CD2-CD2 4.43Å; W49-L554 HydrophobicContact CG-CB 4.35Å; W49-L554 HydrophobicContact CG-CD2 4.31Å; I550-L554 HydrophobicContact CG2-CD1 4.23Å; I550-L554 PolarHBondContact O-N 3.12Å; L554-T557 PolarHBondContact O-OG1 3.05Å; L554-G558 PolarHBondContact O-N 3.06Å; L554-L626 HydrophobicContact CD2-CD2 4.48Å
555	L	87.6	Confident	86.7	Confident	39 Å²	39	25.2 Å²	25.2	20%	0.204	15%	0.148	C	C	.	.	I	π-helix	trans	-64.1	-46.9	-179.1	-77.9	-178.2	0	0	0	112	N45 L48 V52 T551 T557 G558 M559	N45-L555 WeakPolarHBondContact OD1-CD1 3.25Å; N45-L555 VanDerWaalsContact OD1-CG 3.23Å; N45-L555 WeakPolarHBondContact OD1-CG 3.2Å; L48-L555 HydrophobicContact CB-CD2 3.6Å; L48-L555 HydrophobicContact CB-CG 4.4Å; L48-L555 HydrophobicContact CD1-CD1 3.89Å; L48-L555 HydrophobicContact CD1-CD2 4.28Å; V52-L555 HydrophobicContact CG2-CD2 4.44Å; T551-L555 HydrophobicContact CG2-CB 4.31Å; T551-L555 HydrophobicContact CG2-CD1 4.2Å; T551-L555 WeakPolarHBondContact O-CA 3.41Å; T551-L555 WeakPolarHBondContact O-CB 3.18Å; T551-L555 PolarHBondContact O-N 3.36Å; L555-T557 PolarHBondContact O-N 3.02Å; L555-G558 PolarHBondContact O-N 3.03Å; L555-M559 VanDerWaalsContact O-CG 3.22Å; L555-M559 WeakPolarHBondContact O-CG 3.4Å; L555-M559 PolarHBondContact O-N 2.81Å
556	G	87.5	Confident	86.5	Confident	27 Å²	27	26.3 Å²	26.3	28%	0.278	16%	0.156	S	C	.	.	I	π-helix	trans	-54.7	-54.8	-178.7	0	0	0	0	0	112.8	T551 A552 G558 M559 E560	T551-G556 PolarHBondContact O-N 3.31Å; A552-G556 VanDerWaalsContact O-CA 3.27Å; A552-G556 WeakPolarHBondContact O-CA 3.38Å; A552-G556 PolarHBondContact O-N 3.07Å; G556-G558 PolarHBondContact O-N 3.42Å; G556-M559 PolarHBondContact O-N 2.73Å; G556-E560 WeakPolarHBondContact O-CG 3.35Å; G556-E560 PolarHBondContact O-N 3.25Å; G556-E560 VanDerWaalsContact O-N 3.08Å
557	T	90.4	Very high	86.2	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-65.9	-35.6	178	67.1	0	0	0	0	112.6	A552 A553 L554 L555 M559 E560 L561 M630 K631	A552-T557 PolarHBondContact O-N 3.41Å; A553-T557 WeakPolarHBondContact O-CG2 3.29Å; A553-T557 PolarHBondContact O-OG1 2.97Å; L554-T557 PolarHBondContact O-OG1 3.05Å; L555-T557 PolarHBondContact O-N 3.02Å; T557-M559 PolarHBondContact O-N 2.8Å; T557-E560 PolarHBondContact O-N 3.32Å; T557-L561 PolarHBondContact O-N 2.88Å; T557-M630 HydrophobicContact CG2-CB 3.95Å; T557-K631 HydrophobicContact CG2-CB 4.39Å
558	G	89.6	Confident	86.2	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-62.1	-41.2	173.9	0	0	0	0	0	113.1	V52 L554 L555 G556 E560 L561 L562	V52-G558 WeakPolarHBondContact CG1-O 3.4Å; L554-G558 PolarHBondContact O-N 3.06Å; L555-G558 PolarHBondContact O-N 3.03Å; G556-G558 PolarHBondContact O-N 3.42Å; G558-E560 VanDerWaalsContact C-N 3.35Å; G558-L561 WeakPolarHBondContact O-CB 3.49Å; G558-L561 PolarHBondContact O-N 3.4Å; G558-L562 PolarHBondContact O-N 3.3Å; G558-L562 VanDerWaalsContact O-N 3.09Å
559	M	86.5	Confident	86	Confident	65 Å²	65	34 Å²	34	32%	0.32	20%	0.199	S	C	.	.	H	α-helix	trans	-68.8	-33.9	176.3	-63.5	-46.6	-74.4	0	0	112.3	V52 L555 G556 T557 L562 R563 L564	V52-M559 HydrophobicContact CG2-SD 4.06Å; L555-M559 VanDerWaalsContact O-CG 3.22Å; L555-M559 WeakPolarHBondContact O-CG 3.4Å; L555-M559 PolarHBondContact O-N 2.81Å; G556-M559 PolarHBondContact O-N 2.73Å; T557-M559 PolarHBondContact O-N 2.8Å; M559-L562 HydrophobicContact SD-CD1 4.3Å; M559-R563 PolarHBondContact O-N 2.67Å; M559-L564 HydrophobicContact CE-CB 3.61Å; M559-L564 HydrophobicContact CE-CD1 3.87Å; M559-L564 HydrophobicContact CE-CD2 3.06Å; M559-L564 HydrophobicContact CE-CG 3.62Å; M559-L564 PolarHBondContact O-N 3.33Å
560	E	87	Confident	85.5	Confident	48 Å²	48	35.3 Å²	35.3	22%	0.224	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-39.3	172.8	-73.7	175.9	-174	0	0	112	G556 T557 G558 R563 K631 T634 N638	G556-E560 WeakPolarHBondContact O-CG 3.35Å; G556-E560 PolarHBondContact O-N 3.25Å; G556-E560 VanDerWaalsContact O-N 3.08Å; T557-E560 PolarHBondContact O-N 3.32Å; G558-E560 VanDerWaalsContact C-N 3.35Å; E560-R563 WeakPolarHBondContact O-CG 3.32Å; E560-R563 PolarHBondContact O-N 2.95Å; E560-K631 IonicContact OE1-NZ 3.25Å; E560-K631 WeakPolarHBondContact OE2-CD 3.41Å; E560-K631 WeakPolarHBondContact OE2-CE 3.38Å; E560-K631 IonicContact OE2-NZ 3.04Å; E560-K631 PolarHBondContact OE2-NZ 2.81Å; E560-T634 HydrophobicContact CB-CG2 4.26Å; E560-N638 PolarHBondContact O-ND2 3.04Å
561	L	86.9	Confident	85.2	Confident	2 Å²	2	38 Å²	38	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-45.6	173.4	-174	68.4	0	0	0	111.5	L53 Y56 W109 T557 G558 R563 T634 Y637	L53-L561 HydrophobicContact CD2-CD2 3.64Å; Y56-L561 HydrophobicContact CD1-CD2 3.86Å; Y56-L561 HydrophobicContact CD1-CG 4.26Å; Y56-L561 HydrophobicContact CD2-CG 4.13Å; Y56-L561 HydrophobicContact CE1-CD1 4.49Å; Y56-L561 HydrophobicContact CE1-CD2 4.06Å; Y56-L561 HydrophobicContact CE1-CG 4.2Å; Y56-L561 HydrophobicContact CE2-CG 4.08Å; Y56-L561 HydrophobicContact CG-CD2 4.1Å; Y56-L561 HydrophobicContact CG-CG 4.23Å; W109-L561 HydrophobicContact CD2-CD2 4.48Å; W109-L561 HydrophobicContact CE3-CD1 4.24Å; W109-L561 HydrophobicContact CE3-CD2 4.13Å; W109-L561 HydrophobicContact CH2-CD2 3.51Å; W109-L561 HydrophobicContact CZ2-CD2 3.91Å; W109-L561 HydrophobicContact CZ3-CD1 4.1Å; W109-L561 HydrophobicContact CZ3-CD2 3.63Å; T557-L561 PolarHBondContact O-N 2.88Å; G558-L561 WeakPolarHBondContact O-CB 3.49Å; G558-L561 PolarHBondContact O-N 3.4Å; L561-R563 PolarHBondContact O-N 3.16Å; L561-T634 HydrophobicContact CB-CG2 3.9Å; L561-T634 HydrophobicContact CD1-CG2 4.22Å; L561-Y637 HydrophobicContact CD1-CD1 3.82Å; L561-Y637 HydrophobicContact CD1-CE1 4.43Å
562	L	83.8	Confident	84.9	Confident	15 Å²	15	38 Å²	38	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-20.5	173.5	-81.2	172.6	0	0	0	113.5	V52 V55 Y56 L59 G558 M559 L564	V52-L562 HydrophobicContact CB-CD1 4.37Å; V52-L562 HydrophobicContact CG1-CD1 3.6Å; V52-L562 HydrophobicContact CG1-CG 4.08Å; V52-L562 HydrophobicContact CG2-CD1 4.36Å; V55-L562 HydrophobicContact CG1-CD2 4.27Å; Y56-L562 VanDerWaalsContact CA-CD2 3.49Å; Y56-L562 HydrophobicContact CD2-CD2 4.01Å; Y56-L562 HydrophobicContact CG-CD2 4.3Å; L59-L562 HydrophobicContact CD1-CD2 4.03Å; G558-L562 PolarHBondContact O-N 3.3Å; G558-L562 VanDerWaalsContact O-N 3.09Å; M559-L562 HydrophobicContact SD-CD1 4.3Å; L562-L564 VanDerWaalsContact C-N 3.25Å; L562-L564 PolarHBondContact O-N 3.25Å
563	R	84.6	Confident	84.6	Confident	36 Å²	36	44.1 Å²	44.1	14%	0.136	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	46	-168.1	-55.1	177.6	-74.2	166.7	-4.2	111.1	Y66 M559 E560 L561 G565 S566 L567 S642	Y66-R563 PolarHBondContact O-NH2 3.33Å; Y66-R563 VanDerWaalsContact O-NH2 3.11Å; M559-R563 PolarHBondContact O-N 2.67Å; E560-R563 WeakPolarHBondContact O-CG 3.32Å; E560-R563 PolarHBondContact O-N 2.95Å; L561-R563 PolarHBondContact O-N 3.16Å; R563-G565 VanDerWaalsContact C-N 3.26Å; R563-G565 PolarHBondContact O-N 3.41Å; R563-G565 VanDerWaalsContact O-N 3.09Å; R563-S566 VanDerWaalsContact CB-OG 3.32Å; R563-S566 WeakPolarHBondContact CB-OG 3.13Å; R563-S566 PolarHBondContact O-N 3.09Å; R563-S566 PolarHBondContact O-OG 3.37Å; R563-L567 PolarHBondContact O-N 3.42Å; R563-S642 VanDerWaalsContact CZ-OG 3.24Å; R563-S642 VanDerWaalsContact NH1-CB 3.31Å; R563-S642 PolarHBondContact NH1-OG 2.87Å
564	L	81.4	Confident	84	Confident	83 Å²	83	46.2 Å²	46.2	44%	0.435	25%	0.253	S	S	.	.	H	α-helix	trans	-52.9	-41.7	-168.7	-170	81.6	0	0	0	112.9	M559 L562 S566 L567 F568	M559-L564 HydrophobicContact CE-CB 3.61Å; M559-L564 HydrophobicContact CE-CD1 3.87Å; M559-L564 HydrophobicContact CE-CD2 3.06Å; M559-L564 HydrophobicContact CE-CG 3.62Å; M559-L564 PolarHBondContact O-N 3.33Å; L562-L564 VanDerWaalsContact C-N 3.25Å; L562-L564 PolarHBondContact O-N 3.25Å; L564-S566 PolarHBondContact O-N 3.47Å; L564-L567 PolarHBondContact O-N 3.22Å; L564-F568 WeakPolarHBondContact O-CB 3.5Å; L564-F568 PolarHBondContact O-N 2.97Å
565	G	78.6	Confident	83.5	Confident	53 Å²	53	51.9 Å²	51.9	55%	0.546	28%	0.277	S	S	.	.	H	α-helix	trans	-61.1	-41.3	179.5	0	0	0	0	0	113.5	R563 C569	R563-G565 VanDerWaalsContact C-N 3.26Å; R563-G565 PolarHBondContact O-N 3.41Å; R563-G565 VanDerWaalsContact O-N 3.09Å; G565-C569 PolarHBondContact O-N 3.3Å; G565-C569 PolarHBondContact O-SG 3.35Å
566	S	79.1	Confident	83.1	Confident	25 Å²	25	54.6 Å²	54.6	18%	0.175	29%	0.288	C	S	.	.	H	α-helix	trans	-74.1	-36.5	176.4	67.9	0	0	0	0	111.4	Y66 R563 L564 F568 C569 Y570	Y66-S566 PolarHBondContact OH-O 3.39Å; Y66-S566 PolarHBondContact OH-OG 2.96Å; R563-S566 VanDerWaalsContact CB-OG 3.32Å; R563-S566 WeakPolarHBondContact CB-OG 3.13Å; R563-S566 PolarHBondContact O-N 3.09Å; R563-S566 PolarHBondContact O-OG 3.37Å; L564-S566 PolarHBondContact O-N 3.47Å; S566-F568 VanDerWaalsContact C-N 3.33Å; S566-F568 PolarHBondContact O-N 3.22Å; S566-C569 PolarHBondContact O-N 3.33Å; S566-Y570 VanDerWaalsContact O-CB 3.26Å; S566-Y570 WeakPolarHBondContact O-CB 3.34Å; S566-Y570 PolarHBondContact O-N 3.15Å
567	L	80.8	Confident	82.6	Confident	29 Å²	29	53.4 Å²	53.4	15%	0.152	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-39.8	177.8	-173.9	70.5	0	0	0	111.3	L59 Y66 R563 L564 Y570 S571	L59-L567 HydrophobicContact CD1-CD2 3.87Å; Y66-L567 HydrophobicContact CD1-CD1 4.05Å; Y66-L567 HydrophobicContact CD2-CD1 4.1Å; Y66-L567 HydrophobicContact CE1-CB 4.36Å; Y66-L567 HydrophobicContact CE1-CD1 3.79Å; Y66-L567 HydrophobicContact CE2-CD1 3.86Å; Y66-L567 HydrophobicContact CG-CD1 4.21Å; Y66-L567 WeakPolarHBondContact OH-CA 3.38Å; Y66-L567 PolarHBondContact OH-N 2.01Å; R563-L567 PolarHBondContact O-N 3.42Å; L564-L567 PolarHBondContact O-N 3.22Å; L567-Y570 PolarHBondContact O-N 2.53Å; L567-S571 VanDerWaalsContact O-CB 3.29Å; L567-S571 WeakPolarHBondContact O-CB 3.16Å; L567-S571 PolarHBondContact O-N 3.23Å; L567-S571 PolarHBondContact O-OG 3.4Å
568	F	82.8	Confident	81.7	Confident	145 Å²	145	59.1 Å²	59.1	64%	0.636	30%	0.297	S	S	*	.	H	α-helix	trans	-63.7	-48.2	175.2	179.9	-99.9	0	0	0	111.5	L564 S566 Y570 S571 T572	L564-F568 WeakPolarHBondContact O-CB 3.5Å; L564-F568 PolarHBondContact O-N 2.97Å; S566-F568 VanDerWaalsContact C-N 3.33Å; S566-F568 PolarHBondContact O-N 3.22Å; F568-Y570 VanDerWaalsContact C-N 3.33Å; F568-Y570 PolarHBondContact O-N 3.44Å; F568-S571 PolarHBondContact O-N 2.99Å; F568-T572 WeakPolarHBondContact O-CB 3.39Å; F568-T572 PolarHBondContact O-N 3.04Å; F568-T572 PolarHBondContact O-OG1 2.71Å
569	C	81	Confident	80.9	Confident	65 Å²	65	59.3 Å²	59.3	44%	0.439	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-42.4	176.7	-67.7	0	0	0	0	111.7	G565 S566 T572 R573	G565-C569 PolarHBondContact O-N 3.3Å; G565-C569 PolarHBondContact O-SG 3.35Å; S566-C569 PolarHBondContact O-N 3.33Å; C569-T572 PolarHBondContact O-N 3.34Å; C569-R573 WeakPolarHBondContact O-CB 3.46Å; C569-R573 VanDerWaalsContact O-CG 3.3Å; C569-R573 WeakPolarHBondContact O-CG 3.33Å; C569-R573 PolarHBondContact O-N 3.5Å
570	Y	79.4	Confident	80.4	Confident	26 Å²	26	59.9 Å²	59.9	10%	0.102	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-49.9	176.7	172.1	-100.3	0	0	0	112.2	Y66 S566 L567 F568 T572 R573 L574 I586 R587 Q590	Y66-Y570 AromaticContact CD2-CD1 3.71Å; Y66-Y570 HydrophobicContact CD2-CD1 3.71Å; Y66-Y570 HydrophobicContact CD2-CD2 4.39Å; Y66-Y570 AromaticContact CD2-CE1 3.77Å; Y66-Y570 HydrophobicContact CD2-CE1 3.77Å; Y66-Y570 HydrophobicContact CD2-CE2 4.43Å; Y66-Y570 HydrophobicContact CD2-CG 4.05Å; Y66-Y570 AromaticContact CE2-CD1 3.46Å; Y66-Y570 HydrophobicContact CE2-CD1 3.46Å; Y66-Y570 VanDerWaalsContact CE2-CD1 3.46Å; Y66-Y570 AromaticContact CE2-CD2 3.97Å; Y66-Y570 HydrophobicContact CE2-CD2 3.97Å; Y66-Y570 HydrophobicContact CE2-CE1 4.02Å; Y66-Y570 HydrophobicContact CE2-CE2 4.46Å; Y66-Y570 AromaticContact CE2-CG 3.45Å; Y66-Y570 HydrophobicContact CE2-CG 3.45Å; Y66-Y570 VanDerWaalsContact CE2-CG 3.45Å; S566-Y570 VanDerWaalsContact O-CB 3.26Å; S566-Y570 WeakPolarHBondContact O-CB 3.34Å; S566-Y570 PolarHBondContact O-N 3.15Å; L567-Y570 PolarHBondContact O-N 2.53Å; F568-Y570 VanDerWaalsContact C-N 3.33Å; F568-Y570 PolarHBondContact O-N 3.44Å; Y570-T572 VanDerWaalsContact C-N 3.27Å; Y570-T572 PolarHBondContact O-N 3.41Å; Y570-R573 PolarHBondContact O-N 2.96Å; Y570-L574 HydrophobicContact CE1-CD2 4.12Å; Y570-L574 VanDerWaalsContact O-CB 3.31Å; Y570-L574 WeakPolarHBondContact O-CB 3.48Å; Y570-L574 PolarHBondContact O-N 3.36Å; Y570-I586 HydrophobicContact CD2-CG2 3.75Å; Y570-I586 HydrophobicContact CE2-CG2 3.79Å; Y570-R587 HydrophobicContact CE2-CG 4.27Å; Y570-R587 WeakPolarHBondContact OH-CG 3.49Å; Y570-Q590 HydrophobicContact CD2-CG 4.18Å
571	S	81.7	Confident	79.7	Confident	58 Å²	58	58 Å²	58	41%	0.406	29%	0.292	S	S	.	.	H	α-helix	trans	-61	-40.2	179.4	-57.6	0	0	0	0	110.9	L567 F568 L574 F575	L567-S571 VanDerWaalsContact O-CB 3.29Å; L567-S571 WeakPolarHBondContact O-CB 3.16Å; L567-S571 PolarHBondContact O-N 3.23Å; L567-S571 PolarHBondContact O-OG 3.4Å; F568-S571 PolarHBondContact O-N 2.99Å; S571-L574 PolarHBondContact O-N 3.48Å; S571-F575 VanDerWaalsContact O-CB 3.24Å; S571-F575 WeakPolarHBondContact O-CB 3.34Å; S571-F575 PolarHBondContact O-N 3.16Å
572	T	82	Confident	79.1	Confident	51 Å²	51	60 Å²	60	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-49.4	175.1	-56.6	0	0	0	0	111.2	F568 C569 Y570 L574 F575 F576	F568-T572 WeakPolarHBondContact O-CB 3.39Å; F568-T572 PolarHBondContact O-N 3.04Å; F568-T572 PolarHBondContact O-OG1 2.71Å; C569-T572 PolarHBondContact O-N 3.34Å; Y570-T572 VanDerWaalsContact C-N 3.27Å; Y570-T572 PolarHBondContact O-N 3.41Å; T572-L574 VanDerWaalsContact C-N 3.33Å; T572-L574 PolarHBondContact O-N 2.78Å; T572-F575 PolarHBondContact O-N 3.24Å; T572-F576 HydrophobicContact CG2-CD2 3.75Å; T572-F576 HydrophobicContact CG2-CE2 3.73Å; T572-F576 WeakPolarHBondContact O-CD2 3.47Å; T572-F576 PolarHBondContact O-N 3.08Å
573	R	82.4	Confident	78.8	Confident	147 Å²	147	63.1 Å²	63.1	56%	0.555	31%	0.311	S	S	*	.	H	α-helix	trans	-61.5	-41.1	176.8	-72.9	176.6	-173.8	-177.3	1.3	112	C569 Y570 F575 F576 S577 I586	C569-R573 WeakPolarHBondContact O-CB 3.46Å; C569-R573 VanDerWaalsContact O-CG 3.3Å; C569-R573 WeakPolarHBondContact O-CG 3.33Å; C569-R573 PolarHBondContact O-N 3.5Å; Y570-R573 PolarHBondContact O-N 2.96Å; R573-F575 VanDerWaalsContact C-N 3.34Å; R573-F576 CarbonylContact O-C 3.53Å; R573-F576 PolarHBondContact O-N 2.95Å; R573-S577 PolarHBondContact O-N 3.3Å; R573-I586 HydrophobicContact CB-CD1 4.11Å; R573-I586 HydrophobicContact CB-CG1 4.48Å; R573-I586 HydrophobicContact CB-CG2 4.19Å
574	L	80.1	Confident	78.1	Confident	43 Å²	43	64.7 Å²	64.7	23%	0.225	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-39.2	178.5	-168.8	70.8	0	0	0	111.4	Y570 S571 T572 S577 R583	Y570-L574 HydrophobicContact CE1-CD2 4.12Å; Y570-L574 VanDerWaalsContact O-CB 3.31Å; Y570-L574 WeakPolarHBondContact O-CB 3.48Å; Y570-L574 PolarHBondContact O-N 3.36Å; S571-L574 PolarHBondContact O-N 3.48Å; T572-L574 VanDerWaalsContact C-N 3.33Å; T572-L574 PolarHBondContact O-N 2.78Å; L574-S577 WeakPolarHBondContact O-CB 3.45Å; L574-S577 PolarHBondContact O-N 3.26Å; L574-S577 PolarHBondContact O-OG 2.98Å; L574-R583 HydrophobicContact CD1-CB 3.91Å; L574-R583 HydrophobicContact CD1-CG 3.73Å
575	F	80.3	Confident	77.7	Confident	130 Å²	130	61.8 Å²	61.8	57%	0.57	31%	0.31	S	S	*	.	H	α-helix	trans	-65.2	-39.8	176.5	-173.2	-100	0	0	0	112.2	L299 S571 T572 R573	L299-F575 HydrophobicContact CD1-CE1 4.32Å; L299-F575 HydrophobicContact CD2-CE1 3.88Å; L299-F575 HydrophobicContact CD2-CZ 4.02Å; L299-F575 HydrophobicContact CG-CE1 4.19Å; L299-F575 HydrophobicContact CG-CZ 4.46Å; S571-F575 VanDerWaalsContact O-CB 3.24Å; S571-F575 WeakPolarHBondContact O-CB 3.34Å; S571-F575 PolarHBondContact O-N 3.16Å; T572-F575 PolarHBondContact O-N 3.24Å; R573-F575 VanDerWaalsContact C-N 3.34Å
576	F	78.8	Confident	77.5	Confident	97 Å²	97	60.1 Å²	60.1	43%	0.425	29%	0.288	S	S	.	.	H	α-helix	trans	-86.6	0.7	177	-69.8	-66.9	0	0	0	115.1	L299 T572 R573	L299-F576 HydrophobicContact CD1-CD1 4.2Å; L299-F576 HydrophobicContact CD1-CE1 3.76Å; T572-F576 HydrophobicContact CG2-CD2 3.75Å; T572-F576 HydrophobicContact CG2-CE2 3.73Å; T572-F576 WeakPolarHBondContact O-CD2 3.47Å; T572-F576 PolarHBondContact O-N 3.08Å; R573-F576 CarbonylContact O-C 3.53Å; R573-F576 PolarHBondContact O-N 2.95Å
577	S	78	Confident	77.2	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.014	30%	0.296	C	S	.	.			trans	-61.9	136.9	177.7	63.8	0	0	0	0	111.8	R298 R573 L574 R583	R298-S577 PolarHBondContact NH1-O 2.98Å; R298-S577 PolarHBondContact NH1-OG 3.45Å; R573-S577 PolarHBondContact O-N 3.3Å; L574-S577 WeakPolarHBondContact O-CB 3.45Å; L574-S577 PolarHBondContact O-N 3.26Å; L574-S577 PolarHBondContact O-OG 2.98Å; S577-R583 WeakPolarHBondContact OG-CG 3.13Å; S577-R583 PolarHBondContact OG-NE 2.95Å
578	R	71.2	Confident	76.5	Confident	121 Å²	121	64.1 Å²	64.1	46%	0.457	30%	0.299	S	S	.	.			trans	-87.3	-39	-175.7	-56.4	171.6	-176.1	-175	2.6	111.8	I293 E582	I293-R578 WeakPolarHBondContact O-CD 3.46Å; R578-E582 WeakPolarHBondContact CA-OE2 3.42Å; R578-E582 VanDerWaalsContact CB-OE2 3.28Å; R578-E582 WeakPolarHBondContact CB-OE2 3.43Å; R578-E582 PolarHBondContact N-OE2 3.09Å
579	S	73.2	Confident	75.8	Confident	4 Å²	4	61 Å²	61	3%	0.028	29%	0.289	C	S	.	.	S	Bend	trans	-131.7	165.2	-171.3	72.9	0	0	0	0	112.8	Y279 Y317 E582 R583	Y279-S579 WeakPolarHBondContact OH-CB 3.38Å; Y317-S579 WeakPolarHBondContact OH-CB 3.23Å; Y317-S579 PolarHBondContact OH-OG 2.92Å; S579-E582 PolarHBondContact O-N 2.71Å; S579-E582 WeakPolarHBondContact OG-CB 3.43Å; S579-E582 PolarHBondContact OG-N 3.09Å; S579-R583 PolarHBondContact O-N 3.13Å
580	E	74.7	Confident	75.1	Confident	78 Å²	78	58.5 Å²	58.5	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-44.4	173.6	-80.3	173.1	-175.2	0	0	112.8	F278 Y279 K282 E582 R583 V584	F278-E580 HydrophobicContact CE1-CB 3.78Å; F278-E580 WeakPolarHBondContact CE1-OE2 3.41Å; F278-E580 HydrophobicContact CZ-CB 3.83Å; F278-E580 WeakPolarHBondContact CZ-OE2 3.45Å; Y279-E580 PolarHBondContact OH-N 2.85Å; K282-E580 VanDerWaalsContact NZ-CD 3.26Å; K282-E580 IonicContact NZ-OE1 3.61Å; K282-E580 PolarHBondContact NZ-OE1 3.22Å; K282-E580 VanDerWaalsContact NZ-OE1 3.13Å; K282-E580 IonicContact NZ-OE2 2.89Å; K282-E580 PolarHBondContact NZ-OE2 2.91Å; E580-E582 PolarHBondContact O-N 2.98Å; E580-R583 WeakPolarHBondContact O-CB 3.47Å; E580-R583 PolarHBondContact O-N 3.44Å; E580-V584 PolarHBondContact O-N 3.42Å; E580-V584 VanDerWaalsContact O-N 3.13Å
581	P	72.1	Confident	74.5	Confident	9 Å²	9	58.4 Å²	58.4	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-57.2	-36.9	173.8	-26.3	32.7	0	0	0	113.5	F278 Y279 R583 V584 N585	F278-P581 HydrophobicContact CB-CB 4.44Å; F278-P581 HydrophobicContact CB-CG 3.84Å; F278-P581 HydrophobicContact CD1-CG 3.45Å; F278-P581 VanDerWaalsContact CD1-CG 3.45Å; F278-P581 HydrophobicContact CE1-CG 4.13Å; F278-P581 HydrophobicContact CG-CG 3.72Å; Y279-P581 HydrophobicContact CD2-CG 3.89Å; Y279-P581 VanDerWaalsContact CE2-CD 3.46Å; Y279-P581 HydrophobicContact CE2-CG 3.41Å; Y279-P581 VanDerWaalsContact CE2-CG 3.41Å; Y279-P581 WeakPolarHBondContact OH-CD 3.37Å; P581-R583 VanDerWaalsContact C-N 3.29Å; P581-R583 PolarHBondContact O-N 2.99Å; P581-V584 PolarHBondContact O-N 3.24Å; P581-N585 WeakPolarHBondContact O-CB 3.22Å; P581-N585 PolarHBondContact O-N 3.44Å
582	E	75.5	Confident	74	Confident	43 Å²	43	58.7 Å²	58.7	20%	0.201	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-37.1	177.7	-168.9	-179.1	174.2	0	0	111.5	R578 S579 E580 N585 I586	R578-E582 WeakPolarHBondContact CA-OE2 3.42Å; R578-E582 VanDerWaalsContact CB-OE2 3.28Å; R578-E582 WeakPolarHBondContact CB-OE2 3.43Å; R578-E582 PolarHBondContact N-OE2 3.09Å; S579-E582 PolarHBondContact O-N 2.71Å; S579-E582 WeakPolarHBondContact OG-CB 3.43Å; S579-E582 PolarHBondContact OG-N 3.09Å; E580-E582 PolarHBondContact O-N 2.98Å; E582-N585 PolarHBondContact O-N 2.9Å; E582-I586 HydrophobicContact CG-CD1 4.04Å; E582-I586 WeakPolarHBondContact O-CB 3.24Å; E582-I586 WeakPolarHBondContact O-CD1 3.48Å; E582-I586 WeakPolarHBondContact O-CG1 3.25Å; E582-I586 PolarHBondContact O-N 3.03Å
583	R	76.3	Confident	73.8	Confident	80 Å²	80	58.2 Å²	58.2	30%	0.302	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-43.2	173.9	-64.1	177.9	162.4	-171.4	-10.2	112.1	R298 L574 S577 S579 E580 P581 N585 I586 R587	R298-R583 VanDerWaalsContact CZ-CZ 3.44Å; R298-R583 VanDerWaalsContact NH1-CZ 3.26Å; R298-R583 VanDerWaalsContact NH1-NE 3.11Å; R298-R583 VanDerWaalsContact NH2-NH2 3.14Å; L574-R583 HydrophobicContact CD1-CB 3.91Å; L574-R583 HydrophobicContact CD1-CG 3.73Å; S577-R583 WeakPolarHBondContact OG-CG 3.13Å; S577-R583 PolarHBondContact OG-NE 2.95Å; S579-R583 PolarHBondContact O-N 3.13Å; E580-R583 WeakPolarHBondContact O-CB 3.47Å; E580-R583 PolarHBondContact O-N 3.44Å; P581-R583 VanDerWaalsContact C-N 3.29Å; P581-R583 PolarHBondContact O-N 2.99Å; R583-N585 VanDerWaalsContact C-N 3.32Å; R583-I586 PolarHBondContact O-N 3.43Å; R583-R587 VanDerWaalsContact O-CG 3.3Å; R583-R587 WeakPolarHBondContact O-CG 3.18Å; R583-R587 PolarHBondContact O-N 3.43Å
584	V	71.6	Confident	73.9	Confident	70 Å²	70	51.7 Å²	51.7	42%	0.424	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-43.3	175.7	178.1	0	0	0	0	110.3	E580 P581 R587 K588	E580-V584 PolarHBondContact O-N 3.42Å; E580-V584 VanDerWaalsContact O-N 3.13Å; P581-V584 PolarHBondContact O-N 3.24Å; V584-R587 WeakPolarHBondContact O-CB 3.35Å; V584-R587 PolarHBondContact O-N 3.14Å; V584-K588 PolarHBondContact O-N 3.29Å
585	N	72.1	Confident	74.2	Confident	22 Å²	22	51 Å²	51	12%	0.118	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-41.5	177	-166.9	63.7	0	0	0	112.5	H271 R274 P581 E582 R583 R587 K588 N589	H271-N585 PolarHBondContact ND1-ND2 3.44Å; R274-N585 PolarHBondContact NH1-OD1 3.35Å; P581-N585 WeakPolarHBondContact O-CB 3.22Å; P581-N585 PolarHBondContact O-N 3.44Å; E582-N585 PolarHBondContact O-N 2.9Å; R583-N585 VanDerWaalsContact C-N 3.32Å; N585-R587 VanDerWaalsContact C-N 3.31Å; N585-R587 PolarHBondContact O-N 2.99Å; N585-K588 PolarHBondContact O-N 3.45Å; N585-N589 PolarHBondContact ND2-ND2 3.38Å; N585-N589 WeakPolarHBondContact O-CB 3.45Å; N585-N589 PolarHBondContact O-N 3.23Å
586	I	75.4	Confident	74.6	Confident	18 Å²	18	45.1 Å²	45.1	9%	0.092	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-40.5	174.6	-69.3	160.6	0	0	0	110.6	Y570 R573 E582 R583	Y570-I586 HydrophobicContact CD2-CG2 3.75Å; Y570-I586 HydrophobicContact CE2-CG2 3.79Å; R573-I586 HydrophobicContact CB-CD1 4.11Å; R573-I586 HydrophobicContact CB-CG1 4.48Å; R573-I586 HydrophobicContact CB-CG2 4.19Å; E582-I586 HydrophobicContact CG-CD1 4.04Å; E582-I586 WeakPolarHBondContact O-CB 3.24Å; E582-I586 WeakPolarHBondContact O-CD1 3.48Å; E582-I586 WeakPolarHBondContact O-CG1 3.25Å; E582-I586 PolarHBondContact O-N 3.03Å; R583-I586 PolarHBondContact O-N 3.43Å
587	R	72.6	Confident	75.1	Confident	89 Å²	89	40.5 Å²	40.5	34%	0.336	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-43.1	175.2	-72.7	169.9	-173.4	171.1	-1.4	111.8	A70 Y570 R583 V584 N585 Q590	A70-R587 WeakPolarHBondContact CB-O 3.49Å; Y570-R587 HydrophobicContact CE2-CG 4.27Å; Y570-R587 WeakPolarHBondContact OH-CG 3.49Å; R583-R587 VanDerWaalsContact O-CG 3.3Å; R583-R587 WeakPolarHBondContact O-CG 3.18Å; R583-R587 PolarHBondContact O-N 3.43Å; V584-R587 WeakPolarHBondContact O-CB 3.35Å; V584-R587 PolarHBondContact O-N 3.14Å; N585-R587 VanDerWaalsContact C-N 3.31Å; N585-R587 PolarHBondContact O-N 2.99Å; R587-Q590 WeakPolarHBondContact O-CB 3.25Å
588	K	66.3	Low	75.5	Confident	48 Å²	48	44 Å²	44	21%	0.209	21%	0.205	C	C	.	.	H	α-helix	trans	-68.6	-41.5	179.4	-175.6	170.3	175.6	145.8	0	112.8	A70 I73 V584 N585 Q590	A70-K588 WeakPolarHBondContact CB-O 3.42Å; I73-K588 HydrophobicContact CG2-CD 3.62Å; I73-K588 HydrophobicContact CG2-CG 3.88Å; V584-K588 PolarHBondContact O-N 3.29Å; N585-K588 PolarHBondContact O-N 3.45Å; K588-Q590 PolarHBondContact O-N 3.4Å; K588-Q590 VanDerWaalsContact O-N 3.1Å
589	N	67.1	Low	76.4	Confident	81 Å²	81	38.7 Å²	38.7	43%	0.433	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	14.2	-178.7	-71.8	-2.4	0	0	0	113.8	N585	N585-N589 PolarHBondContact ND2-ND2 3.38Å; N585-N589 WeakPolarHBondContact O-CB 3.45Å; N585-N589 PolarHBondContact O-N 3.23Å
590	Q	65.9	Low	77.3	Confident	12 Å²	12	38.5 Å²	38.5	6%	0.056	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-7.5	-177.1	-163.6	61	9.5	0	0	113.7	Y66 A70 Y570 R587 K588 I592	Y66-Q590 HydrophobicContact CE2-CG 3.95Å; Y66-Q590 PolarHBondContact OH-NE2 3.4Å; A70-Q590 HydrophobicContact CB-CB 4.38Å; Y570-Q590 HydrophobicContact CD2-CG 4.18Å; R587-Q590 WeakPolarHBondContact O-CB 3.25Å; K588-Q590 PolarHBondContact O-N 3.4Å; K588-Q590 VanDerWaalsContact O-N 3.1Å; Q590-I592 PolarHBondContact O-N 3.01Å
591	A	66.5	Low	78.1	Confident	24 Å²	24	34.8 Å²	34.8	20%	0.198	17%	0.167	C	C	.	.			trans	-66.3	107.2	172.3	0	0	0	0	0	109.3	A70 L71	A70-A591 HydrophobicContact CB-CB 3.94Å; L71-A591 HydrophobicContact CD2-CB 4.03Å
592	I	71.4	Confident	78.9	Confident	63 Å²	63	37 Å²	37	32%	0.323	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	145.4	179.6	-62.3	164.9	0	0	0	108.5	Q590 F643 A644	Q590-I592 PolarHBondContact O-N 3.01Å; I592-F643 HydrophobicContact CB-CD1 4.44Å; I592-F643 HydrophobicContact CB-CE1 4.39Å; I592-F643 HydrophobicContact CG2-CE1 4.3Å; I592-F643 WeakPolarHBondContact O-CA 3.28Å; I592-F643 WeakPolarHBondContact O-CD1 3.16Å; I592-A644 PolarHBondContact O-N 3.32Å; I592-A644 VanDerWaalsContact O-N 3.11Å
593	D	78.9	Confident	79.8	Confident	42 Å²	42	35 Å²	35	23%	0.225	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	136.6	169.9	-78	-6	0	0	0	110.7	R483 Q595 T646	R483-D593 IonicContact CZ-OD2 2.74Å; R483-D593 IonicContact NH1-OD2 3.82Å; R483-D593 PolarHBondContact NH1-OD2 3.28Å; D593-Q595 PolarHBondContact O-N 3.11Å; D593-Q595 VanDerWaalsContact O-N 3.14Å; D593-Q595 PolarHBondContact O-NE2 2.67Å; D593-Q595 VanDerWaalsContact O-NE2 3.15Å; D593-T646 HydrophobicContact CB-CG2 3.46Å; D593-T646 VanDerWaalsContact CB-CG2 3.46Å
594	F	84.9	Confident	80.6	Confident	9 Å²	9	31.1 Å²	31.1	4%	0.039	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-62.7	118.3	174.2	-172	-106.2	0	0	0	110.7	Y132 F596 E599 M639 F643	Y132-F594 HydrophobicContact CD1-CE1 4.36Å; Y132-F594 HydrophobicContact CE1-CE1 4.16Å; Y132-F594 HydrophobicContact CE1-CZ 4.01Å; F594-F596 VanDerWaalsContact C-N 3.34Å; F594-F596 HydrophobicContact CB-CE2 4.37Å; F594-F596 AromaticContact CD1-CD1 3.74Å; F594-F596 HydrophobicContact CD1-CD1 3.74Å; F594-F596 AromaticContact CD1-CD2 3.7Å; F594-F596 HydrophobicContact CD1-CD2 3.7Å; F594-F596 AromaticContact CD1-CE1 3.68Å; F594-F596 HydrophobicContact CD1-CE1 3.68Å; F594-F596 AromaticContact CD1-CE2 3.67Å; F594-F596 HydrophobicContact CD1-CE2 3.67Å; F594-F596 AromaticContact CD1-CG 3.76Å; F594-F596 HydrophobicContact CD1-CG 3.76Å; F594-F596 AromaticContact CD1-CZ 3.67Å; F594-F596 HydrophobicContact CD1-CZ 3.67Å; F594-F596 AromaticContact CE1-CD1 3.7Å; F594-F596 HydrophobicContact CE1-CD1 3.7Å; F594-F596 HydrophobicContact CE1-CD2 4.47Å; F594-F596 AromaticContact CE1-CE1 3.77Å; F594-F596 HydrophobicContact CE1-CE1 3.77Å; F594-F596 HydrophobicContact CE1-CG 4.09Å; F594-F596 HydrophobicContact CE1-CZ 4.23Å; F594-F596 WeakPolarHBondContact O-CD2 3.48Å; F594-F596 PolarHBondContact O-N 3.14Å; F594-E599 HydrophobicContact CE1-CB 4.47Å; F594-E599 HydrophobicContact CE1-CG 4.19Å; F594-E599 HydrophobicContact CE2-CG 4Å; F594-E599 HydrophobicContact CZ-CB 4.12Å; F594-E599 HydrophobicContact CZ-CG 3.64Å; F594-M639 HydrophobicContact CD1-CG 4.34Å; F594-M639 HydrophobicContact CD1-SD 4.32Å; F594-M639 HydrophobicContact CD2-CG 3.71Å; F594-M639 HydrophobicContact CE1-CE 4.49Å; F594-M639 HydrophobicContact CE1-CG 4.26Å; F594-M639 HydrophobicContact CE1-SD 3.87Å; F594-M639 HydrophobicContact CE2-CG 3.6Å; F594-M639 HydrophobicContact CE2-SD 4.11Å; F594-M639 HydrophobicContact CG-CG 4.07Å; F594-M639 HydrophobicContact CZ-CG 3.88Å; F594-M639 HydrophobicContact CZ-SD 3.73Å; F594-F643 HydrophobicContact CB-CB 3.94Å; F594-F643 HydrophobicContact CB-CD1 4.3Å; F594-F643 HydrophobicContact CB-CD2 4.46Å; F594-F643 HydrophobicContact CB-CG 4.01Å; F594-F643 HydrophobicContact CD2-CD1 4.39Å; F594-F643 AromaticContact CD2-CD2 3.5Å; F594-F643 HydrophobicContact CD2-CD2 3.5Å; F594-F643 AromaticContact CD2-CE2 3.64Å; F594-F643 HydrophobicContact CD2-CE2 3.64Å; F594-F643 AromaticContact CD2-CG 3.9Å; F594-F643 HydrophobicContact CD2-CG 3.9Å; F594-F643 HydrophobicContact CD2-CZ 4.2Å; F594-F643 HydrophobicContact CE2-CD2 4.25Å; F594-F643 HydrophobicContact CE2-CE2 4.09Å; F594-F643 HydrophobicContact CG-CD2 4.44Å; F594-F643 HydrophobicContact CG-CG 4.46Å
595	Q	86.1	Confident	81.5	Confident	30 Å²	30	27.9 Å²	27.9	14%	0.14	13%	0.13	C	C	.	.			trans	-85.5	73.3	-174.7	-62.3	-62.1	-47.8	0	0	111	M490 D593 G597 R598 E599	M490-Q595 HydrophobicContact CE-CB 4.44Å; D593-Q595 PolarHBondContact O-N 3.11Å; D593-Q595 VanDerWaalsContact O-N 3.14Å; D593-Q595 PolarHBondContact O-NE2 2.67Å; D593-Q595 VanDerWaalsContact O-NE2 3.15Å; Q595-G597 PolarHBondContact O-N 3.39Å; Q595-R598 HydrophobicContact CB-CB 4.2Å; Q595-R598 PolarHBondContact O-N 3.28Å; Q595-E599 PolarHBondContact O-N 2.95Å
596	F	88.6	Confident	82.5	Confident	6 Å²	6	27 Å²	27	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-46.5	-40.8	-179.7	-76	-83.1	0	0	0	112.8	D128 Y132 F594 R598 E599 Y600 M639 T646 L648	D128-F596 HydrophobicContact CB-CE2 4.25Å; D128-F596 HydrophobicContact CB-CZ 3.96Å; Y132-F596 AromaticContact CD2-CD1 3.83Å; Y132-F596 HydrophobicContact CD2-CD1 3.83Å; Y132-F596 HydrophobicContact CD2-CE1 4.17Å; Y132-F596 HydrophobicContact CG-CD1 4.02Å; Y132-F596 AromaticContact CG-CE1 3.86Å; Y132-F596 HydrophobicContact CG-CE1 3.86Å; F594-F596 VanDerWaalsContact C-N 3.34Å; F594-F596 HydrophobicContact CB-CE2 4.37Å; F594-F596 AromaticContact CD1-CD1 3.74Å; F594-F596 HydrophobicContact CD1-CD1 3.74Å; F594-F596 AromaticContact CD1-CD2 3.7Å; F594-F596 HydrophobicContact CD1-CD2 3.7Å; F594-F596 AromaticContact CD1-CE1 3.68Å; F594-F596 HydrophobicContact CD1-CE1 3.68Å; F594-F596 AromaticContact CD1-CE2 3.67Å; F594-F596 HydrophobicContact CD1-CE2 3.67Å; F594-F596 AromaticContact CD1-CG 3.76Å; F594-F596 HydrophobicContact CD1-CG 3.76Å; F594-F596 AromaticContact CD1-CZ 3.67Å; F594-F596 HydrophobicContact CD1-CZ 3.67Å; F594-F596 AromaticContact CE1-CD1 3.7Å; F594-F596 HydrophobicContact CE1-CD1 3.7Å; F594-F596 HydrophobicContact CE1-CD2 4.47Å; F594-F596 AromaticContact CE1-CE1 3.77Å; F594-F596 HydrophobicContact CE1-CE1 3.77Å; F594-F596 HydrophobicContact CE1-CG 4.09Å; F594-F596 HydrophobicContact CE1-CZ 4.23Å; F594-F596 WeakPolarHBondContact O-CD2 3.48Å; F594-F596 PolarHBondContact O-N 3.14Å; F596-R598 VanDerWaalsContact C-N 3.3Å; F596-R598 PolarHBondContact O-N 3.27Å; F596-E599 PolarHBondContact O-N 3.22Å; F596-Y600 HydrophobicContact CB-CD2 4.28Å; F596-Y600 HydrophobicContact CB-CE2 4.41Å; F596-Y600 HydrophobicContact CD1-CE2 4.24Å; F596-Y600 WeakPolarHBondContact O-CB 3.49Å; F596-Y600 WeakPolarHBondContact O-CD2 3.39Å; F596-Y600 PolarHBondContact O-N 3.05Å; F596-M639 HydrophobicContact CE1-CE 4.43Å; F596-M639 HydrophobicContact CZ-CE 4.31Å; F596-T646 WeakPolarHBondContact CE2-OG1 3.46Å; F596-L648 HydrophobicContact CB-CD1 3.92Å; F596-L648 HydrophobicContact CD2-CD1 3.37Å; F596-L648 HydrophobicContact CE2-CD1 4.19Å; F596-L648 HydrophobicContact CG-CD1 3.93Å
597	G	88.4	Confident	83.5	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.7	-28.9	-175.3	0	0	0	0	0	114.9	N487 V491 Q595 A601	N487-G597 PolarHBondContact OD1-N 3.46Å; V491-G597 WeakPolarHBondContact CG2-O 3.49Å; Q595-G597 PolarHBondContact O-N 3.39Å; G597-A601 PolarHBondContact O-N 2.88Å
598	R	87.5	Confident	84.5	Confident	75 Å²	75	22 Å²	22	28%	0.283	11%	0.106	S	C	.	.	H	α-helix	trans	-75.5	-51.3	175.9	-173.9	-175.5	64.4	-162.7	-0.1	109.4	Y472 M490 Q595 F596 Y600 A601 W602	Y472-R598 HydrophobicContact CD2-CB 4.24Å; Y472-R598 HydrophobicContact CD2-CG 4.05Å; Y472-R598 HydrophobicContact CE2-CB 4.11Å; Y472-R598 HydrophobicContact CE2-CG 4.2Å; M490-R598 HydrophobicContact CE-CB 4.19Å; M490-R598 HydrophobicContact SD-CB 4.46Å; Q595-R598 HydrophobicContact CB-CB 4.2Å; Q595-R598 PolarHBondContact O-N 3.28Å; F596-R598 VanDerWaalsContact C-N 3.3Å; F596-R598 PolarHBondContact O-N 3.27Å; R598-Y600 VanDerWaalsContact C-N 3.32Å; R598-Y600 PolarHBondContact O-N 3.08Å; R598-A601 PolarHBondContact O-N 2.85Å; R598-A601 VanDerWaalsContact O-N 3.12Å; R598-W602 HydrophobicContact CB-CZ3 4.33Å; R598-W602 HydrophobicContact CG-CD2 4.42Å; R598-W602 HydrophobicContact CG-CE3 3.59Å; R598-W602 HydrophobicContact CG-CH2 3.93Å; R598-W602 HydrophobicContact CG-CZ3 3.32Å; R598-W602 PolarHBondContact O-N 2.92Å; R598-W602 VanDerWaalsContact O-N 3.14Å
599	E	89.9	Confident	85.6	Confident	9 Å²	9	19.7 Å²	19.7	4%	0.042	10%	0.096	C	C	.	.	H	α-helix	trans	-62.9	-39.4	-175.4	-55.7	-53.5	140.3	0	0	111.9	Y132 F594 Q595 F596 M603 K631	Y132-E599 HydrophobicContact CE2-CB 4.32Å; Y132-E599 WeakPolarHBondContact OH-CB 3.26Å; F594-E599 HydrophobicContact CE1-CB 4.47Å; F594-E599 HydrophobicContact CE1-CG 4.19Å; F594-E599 HydrophobicContact CE2-CG 4Å; F594-E599 HydrophobicContact CZ-CB 4.12Å; F594-E599 HydrophobicContact CZ-CG 3.64Å; Q595-E599 PolarHBondContact O-N 2.95Å; F596-E599 PolarHBondContact O-N 3.22Å; E599-M603 VanDerWaalsContact O-CB 3.29Å; E599-M603 WeakPolarHBondContact O-CB 3.36Å; E599-M603 PolarHBondContact O-N 2.93Å; E599-M603 VanDerWaalsContact O-N 3.1Å; E599-K631 IonicContact OE2-NZ 2.86Å; E599-K631 PolarHBondContact OE2-NZ 3.4Å
600	Y	92.3	Very high	87	Confident	1 Å²	1	16 Å²	16	0%	0.004	8%	0.076	C	C	.	.	H	α-helix	trans	-59.8	-48.1	171.8	-87.5	-57.9	0	0	0	112.9	Y132 F135 F596 R598 W602 M603 M604 I652 H653 A656	Y132-Y600 WeakPolarHBondContact CA-OH 3.46Å; Y132-Y600 HydrophobicContact CD2-CD1 4.19Å; Y132-Y600 HydrophobicContact CD2-CD2 4.14Å; Y132-Y600 AromaticContact CD2-CE1 3.67Å; Y132-Y600 HydrophobicContact CD2-CE1 3.67Å; Y132-Y600 AromaticContact CD2-CE2 3.61Å; Y132-Y600 HydrophobicContact CD2-CE2 3.61Å; Y132-Y600 HydrophobicContact CD2-CG 4.41Å; Y132-Y600 AromaticContact CD2-CZ 3.36Å; Y132-Y600 HydrophobicContact CE2-CD1 4.02Å; Y132-Y600 HydrophobicContact CE2-CD2 4.26Å; Y132-Y600 AromaticContact CE2-CE1 3.94Å; Y132-Y600 HydrophobicContact CE2-CE1 3.94Å; Y132-Y600 HydrophobicContact CE2-CE2 4.18Å; Y132-Y600 HydrophobicContact CE2-CG 4.19Å; F135-Y600 HydrophobicContact CD1-CD1 4.28Å; F135-Y600 AromaticContact CD1-CE1 3.52Å; F135-Y600 HydrophobicContact CD1-CE1 3.52Å; F135-Y600 AromaticContact CE1-CD1 4Å; F135-Y600 HydrophobicContact CE1-CD1 4Å; F135-Y600 AromaticContact CE1-CE1 3.64Å; F135-Y600 HydrophobicContact CE1-CE1 3.64Å; F135-Y600 HydrophobicContact CG-CE1 4.33Å; F596-Y600 HydrophobicContact CB-CD2 4.28Å; F596-Y600 HydrophobicContact CB-CE2 4.41Å; F596-Y600 HydrophobicContact CD1-CE2 4.24Å; F596-Y600 WeakPolarHBondContact O-CB 3.49Å; F596-Y600 WeakPolarHBondContact O-CD2 3.39Å; F596-Y600 PolarHBondContact O-N 3.05Å; R598-Y600 VanDerWaalsContact C-N 3.32Å; R598-Y600 PolarHBondContact O-N 3.08Å; Y600-W602 PolarHBondContact O-N 3.16Å; Y600-M603 HydrophobicContact CD1-CE 3.71Å; Y600-M603 HydrophobicContact CE1-CE 4.08Å; Y600-M603 PolarHBondContact O-N 3.31Å; Y600-M604 WeakPolarHBondContact O-CB 2.99Å; Y600-M604 VanDerWaalsContact O-CG 3.25Å; Y600-M604 WeakPolarHBondContact O-CG 3.48Å; Y600-M604 PolarHBondContact O-N 3.36Å; Y600-I652 HydrophobicContact CD2-CG2 4.17Å; Y600-I652 HydrophobicContact CE2-CG2 4.31Å; Y600-H653 AromaticContact CE2-ND1 3.6Å; Y600-H653 AromaticContact CZ-ND1 3.57Å; Y600-H653 PolarHBondContact OH-ND1 3.5Å; Y600-A656 HydrophobicContact CD1-CB 3.27Å; Y600-A656 HydrophobicContact CD2-CB 4.35Å; Y600-A656 HydrophobicContact CE1-CB 3.42Å; Y600-A656 VanDerWaalsContact CE1-CB 3.42Å; Y600-A656 HydrophobicContact CE2-CB 4.47Å; Y600-A656 HydrophobicContact CG-CB 3.78Å
601	A	91.3	Very high	88.3	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63.3	-43.2	-175.9	0	0	0	0	0	112.6	C494 G597 R598 N605	C494-A601 HydrophobicContact CB-CB 3.51Å; G597-A601 PolarHBondContact O-N 2.88Å; R598-A601 PolarHBondContact O-N 2.85Å; R598-A601 VanDerWaalsContact O-N 3.12Å; A601-N605 WeakPolarHBondContact O-CB 3.02Å; A601-N605 PolarHBondContact O-N 3.26Å
602	W	88.8	Confident	89.5	Confident	54 Å²	54	14.6 Å²	14.6	21%	0.205	7%	0.066	C	C	.	.	H	α-helix	trans	-68	-44.4	178.1	-92.8	-105.4	0	0	0	112.1	P468 C494 L498 R598 Y600 M604 N605 V606	P468-W602 HydrophobicContact CB-CH2 4.23Å; P468-W602 HydrophobicContact CB-CZ2 3.6Å; C494-W602 HydrophobicContact CB-CZ3 4.2Å; L498-W602 HydrophobicContact CD1-CD2 4.04Å; L498-W602 HydrophobicContact CD1-CE3 4.1Å; L498-W602 HydrophobicContact CD1-CG 4.46Å; L498-W602 HydrophobicContact CD1-CZ3 4.45Å; R598-W602 HydrophobicContact CB-CZ3 4.33Å; R598-W602 HydrophobicContact CG-CD2 4.42Å; R598-W602 HydrophobicContact CG-CE3 3.59Å; R598-W602 HydrophobicContact CG-CH2 3.93Å; R598-W602 HydrophobicContact CG-CZ3 3.32Å; R598-W602 PolarHBondContact O-N 2.92Å; R598-W602 VanDerWaalsContact O-N 3.14Å; Y600-W602 PolarHBondContact O-N 3.16Å; W602-M604 PolarHBondContact O-N 3.2Å; W602-N605 PolarHBondContact O-N 3.19Å; W602-V606 PolarHBondContact O-N 2.51Å; W602-V606 VanDerWaalsContact O-N 3.09Å
603	M	93.8	Very high	90.3	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-60.5	-44.8	175.5	-178.6	-177.8	48.1	0	0	111.8	Y132 F135 Q136 L139 E599 Y600 N605 V606 F607 Y627 L628	Y132-M603 HydrophobicContact CE2-CE 4.18Å; F135-M603 HydrophobicContact CD1-CE 3.83Å; F135-M603 HydrophobicContact CE1-CE 3.62Å; Q136-M603 HydrophobicContact CG-CE 4.2Å; Q136-M603 HydrophobicContact CG-SD 3.64Å; L139-M603 HydrophobicContact CD1-SD 4.33Å; E599-M603 VanDerWaalsContact O-CB 3.29Å; E599-M603 WeakPolarHBondContact O-CB 3.36Å; E599-M603 PolarHBondContact O-N 2.93Å; E599-M603 VanDerWaalsContact O-N 3.1Å; Y600-M603 HydrophobicContact CD1-CE 3.71Å; Y600-M603 HydrophobicContact CE1-CE 4.08Å; Y600-M603 PolarHBondContact O-N 3.31Å; M603-N605 VanDerWaalsContact C-N 3.31Å; M603-N605 PolarHBondContact O-N 3.33Å; M603-V606 PolarHBondContact O-N 3.43Å; M603-F607 WeakPolarHBondContact O-CB 3.49Å; M603-F607 PolarHBondContact O-N 2.89Å; M603-Y627 HydrophobicContact CG-CE1 4.42Å; M603-L628 HydrophobicContact CG-CD2 4.1Å; M603-L628 HydrophobicContact SD-CD2 4.44Å
604	M	93.6	Very high	91	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-68.9	-31.8	179.6	-70.3	-55.1	86.5	0	0	112	F135 L139 Y495 Y600 W602 F607 S608 Q659 A660	F135-M604 HydrophobicContact CE1-CE 3.69Å; F135-M604 HydrophobicContact CE1-SD 4.03Å; F135-M604 HydrophobicContact CZ-CE 3.91Å; F135-M604 HydrophobicContact CZ-SD 3.74Å; L139-M604 HydrophobicContact CD1-CE 3.32Å; L139-M604 HydrophobicContact CD1-SD 4.47Å; Y495-M604 HydrophobicContact CD2-CB 3.74Å; Y495-M604 HydrophobicContact CE2-CB 3.75Å; Y600-M604 WeakPolarHBondContact O-CB 2.99Å; Y600-M604 VanDerWaalsContact O-CG 3.25Å; Y600-M604 WeakPolarHBondContact O-CG 3.48Å; Y600-M604 PolarHBondContact O-N 3.36Å; W602-M604 PolarHBondContact O-N 3.2Å; M604-F607 HydrophobicContact CE-CB 4.19Å; M604-F607 HydrophobicContact SD-CD1 4.46Å; M604-S608 WeakPolarHBondContact O-CB 3.34Å; M604-S608 PolarHBondContact O-N 2.94Å; M604-S608 PolarHBondContact O-OG 3.15Å; M604-Q659 HydrophobicContact CG-CB 4.3Å; M604-A660 HydrophobicContact SD-CB 3.93Å
605	N	91	Very high	91.3	Very high	1 Å²	1	10 Å²	10	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-63.8	-50.6	173.5	-177.5	53.1	0	0	0	111.8	L498 Y548 A601 W602 M603 F607 S608 V609	L498-N605 HydrophobicContact CB-CB 4.2Å; L498-N605 HydrophobicContact CD1-CB 4.34Å; Y548-N605 PolarHBondContact OH-ND2 3.13Å; A601-N605 WeakPolarHBondContact O-CB 3.02Å; A601-N605 PolarHBondContact O-N 3.26Å; W602-N605 PolarHBondContact O-N 3.19Å; M603-N605 VanDerWaalsContact C-N 3.31Å; M603-N605 PolarHBondContact O-N 3.33Å; N605-F607 VanDerWaalsContact C-N 3.33Å; N605-F607 PolarHBondContact O-N 3.29Å; N605-S608 WeakPolarHBondContact O-CB 3.42Å; N605-S608 PolarHBondContact O-N 2.85Å; N605-S608 VanDerWaalsContact O-N 3.15Å; N605-V609 WeakPolarHBondContact O-CG2 3.23Å; N605-V609 PolarHBondContact O-N 3.18Å
606	V	92.7	Very high	91.4	Very high	3 Å²	3	9 Å²	9	2%	0.018	4%	0.038	C	C	.	.	H	α-helix	trans	-62.7	-41.6	177	178	0	0	0	0	111	Y548 V549 A552 W602 M603 S608 V609 V610 Y627	Y548-V606 HydrophobicContact CE1-CG2 4.31Å; V549-V606 HydrophobicContact CG1-CG1 4.31Å; V549-V606 HydrophobicContact CG2-CG1 4.28Å; A552-V606 HydrophobicContact CB-CG2 4.32Å; W602-V606 PolarHBondContact O-N 2.51Å; W602-V606 VanDerWaalsContact O-N 3.09Å; M603-V606 PolarHBondContact O-N 3.43Å; V606-S608 VanDerWaalsContact C-N 3.31Å; V606-S608 PolarHBondContact O-N 2.77Å; V606-V609 WeakPolarHBondContact O-CB 3.41Å; V606-V609 PolarHBondContact O-N 3.37Å; V606-V610 WeakPolarHBondContact O-CG2 3.48Å; V606-V610 PolarHBondContact O-N 3.38Å; V606-Y627 HydrophobicContact CB-CD1 4Å; V606-Y627 HydrophobicContact CB-CE1 3.66Å; V606-Y627 HydrophobicContact CB-CE2 4.39Å; V606-Y627 HydrophobicContact CG1-CD1 3.5Å; V606-Y627 VanDerWaalsContact CG1-CD1 3.5Å; V606-Y627 HydrophobicContact CG1-CD2 4.09Å; V606-Y627 HydrophobicContact CG1-CE1 3.72Å; V606-Y627 HydrophobicContact CG1-CE2 4.3Å; V606-Y627 HydrophobicContact CG1-CG 3.71Å; V606-Y627 HydrophobicContact CG2-CE1 4.11Å; V606-Y627 HydrophobicContact CG2-CE2 4.01Å
607	F	95.5	Very high	91.4	Very high	3 Å²	3	8.9 Å²	8.9	1%	0.013	4%	0.037	C	C	.	.	H	α-helix	trans	-58.4	-42.2	173.6	178.6	-109.7	0	0	0	112.2	L139 F142 V143 M603 M604 N605 V610 M611 A660 A663	L139-F607 HydrophobicContact CD2-CD2 4.4Å; L139-F607 HydrophobicContact CD2-CE1 4.27Å; L139-F607 HydrophobicContact CD2-CE2 4.04Å; L139-F607 HydrophobicContact CD2-CZ 3.97Å; F142-F607 AromaticContact CD1-CE2 3.8Å; F142-F607 HydrophobicContact CD1-CE2 3.8Å; F142-F607 AromaticContact CD1-CZ 3.88Å; F142-F607 HydrophobicContact CD1-CZ 3.88Å; F142-F607 AromaticContact CE1-CE2 3.76Å; F142-F607 HydrophobicContact CE1-CE2 3.76Å; F142-F607 AromaticContact CE1-CZ 3.62Å; F142-F607 HydrophobicContact CE1-CZ 3.62Å; V143-F607 HydrophobicContact CG2-CD2 4.17Å; V143-F607 HydrophobicContact CG2-CE2 3.85Å; M603-F607 WeakPolarHBondContact O-CB 3.49Å; M603-F607 PolarHBondContact O-N 2.89Å; M604-F607 HydrophobicContact CE-CB 4.19Å; M604-F607 HydrophobicContact SD-CD1 4.46Å; N605-F607 VanDerWaalsContact C-N 3.33Å; N605-F607 PolarHBondContact O-N 3.29Å; F607-V610 PolarHBondContact O-N 3.43Å; F607-M611 HydrophobicContact CD1-CG 4.32Å; F607-M611 HydrophobicContact CD2-CG 4.31Å; F607-M611 HydrophobicContact CE1-CG 3.86Å; F607-M611 HydrophobicContact CE2-CG 3.84Å; F607-M611 HydrophobicContact CE2-SD 3.97Å; F607-M611 HydrophobicContact CZ-CG 3.59Å; F607-M611 HydrophobicContact CZ-SD 3.98Å; F607-M611 WeakPolarHBondContact O-CG 3.48Å; F607-M611 PolarHBondContact O-N 3.24Å; F607-A660 HydrophobicContact CE1-CB 4.28Å; F607-A663 HydrophobicContact CD1-CB 3.75Å; F607-A663 HydrophobicContact CE1-CB 3.72Å
608	S	93.4	Very high	91.6	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-65.3	-38.3	177.2	-59.3	0	0	0	0	112.7	Y495 M604 N605 V606 M611 A612 A663	Y495-S608 WeakPolarHBondContact CE2-OG 3.38Å; Y495-S608 PolarHBondContact OH-OG 3.45Å; M604-S608 WeakPolarHBondContact O-CB 3.34Å; M604-S608 PolarHBondContact O-N 2.94Å; M604-S608 PolarHBondContact O-OG 3.15Å; N605-S608 WeakPolarHBondContact O-CB 3.42Å; N605-S608 PolarHBondContact O-N 2.85Å; N605-S608 VanDerWaalsContact O-N 3.15Å; V606-S608 VanDerWaalsContact C-N 3.31Å; V606-S608 PolarHBondContact O-N 2.77Å; S608-M611 PolarHBondContact O-N 2.85Å; S608-A612 WeakPolarHBondContact O-CB 3.48Å; S608-A612 PolarHBondContact O-N 3.32Å; S608-A663 WeakPolarHBondContact OG-CB 3.15Å
609	V	90.9	Very high	91.8	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-60.6	-48.3	172.2	171.5	0	0	0	0	110.7	V503 F545 Y548 V549 N605 V606 M611 A612 Y613 I620	V503-V609 HydrophobicContact CG2-CG2 3.43Å; V503-V609 VanDerWaalsContact CG2-CG2 3.43Å; F545-V609 HydrophobicContact CB-CG1 4.09Å; F545-V609 HydrophobicContact CD1-CG1 3.72Å; F545-V609 HydrophobicContact CD1-CG2 4.44Å; F545-V609 HydrophobicContact CG-CG1 4.17Å; Y548-V609 HydrophobicContact CE1-CG2 4.3Å; V549-V609 HydrophobicContact CG2-CG1 4.01Å; N605-V609 WeakPolarHBondContact O-CG2 3.23Å; N605-V609 PolarHBondContact O-N 3.18Å; V606-V609 WeakPolarHBondContact O-CB 3.41Å; V606-V609 PolarHBondContact O-N 3.37Å; V609-M611 VanDerWaalsContact C-N 3.34Å; V609-M611 PolarHBondContact O-N 2.99Å; V609-A612 PolarHBondContact O-N 3.06Å; V609-Y613 HydrophobicContact CG1-CD2 4.5Å; V609-Y613 PolarHBondContact O-N 3.12Å; V609-Y613 VanDerWaalsContact O-N 3.08Å; V609-I620 HydrophobicContact CG1-CD1 3.79Å
610	V	94.8	Very high	91.9	Very high	3 Å²	3	5.9 Å²	5.9	2%	0.018	3%	0.027	C	C	.	.	H	α-helix	trans	-61.1	-44.4	178.9	174.1	0	0	0	0	110.6	V549 V606 F607 S614 I620	V549-V610 HydrophobicContact CG1-CG2 4.39Å; V549-V610 HydrophobicContact CG2-CG2 4.25Å; V606-V610 WeakPolarHBondContact O-CG2 3.48Å; V606-V610 PolarHBondContact O-N 3.38Å; F607-V610 PolarHBondContact O-N 3.43Å; V610-S614 WeakPolarHBondContact O-CA 3.39Å; V610-S614 VanDerWaalsContact O-CB 3.23Å; V610-S614 WeakPolarHBondContact O-CB 3.39Å; V610-S614 PolarHBondContact O-N 3.24Å; V610-I620 HydrophobicContact CG2-CG1 4.49Å
611	M	94.3	Very high	92.1	Very high	4 Å²	4	5.9 Å²	5.9	2%	0.02	3%	0.027	C	C	.	.	H	α-helix	trans	-66.4	-42.7	178	-69.7	-46.4	-60.3	0	0	112.7	F142 I146 Y195 F607 S608 V609 Y613 S614 A663 P664	F142-M611 HydrophobicContact CE1-CE 4Å; F142-M611 HydrophobicContact CE1-SD 3.58Å; F142-M611 VanDerWaalsContact CE1-SD 3.58Å; F142-M611 HydrophobicContact CZ-CE 3.81Å; F142-M611 HydrophobicContact CZ-SD 4.02Å; I146-M611 HydrophobicContact CD1-CE 4.2Å; I146-M611 HydrophobicContact CD1-SD 3.68Å; Y195-M611 HydrophobicContact CD2-CE 4.4Å; F607-M611 HydrophobicContact CD1-CG 4.32Å; F607-M611 HydrophobicContact CD2-CG 4.31Å; F607-M611 HydrophobicContact CE1-CG 3.86Å; F607-M611 HydrophobicContact CE2-CG 3.84Å; F607-M611 HydrophobicContact CE2-SD 3.97Å; F607-M611 HydrophobicContact CZ-CG 3.59Å; F607-M611 HydrophobicContact CZ-SD 3.98Å; F607-M611 WeakPolarHBondContact O-CG 3.48Å; F607-M611 PolarHBondContact O-N 3.24Å; S608-M611 PolarHBondContact O-N 2.85Å; V609-M611 VanDerWaalsContact C-N 3.34Å; V609-M611 PolarHBondContact O-N 2.99Å; M611-Y613 VanDerWaalsContact C-N 3.3Å; M611-Y613 PolarHBondContact O-N 3.38Å; M611-S614 PolarHBondContact O-N 2.96Å; M611-S614 PolarHBondContact O-OG 2.77Å; M611-A663 HydrophobicContact CG-CB 4.47Å; M611-P664 HydrophobicContact CE-CB 4.02Å; M611-P664 HydrophobicContact CE-CG 4.01Å; M611-P664 HydrophobicContact CG-CG 4.44Å
612	A	90.8	Very high	92.3	Very high	2 Å²	2	7.9 Å²	7.9	2%	0.017	4%	0.04	C	C	.	.	H	α-helix	trans	-58.8	-41	178.5	0	0	0	0	0	112.7	S608 V609 L666	S608-A612 WeakPolarHBondContact O-CB 3.48Å; S608-A612 PolarHBondContact O-N 3.32Å; V609-A612 PolarHBondContact O-N 3.06Å; A612-L666 HydrophobicContact CB-CB 4.43Å; A612-L666 HydrophobicContact CB-CD2 3.86Å; A612-L666 HydrophobicContact CB-CG 3.9Å
613	Y	89.5	Confident	92.6	Very high	13 Å²	13	7 Å²	7	5%	0.051	4%	0.038	C	C	.	.	H	α-helix	trans	-101.2	-1.3	-175.9	-75.9	-84.6	0	0	0	114.4	S507 F545 V609 M611 I615 T616 C617	S507-Y613 WeakPolarHBondContact CB-OH 3.46Å; S507-Y613 PolarHBondContact OG-OH 2.94Å; F545-Y613 HydrophobicContact CB-CD2 4.41Å; F545-Y613 HydrophobicContact CD1-CE2 4.47Å; F545-Y613 HydrophobicContact CD2-CD2 4.05Å; F545-Y613 HydrophobicContact CD2-CE1 4.09Å; F545-Y613 AromaticContact CD2-CE2 3.36Å; F545-Y613 HydrophobicContact CD2-CE2 3.36Å; F545-Y613 AromaticContact CD2-CZ 3.39Å; F545-Y613 AromaticContact CE2-CE2 3.56Å; F545-Y613 HydrophobicContact CE2-CE2 3.56Å; F545-Y613 AromaticContact CE2-CZ 3.53Å; F545-Y613 WeakPolarHBondContact CE2-OH 3.04Å; F545-Y613 HydrophobicContact CG-CD2 4.19Å; F545-Y613 AromaticContact CG-CE2 3.88Å; F545-Y613 HydrophobicContact CG-CE2 3.88Å; F545-Y613 HydrophobicContact CZ-CE2 4.2Å; V609-Y613 HydrophobicContact CG1-CD2 4.5Å; V609-Y613 PolarHBondContact O-N 3.12Å; V609-Y613 VanDerWaalsContact O-N 3.08Å; M611-Y613 VanDerWaalsContact C-N 3.3Å; M611-Y613 PolarHBondContact O-N 3.38Å; Y613-I615 VanDerWaalsContact C-N 3.28Å; Y613-I615 PolarHBondContact O-N 3.44Å; Y613-T616 WeakPolarHBondContact CA-OG1 3.42Å; Y613-T616 WeakPolarHBondContact CD1-OG1 3.48Å; Y613-T616 PolarHBondContact O-N 3.39Å; Y613-T616 PolarHBondContact O-OG1 3.44Å; Y613-C617 CarbonylContact O-C 3.37Å; Y613-C617 WeakPolarHBondContact O-CA 3.44Å; Y613-C617 PolarHBondContact O-N 3.38Å; Y613-C617 VanDerWaalsContact O-O 3.09Å
614	S	92.9	Very high	92.7	Very high	2 Å²	2	7 Å²	7	1%	0.014	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-38.8	-177.3	58.4	0	0	0	0	113.9	V610 M611 P618	V610-S614 WeakPolarHBondContact O-CA 3.39Å; V610-S614 VanDerWaalsContact O-CB 3.23Å; V610-S614 WeakPolarHBondContact O-CB 3.39Å; V610-S614 PolarHBondContact O-N 3.24Å; M611-S614 PolarHBondContact O-N 2.96Å; M611-S614 PolarHBondContact O-OG 2.77Å; S614-P618 VanDerWaalsContact O-CA 3.28Å; S614-P618 WeakPolarHBondContact O-CA 3.43Å
615	I	91	Very high	92.9	Very high	4 Å²	4	8.5 Å²	8.5	2%	0.021	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-41	179.7	-55.6	-63.3	0	0	0	111.7	I154 H188 L191 Y195 Y613 M671	I154-I615 HydrophobicContact CD1-CD1 3.5Å; I154-I615 VanDerWaalsContact CD1-CD1 3.5Å; H188-I615 HydrophobicContact CB-CG2 3.79Å; L191-I615 HydrophobicContact CB-CD1 4.15Å; Y195-I615 HydrophobicContact CD2-CD1 3.71Å; Y195-I615 HydrophobicContact CD2-CG1 4.39Å; Y195-I615 HydrophobicContact CE2-CD1 3.42Å; Y195-I615 VanDerWaalsContact CE2-CD1 3.42Å; Y195-I615 HydrophobicContact CE2-CG1 4.38Å; Y195-I615 HydrophobicContact CG-CD1 4.49Å; Y613-I615 VanDerWaalsContact C-N 3.28Å; Y613-I615 PolarHBondContact O-N 3.44Å; I615-M671 HydrophobicContact CB-CG 4.47Å; I615-M671 HydrophobicContact CB-SD 4.04Å; I615-M671 HydrophobicContact CG2-CE 4.15Å; I615-M671 HydrophobicContact CG2-CG 4.27Å; I615-M671 HydrophobicContact CG2-SD 3.45Å; I615-M671 WeakPolarHBondContact CG2-SD 3.23Å
616	T	87.7	Confident	93.1	Very high	9 Å²	9	11.4 Å²	11.4	6%	0.055	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-35.2	-175.4	57.5	0	0	0	0	112.3	T174 I175 Y613 M671	T174-T616 VanDerWaalsContact CA-O 3.25Å; T174-T616 WeakPolarHBondContact CA-O 3.4Å; T174-T616 WeakPolarHBondContact CB-O 3.49Å; I175-T616 HydrophobicContact CG2-CG2 4.1Å; I175-T616 PolarHBondContact N-O 2.96Å; Y613-T616 WeakPolarHBondContact CA-OG1 3.42Å; Y613-T616 WeakPolarHBondContact CD1-OG1 3.48Å; Y613-T616 PolarHBondContact O-N 3.39Å; Y613-T616 PolarHBondContact O-OG1 3.44Å; T616-M671 HydrophobicContact CG2-SD 4.3Å
617	C	89.2	Confident	93.3	Very high	2 Å²	2	11.7 Å²	11.7	1%	0.014	6%	0.062	C	C	.	.			trans	-139.6	79.5	-179.8	-179.7	0	0	0	0	110.2	T174 Y613 I619 I620	T174-C617 HydrophobicContact CG2-CB 4.36Å; Y613-C617 CarbonylContact O-C 3.37Å; Y613-C617 WeakPolarHBondContact O-CA 3.44Å; Y613-C617 PolarHBondContact O-N 3.38Å; Y613-C617 VanDerWaalsContact O-O 3.09Å; C617-I619 PolarHBondContact O-N 3.47Å; C617-I620 WeakPolarHBondContact O-CG2 3.38Å; C617-I620 PolarHBondContact O-N 3.37Å; C617-I620 VanDerWaalsContact O-N 3.08Å
618	P	92.5	Very high	93.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.6	-172.2	23.9	-35.7	0	0	0	115.1	S150 I154 L155 S614 I620 V621	S150-P618 WeakPolarHBondContact O-CB 3.34Å; I154-P618 HydrophobicContact CB-CB 4.33Å; I154-P618 HydrophobicContact CB-CG 4.38Å; I154-P618 HydrophobicContact CG2-CB 4.14Å; I154-P618 HydrophobicContact CG2-CG 3.87Å; L155-P618 HydrophobicContact CB-CB 4.34Å; L155-P618 HydrophobicContact CB-CG 3.8Å; L155-P618 HydrophobicContact CD1-CG 4.12Å; S614-P618 VanDerWaalsContact O-CA 3.28Å; S614-P618 WeakPolarHBondContact O-CA 3.43Å; P618-I620 PolarHBondContact O-N 3.5Å; P618-V621 PolarHBondContact O-N 2.74Å
619	I	91.4	Very high	93.5	Very high	22 Å²	22	14.4 Å²	14.4	11%	0.113	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.8	175.9	-64.5	-176.7	0	0	0	112.3	F35 L155 T173 V546 C617 V621 P622 F623	F35-I619 HydrophobicContact CE1-CD1 4.22Å; F35-I619 HydrophobicContact CZ-CD1 3.63Å; L155-I619 HydrophobicContact CD1-CD1 4.14Å; L155-I619 HydrophobicContact CD1-CG1 3.94Å; T173-I619 HydrophobicContact CG2-CD1 3.73Å; T173-I619 WeakPolarHBondContact OG1-CD1 3.47Å; V546-I619 HydrophobicContact CG1-CG2 4.44Å; C617-I619 PolarHBondContact O-N 3.47Å; I619-V621 VanDerWaalsContact C-N 3.26Å; I619-V621 PolarHBondContact O-N 3.46Å; I619-P622 VanDerWaalsContact O-CD 3.24Å; I619-P622 WeakPolarHBondContact O-CD 3.11Å; I619-P622 VanDerWaalsContact O-CG 3.25Å; I619-P622 WeakPolarHBondContact O-CG 3.28Å; I619-F623 HydrophobicContact CG2-CD2 4.26Å; I619-F623 HydrophobicContact CG2-CE2 3.81Å; I619-F623 VanDerWaalsContact O-CD2 3.25Å; I619-F623 WeakPolarHBondContact O-CD2 3.36Å
620	I	93.1	Very high	93.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-67.1	-28	178.6	-158.2	169.9	0	0	0	113	F545 V546 V549 V609 V610 C617 P618 F623 G624	F545-I620 HydrophobicContact CB-CD1 4.01Å; V546-I620 HydrophobicContact CG2-CB 3.93Å; V546-I620 HydrophobicContact CG2-CG1 4.13Å; V549-I620 HydrophobicContact CB-CG1 4.5Å; V549-I620 HydrophobicContact CG2-CD1 3.99Å; V549-I620 HydrophobicContact CG2-CG1 4.04Å; V609-I620 HydrophobicContact CG1-CD1 3.79Å; V610-I620 HydrophobicContact CG2-CG1 4.49Å; C617-I620 WeakPolarHBondContact O-CG2 3.38Å; C617-I620 PolarHBondContact O-N 3.37Å; C617-I620 VanDerWaalsContact O-N 3.08Å; P618-I620 PolarHBondContact O-N 3.5Å; I620-F623 PolarHBondContact O-N 2.81Å; I620-G624 PolarHBondContact O-N 3.47Å
621	V	95.5	Very high	93.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.3	-48.8	-173.3	-175.9	0	0	0	0	113.5	V143 I146 C147 P618 I619 F623 G624 L625	V143-V621 HydrophobicContact CG1-CG1 4.09Å; I146-V621 HydrophobicContact CD1-CG1 4.3Å; I146-V621 HydrophobicContact CG1-CG1 4.01Å; C147-V621 HydrophobicContact CB-CG1 3.83Å; P618-V621 PolarHBondContact O-N 2.74Å; I619-V621 VanDerWaalsContact C-N 3.26Å; I619-V621 PolarHBondContact O-N 3.46Å; V621-F623 VanDerWaalsContact C-N 3.3Å; V621-F623 PolarHBondContact O-N 3.15Å; V621-G624 WeakPolarHBondContact O-CA 3.39Å; V621-G624 PolarHBondContact O-N 3.5Å; V621-G624 VanDerWaalsContact O-N 3.13Å; V621-L625 PolarHBondContact O-N 2.73Å
622	P	96.1	Very high	93.5	Very high	42 Å²	42	16.8 Å²	16.8	27%	0.273	9%	0.092	S	C	.	.	H	α-helix	trans	-61.8	-34.7	175.6	22.9	-35.5	0	0	0	113.2	L151 I619 L625 L626	L151-P622 HydrophobicContact CD1-CB 4.35Å; L151-P622 HydrophobicContact CD1-CG 4.17Å; L151-P622 HydrophobicContact CD2-CG 4.23Å; I619-P622 VanDerWaalsContact O-CD 3.24Å; I619-P622 WeakPolarHBondContact O-CD 3.11Å; I619-P622 VanDerWaalsContact O-CG 3.25Å; I619-P622 WeakPolarHBondContact O-CG 3.28Å; P622-L625 WeakPolarHBondContact O-CB 3.47Å; P622-L625 PolarHBondContact O-N 3.46Å; P622-L626 PolarHBondContact O-N 3.08Å
623	F	95.4	Very high	93.5	Very high	36 Å²	36	17.8 Å²	17.8	16%	0.158	10%	0.097	C	C	.	.	H	α-helix	trans	-73.1	-31.4	174.4	-63.7	-64.1	0	0	0	112.3	V38 L42 V546 V549 I550 I619 I620 V621 L626 Y627	V38-F623 HydrophobicContact CG1-CE2 4.36Å; V38-F623 HydrophobicContact CG1-CZ 4.46Å; L42-F623 HydrophobicContact CD1-CE1 4.1Å; L42-F623 HydrophobicContact CD2-CE1 4.16Å; L42-F623 HydrophobicContact CD2-CZ 4.39Å; V546-F623 HydrophobicContact CG1-CD2 3.77Å; V546-F623 HydrophobicContact CG1-CE2 3.92Å; V549-F623 HydrophobicContact CG1-CB 4.11Å; I550-F623 HydrophobicContact CD1-CD1 3.97Å; I550-F623 HydrophobicContact CD1-CD2 4.1Å; I550-F623 HydrophobicContact CD1-CE1 3.85Å; I550-F623 HydrophobicContact CD1-CE2 4Å; I550-F623 HydrophobicContact CD1-CG 4.09Å; I550-F623 HydrophobicContact CD1-CZ 3.86Å; I550-F623 HydrophobicContact CG1-CB 4.08Å; I550-F623 HydrophobicContact CG1-CD1 3.5Å; I550-F623 HydrophobicContact CG1-CD2 4.13Å; I550-F623 HydrophobicContact CG1-CE1 3.88Å; I550-F623 HydrophobicContact CG1-CE2 4.46Å; I550-F623 HydrophobicContact CG1-CG 3.64Å; I550-F623 HydrophobicContact CG1-CZ 4.34Å; I619-F623 HydrophobicContact CG2-CD2 4.26Å; I619-F623 HydrophobicContact CG2-CE2 3.81Å; I619-F623 VanDerWaalsContact O-CD2 3.25Å; I619-F623 WeakPolarHBondContact O-CD2 3.36Å; I620-F623 PolarHBondContact O-N 2.81Å; V621-F623 VanDerWaalsContact C-N 3.3Å; V621-F623 PolarHBondContact O-N 3.15Å; F623-L626 HydrophobicContact CD1-CD2 4.48Å; F623-L626 WeakPolarHBondContact O-CB 3.49Å; F623-L626 PolarHBondContact O-N 3.45Å; F623-Y627 PolarHBondContact O-N 3.06Å
624	G	96.1	Very high	93.6	Very high	2 Å²	2	17.4 Å²	17.4	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-63.5	-40	169	0	0	0	0	0	112.8	I620 V621 Y627 L628	I620-G624 PolarHBondContact O-N 3.47Å; V621-G624 WeakPolarHBondContact O-CA 3.39Å; V621-G624 PolarHBondContact O-N 3.5Å; V621-G624 VanDerWaalsContact O-N 3.13Å; G624-Y627 WeakPolarHBondContact O-CB 3.25Å; G624-Y627 PolarHBondContact O-N 3.46Å; G624-L628 PolarHBondContact O-N 3.49Å
625	L	97	Very high	93.5	Very high	31 Å²	31	17.4 Å²	17.4	16%	0.162	10%	0.095	C	C	.	.	H	α-helix	trans	-62.9	-45.5	172.5	-177.6	62.6	0	0	0	111	I140 V143 L144 V621 P622 Y627 L628 C629	I140-L625 HydrophobicContact CG2-CD1 3.99Å; V143-L625 HydrophobicContact CB-CD1 4.45Å; V143-L625 HydrophobicContact CG1-CB 3.94Å; V143-L625 HydrophobicContact CG1-CD1 4.36Å; L144-L625 HydrophobicContact CB-CD1 4.21Å; L144-L625 HydrophobicContact CB-CD2 4.49Å; L144-L625 HydrophobicContact CD1-CD2 3.7Å; V621-L625 PolarHBondContact O-N 2.73Å; P622-L625 WeakPolarHBondContact O-CB 3.47Å; P622-L625 PolarHBondContact O-N 3.46Å; L625-Y627 VanDerWaalsContact C-N 3.32Å; L625-Y627 PolarHBondContact O-N 3.12Å; L625-L628 PolarHBondContact O-N 2.92Å; L625-C629 PolarHBondContact O-N 3.23Å; L625-C629 PolarHBondContact O-SG 3.27Å; L625-C629 VanDerWaalsContact O-SG 3.33Å
626	L	96.2	Very high	93.5	Very high	62 Å²	62	18.2 Å²	18.2	33%	0.325	10%	0.098	S	C	.	.	H	α-helix	trans	-56	-46.9	174.6	178.3	65.9	0	0	0	111.3	A553 L554 P622 F623 L628 C629 M630	A553-L626 HydrophobicContact CB-CD2 4.35Å; A553-L626 HydrophobicContact CB-CG 4.25Å; L554-L626 HydrophobicContact CD2-CD2 4.48Å; P622-L626 PolarHBondContact O-N 3.08Å; F623-L626 HydrophobicContact CD1-CD2 4.48Å; F623-L626 WeakPolarHBondContact O-CB 3.49Å; F623-L626 PolarHBondContact O-N 3.45Å; L626-L628 PolarHBondContact O-N 2.9Å; L626-C629 PolarHBondContact O-N 3.37Å; L626-M630 HydrophobicContact CD1-CG 4.03Å; L626-M630 HydrophobicContact CG-CG 4.36Å; L626-M630 WeakPolarHBondContact O-CB 3.28Å; L626-M630 VanDerWaalsContact O-CG 3.24Å; L626-M630 WeakPolarHBondContact O-CG 3.38Å; L626-M630 PolarHBondContact O-N 3.27Å
627	Y	96.3	Very high	93.4	Very high	8 Å²	8	17.9 Å²	17.9	3%	0.031	10%	0.096	C	C	.	.	H	α-helix	trans	-55.5	-52.3	175.7	171.1	-96.4	0	0	0	111.9	A552 A553 M603 V606 F623 G624 L625 C629 M630 K631	A552-Y627 HydrophobicContact CB-CD2 4.07Å; A552-Y627 HydrophobicContact CB-CE2 4.13Å; A553-Y627 HydrophobicContact CB-CD2 4.34Å; M603-Y627 HydrophobicContact CG-CE1 4.42Å; V606-Y627 HydrophobicContact CB-CD1 4Å; V606-Y627 HydrophobicContact CB-CE1 3.66Å; V606-Y627 HydrophobicContact CB-CE2 4.39Å; V606-Y627 HydrophobicContact CG1-CD1 3.5Å; V606-Y627 VanDerWaalsContact CG1-CD1 3.5Å; V606-Y627 HydrophobicContact CG1-CD2 4.09Å; V606-Y627 HydrophobicContact CG1-CE1 3.72Å; V606-Y627 HydrophobicContact CG1-CE2 4.3Å; V606-Y627 HydrophobicContact CG1-CG 3.71Å; V606-Y627 HydrophobicContact CG2-CE1 4.11Å; V606-Y627 HydrophobicContact CG2-CE2 4.01Å; F623-Y627 PolarHBondContact O-N 3.06Å; G624-Y627 WeakPolarHBondContact O-CB 3.25Å; G624-Y627 PolarHBondContact O-N 3.46Å; L625-Y627 VanDerWaalsContact C-N 3.32Å; L625-Y627 PolarHBondContact O-N 3.12Å; Y627-C629 VanDerWaalsContact C-N 3.35Å; Y627-C629 PolarHBondContact O-N 3.23Å; Y627-M630 PolarHBondContact O-N 3.29Å; Y627-K631 HydrophobicContact CE1-CB 4.48Å; Y627-K631 VanDerWaalsContact O-CB 3.23Å; Y627-K631 WeakPolarHBondContact O-CB 3.28Å; Y627-K631 PolarHBondContact O-N 3.19Å
628	L	96.6	Very high	93.3	Very high	6 Å²	6	18 Å²	18	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-64	-39.3	-176.9	-69.2	174.6	0	0	0	112.2	L139 I140 V143 M603 G624 L625 L626 H632	L139-L628 HydrophobicContact CB-CD1 4.09Å; I140-L628 HydrophobicContact CG1-CB 3.66Å; V143-L628 HydrophobicContact CB-CD1 4.05Å; V143-L628 HydrophobicContact CG2-CD1 3.55Å; M603-L628 HydrophobicContact CG-CD2 4.1Å; M603-L628 HydrophobicContact SD-CD2 4.44Å; G624-L628 PolarHBondContact O-N 3.49Å; L625-L628 PolarHBondContact O-N 2.92Å; L626-L628 PolarHBondContact O-N 2.9Å; L628-H632 VanDerWaalsContact O-CB 3.29Å; L628-H632 WeakPolarHBondContact O-CB 3.36Å; L628-H632 PolarHBondContact O-N 2.91Å
629	C	95.6	Very high	92.9	Very high	55 Å²	55	18.3 Å²	18.3	37%	0.372	10%	0.098	S	C	.	.	H	α-helix	trans	-63.6	-47	175.1	-70	0	0	0	0	112	L625 L626 Y627 H632 L633	L625-C629 PolarHBondContact O-N 3.23Å; L625-C629 PolarHBondContact O-SG 3.27Å; L625-C629 VanDerWaalsContact O-SG 3.33Å; L626-C629 PolarHBondContact O-N 3.37Å; Y627-C629 VanDerWaalsContact C-N 3.35Å; Y627-C629 PolarHBondContact O-N 3.23Å; C629-H632 PolarHBondContact O-N 3.24Å; C629-L633 PolarHBondContact O-N 3.21Å
630	M	93	Very high	92.5	Very high	27 Å²	27	17.8 Å²	17.8	13%	0.133	10%	0.095	C	C	.	.	H	α-helix	trans	-64.8	-39.7	178.3	-71.4	-62.1	-73.4	0	0	112	W49 T557 L626 Y627 L633 T634	W49-M630 HydrophobicContact CH2-CE 4.46Å; W49-M630 HydrophobicContact CZ2-CE 3.41Å; W49-M630 VanDerWaalsContact CZ2-CE 3.41Å; T557-M630 HydrophobicContact CG2-CB 3.95Å; L626-M630 HydrophobicContact CD1-CG 4.03Å; L626-M630 HydrophobicContact CG-CG 4.36Å; L626-M630 WeakPolarHBondContact O-CB 3.28Å; L626-M630 VanDerWaalsContact O-CG 3.24Å; L626-M630 WeakPolarHBondContact O-CG 3.38Å; L626-M630 PolarHBondContact O-N 3.27Å; Y627-M630 PolarHBondContact O-N 3.29Å; M630-L633 PolarHBondContact O-N 3.36Å; M630-T634 WeakPolarHBondContact O-CB 3.36Å; M630-T634 PolarHBondContact O-N 3.18Å; M630-T634 PolarHBondContact O-OG1 3.35Å
631	K	94.1	Very high	91.8	Very high	1 Å²	1	18.4 Å²	18.4	0%	0.004	10%	0.097	C	C	.	.	H	α-helix	trans	-63.3	-46.3	175.5	-173.2	67.7	175	124.8	0	111.1	T557 E560 E599 Y627 L633 T634 D635	T557-K631 HydrophobicContact CG2-CB 4.39Å; E560-K631 IonicContact OE1-NZ 3.25Å; E560-K631 WeakPolarHBondContact OE2-CD 3.41Å; E560-K631 WeakPolarHBondContact OE2-CE 3.38Å; E560-K631 IonicContact OE2-NZ 3.04Å; E560-K631 PolarHBondContact OE2-NZ 2.81Å; E599-K631 IonicContact OE2-NZ 2.86Å; E599-K631 PolarHBondContact OE2-NZ 3.4Å; Y627-K631 HydrophobicContact CE1-CB 4.48Å; Y627-K631 VanDerWaalsContact O-CB 3.23Å; Y627-K631 WeakPolarHBondContact O-CB 3.28Å; Y627-K631 PolarHBondContact O-N 3.19Å; K631-L633 PolarHBondContact O-N 2.84Å; K631-T634 PolarHBondContact O-N 2.94Å; K631-D635 VanDerWaalsContact CE-OD2 3.32Å; K631-D635 WeakPolarHBondContact CE-OD2 3.4Å; K631-D635 IonicContact NZ-OD1 3.44Å; K631-D635 PolarHBondContact NZ-OD1 3.36Å; K631-D635 IonicContact NZ-OD2 2.67Å; K631-D635 PolarHBondContact NZ-OD2 3.13Å; K631-D635 WeakPolarHBondContact O-CB 3.45Å; K631-D635 PolarHBondContact O-N 3.18Å
632	H	93.4	Very high	90.9	Very high	28 Å²	28	18.8 Å²	18.8	13%	0.13	10%	0.1	C	C	.	.	H	α-helix	trans	-60.7	-43.7	177.8	-177.2	73.7	0	0	0	112.7	I133 Q136 I140 L628 C629 R636	I133-H632 VanDerWaalsContact CG2-CE1 3.48Å; I133-H632 WeakPolarHBondContact CG2-CE1 3.38Å; Q136-H632 PolarHBondContact OE1-ND1 3.03Å; Q136-H632 VanDerWaalsContact OE1-ND1 3.12Å; I140-H632 HydrophobicContact CD1-CB 3.74Å; L628-H632 VanDerWaalsContact O-CB 3.29Å; L628-H632 WeakPolarHBondContact O-CB 3.36Å; L628-H632 PolarHBondContact O-N 2.91Å; C629-H632 PolarHBondContact O-N 3.24Å; H632-R636 WeakPolarHBondContact NE2-CD 3.14Å; H632-R636 WeakPolarHBondContact O-CB 3.47Å; H632-R636 WeakPolarHBondContact O-CG 3.23Å; H632-R636 PolarHBondContact O-N 3.28Å; H632-R636 VanDerWaalsContact O-N 3.13Å
633	L	91.6	Very high	90	Very high	24 Å²	24	18 Å²	18	13%	0.126	9%	0.092	C	C	.	.	H	α-helix	trans	-62.8	-49.1	176.5	-175.5	72	0	0	0	111.5	F110 S113 I114 C629 M630 K631 Y637	F110-L633 HydrophobicContact CD2-CD2 3.72Å; F110-L633 HydrophobicContact CE2-CD2 3.42Å; F110-L633 VanDerWaalsContact CE2-CD2 3.42Å; F110-L633 HydrophobicContact CZ-CD2 4.4Å; S113-L633 WeakPolarHBondContact OG-CD1 3.21Å; S113-L633 PolarHBondContact OG-O 2.71Å; I114-L633 HydrophobicContact CG1-CD1 3.7Å; C629-L633 PolarHBondContact O-N 3.21Å; M630-L633 PolarHBondContact O-N 3.36Å; K631-L633 PolarHBondContact O-N 2.84Å; L633-Y637 PolarHBondContact O-N 2.98Å
634	T	91.1	Very high	89.1	Confident	4 Å²	4	16.9 Å²	16.9	3%	0.025	9%	0.09	C	C	.	.	H	α-helix	trans	-64.2	-44.7	-176.9	-58.1	0	0	0	0	111.8	E560 L561 M630 K631 Y637 N638	E560-T634 HydrophobicContact CB-CG2 4.26Å; L561-T634 HydrophobicContact CB-CG2 3.9Å; L561-T634 HydrophobicContact CD1-CG2 4.22Å; M630-T634 WeakPolarHBondContact O-CB 3.36Å; M630-T634 PolarHBondContact O-N 3.18Å; M630-T634 PolarHBondContact O-OG1 3.35Å; K631-T634 PolarHBondContact O-N 2.94Å; T634-Y637 PolarHBondContact O-N 3.44Å; T634-N638 WeakPolarHBondContact O-CB 3.32Å; T634-N638 PolarHBondContact O-N 3.09Å
635	D	91.3	Very high	88	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.011	12%	0.115	C	C	.	.	H	α-helix	trans	-66.6	-42.9	-179.5	-74.8	-12.7	0	0	0	111.9	Y132 Q136 K631 Y637 N638 M639	Y132-D635 HydrophobicContact CE1-CB 4.06Å; Y132-D635 WeakPolarHBondContact CE1-OD2 3.39Å; Y132-D635 PolarHBondContact OH-OD2 3.42Å; Q136-D635 PolarHBondContact NE2-OD2 3.07Å; K631-D635 VanDerWaalsContact CE-OD2 3.32Å; K631-D635 WeakPolarHBondContact CE-OD2 3.4Å; K631-D635 IonicContact NZ-OD1 3.44Å; K631-D635 PolarHBondContact NZ-OD1 3.36Å; K631-D635 IonicContact NZ-OD2 2.67Å; K631-D635 PolarHBondContact NZ-OD2 3.13Å; K631-D635 WeakPolarHBondContact O-CB 3.45Å; K631-D635 PolarHBondContact O-N 3.18Å; D635-Y637 VanDerWaalsContact C-N 3.32Å; D635-Y637 PolarHBondContact O-N 3.36Å; D635-N638 PolarHBondContact O-N 3.28Å; D635-M639 HydrophobicContact CB-SD 4.47Å; D635-M639 VanDerWaalsContact O-CB 3.24Å; D635-M639 WeakPolarHBondContact O-CB 3.47Å; D635-M639 WeakPolarHBondContact O-CG 3.31Å; D635-M639 PolarHBondContact O-N 2.79Å
636	R	89.3	Confident	86.8	Confident	22 Å²	22	20.3 Å²	20.3	8%	0.083	11%	0.113	C	C	.	.	H	α-helix	trans	-56.2	-47.9	175.2	-77.1	175.6	71.8	104.2	8.6	111.6	M116 D118 L121 I133 H632 Y640	M116-R636 HydrophobicContact CE-CB 4.19Å; M116-R636 PolarHBondContact O-NH2 3.47Å; D118-R636 IonicContact OD1-CZ 2.82Å; D118-R636 IonicContact OD1-NH1 2.64Å; D118-R636 PolarHBondContact OD1-NH1 3.49Å; D118-R636 IonicContact OD1-NH2 3.02Å; D118-R636 PolarHBondContact OD1-NH2 3.39Å; L121-R636 HydrophobicContact CD2-CG 4.32Å; I133-R636 HydrophobicContact CD1-CG 4.11Å; I133-R636 HydrophobicContact CG1-CG 4.47Å; I133-R636 HydrophobicContact CG2-CG 4.33Å; H632-R636 WeakPolarHBondContact NE2-CD 3.14Å; H632-R636 WeakPolarHBondContact O-CB 3.47Å; H632-R636 WeakPolarHBondContact O-CG 3.23Å; H632-R636 PolarHBondContact O-N 3.28Å; H632-R636 VanDerWaalsContact O-N 3.13Å; R636-Y640 PolarHBondContact O-N 3.23Å
637	Y	86.7	Confident	85.5	Confident	2 Å²	2	24 Å²	24	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-50.9	178.8	-176.2	-92.5	0	0	0	111.7	Y56 R60 R68 D103 W109 L561 L633 T634 D635 M639 Y640 Y641	Y56-Y637 WeakPolarHBondContact OH-CE1 3.3Å; Y56-Y637 PolarHBondContact OH-OH 3.27Å; R60-Y637 PolarHBondContact NH1-OH 3.11Å; R68-Y637 PolarHBondContact NH2-OH 3.03Å; R68-Y637 VanDerWaalsContact NH2-OH 3.09Å; D103-Y637 PolarHBondContact OD2-OH 3.19Å; W109-Y637 HydrophobicContact CB-CD2 4.28Å; W109-Y637 HydrophobicContact CB-CE2 3.53Å; L561-Y637 HydrophobicContact CD1-CD1 3.82Å; L561-Y637 HydrophobicContact CD1-CE1 4.43Å; L633-Y637 PolarHBondContact O-N 2.98Å; T634-Y637 PolarHBondContact O-N 3.44Å; D635-Y637 VanDerWaalsContact C-N 3.32Å; D635-Y637 PolarHBondContact O-N 3.36Å; Y637-M639 PolarHBondContact O-N 3.35Å; Y637-Y640 PolarHBondContact O-N 3.46Å; Y637-Y641 HydrophobicContact CD1-CD2 4.38Å; Y637-Y641 AromaticContact CD2-CD2 3.6Å; Y637-Y641 HydrophobicContact CD2-CD2 3.6Å; Y637-Y641 AromaticContact CD2-CE2 3.74Å; Y637-Y641 HydrophobicContact CD2-CE2 3.74Å; Y637-Y641 HydrophobicContact CE1-CD2 4.13Å; Y637-Y641 AromaticContact CE2-CD2 3.33Å; Y637-Y641 HydrophobicContact CE2-CD2 3.33Å; Y637-Y641 AromaticContact CE2-CE2 3.43Å; Y637-Y641 HydrophobicContact CE2-CE2 3.43Å; Y637-Y641 VanDerWaalsContact CE2-CE2 3.43Å; Y637-Y641 HydrophobicContact CE2-CG 4.32Å; Y637-Y641 HydrophobicContact CG-CD2 4.13Å; Y637-Y641 AromaticContact CZ-CD2 3.64Å; Y637-Y641 WeakPolarHBondContact O-CD2 3.27Å; Y637-Y641 PolarHBondContact O-N 2.87Å; Y637-Y641 VanDerWaalsContact O-N 3.08Å
638	N	86.8	Confident	84.4	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.027	13%	0.131	C	C	.	.	H	α-helix	trans	-64.6	-42.5	-176.4	-83	-15.8	0	0	0	112.1	E560 T634 D635 Y640 Y641 S642 F643	E560-N638 PolarHBondContact O-ND2 3.04Å; T634-N638 WeakPolarHBondContact O-CB 3.32Å; T634-N638 PolarHBondContact O-N 3.09Å; D635-N638 PolarHBondContact O-N 3.28Å; N638-Y640 VanDerWaalsContact C-N 3.33Å; N638-Y640 PolarHBondContact O-N 3.27Å; N638-Y641 PolarHBondContact O-N 3.02Å; N638-S642 WeakPolarHBondContact O-CA 3.46Å; N638-S642 VanDerWaalsContact O-CB 3.22Å; N638-S642 WeakPolarHBondContact O-CB 3.47Å; N638-S642 PolarHBondContact O-N 3.08Å; N638-F643 HydrophobicContact CB-CD2 4.12Å; N638-F643 HydrophobicContact CB-CE2 3.84Å; N638-F643 WeakPolarHBondContact O-CD2 3.13Å; N638-F643 PolarHBondContact O-N 3.38Å
639	M	85.2	Confident	83.3	Confident	6 Å²	6	26.2 Å²	26.2	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-42.3	178.2	-72.6	172.8	61.9	0	0	111.6	A129 Y132 I133 F594 F596 D635 Y637	A129-M639 HydrophobicContact CB-CE 3.21Å; Y132-M639 HydrophobicContact CD1-CE 4.5Å; Y132-M639 HydrophobicContact CD1-SD 3.9Å; Y132-M639 HydrophobicContact CE1-SD 4.16Å; I133-M639 HydrophobicContact CD1-CE 4.24Å; I133-M639 HydrophobicContact CD1-SD 4.39Å; I133-M639 HydrophobicContact CG1-SD 4.48Å; F594-M639 HydrophobicContact CD1-CG 4.34Å; F594-M639 HydrophobicContact CD1-SD 4.32Å; F594-M639 HydrophobicContact CD2-CG 3.71Å; F594-M639 HydrophobicContact CE1-CE 4.49Å; F594-M639 HydrophobicContact CE1-CG 4.26Å; F594-M639 HydrophobicContact CE1-SD 3.87Å; F594-M639 HydrophobicContact CE2-CG 3.6Å; F594-M639 HydrophobicContact CE2-SD 4.11Å; F594-M639 HydrophobicContact CG-CG 4.07Å; F594-M639 HydrophobicContact CZ-CG 3.88Å; F594-M639 HydrophobicContact CZ-SD 3.73Å; F596-M639 HydrophobicContact CE1-CE 4.43Å; F596-M639 HydrophobicContact CZ-CE 4.31Å; D635-M639 HydrophobicContact CB-SD 4.47Å; D635-M639 VanDerWaalsContact O-CB 3.24Å; D635-M639 WeakPolarHBondContact O-CB 3.47Å; D635-M639 WeakPolarHBondContact O-CG 3.31Å; D635-M639 PolarHBondContact O-N 2.79Å; Y637-M639 PolarHBondContact O-N 3.35Å
640	Y	82.1	Confident	82.2	Confident	11 Å²	11	24.9 Å²	24.9	4%	0.043	13%	0.127	C	C	.	.	H	α-helix	trans	-68.9	-42.5	179.6	-169.2	-95.2	0	0	0	113.2	M99 M116 L121 K124 R636 Y637 N638	M99-Y640 HydrophobicContact CG-CE1 4.4Å; M116-Y640 HydrophobicContact CE-CD2 4.41Å; M116-Y640 HydrophobicContact CE-CG 4.39Å; M116-Y640 HydrophobicContact SD-CD1 3.95Å; M116-Y640 HydrophobicContact SD-CD2 3.33Å; M116-Y640 WeakPolarHBondContact SD-CD2 3.48Å; M116-Y640 HydrophobicContact SD-CE1 4.42Å; M116-Y640 HydrophobicContact SD-CE2 3.87Å; M116-Y640 HydrophobicContact SD-CG 3.36Å; L121-Y640 HydrophobicContact CD1-CD2 3.85Å; L121-Y640 HydrophobicContact CD1-CG 4.33Å; K124-Y640 HydrophobicContact CB-CE2 4.35Å; K124-Y640 HydrophobicContact CD-CD2 3.79Å; K124-Y640 HydrophobicContact CD-CE1 4.44Å; K124-Y640 HydrophobicContact CD-CE2 3.71Å; K124-Y640 HydrophobicContact CD-CG 4.23Å; K124-Y640 WeakPolarHBondContact CE-O 3.41Å; K124-Y640 PolarHBondContact NZ-O 3.2Å; R636-Y640 PolarHBondContact O-N 3.23Å; Y637-Y640 PolarHBondContact O-N 3.46Å; N638-Y640 VanDerWaalsContact C-N 3.33Å; N638-Y640 PolarHBondContact O-N 3.27Å
641	Y	78.1	Confident	81.6	Confident	13 Å²	13	28.7 Å²	28.7	5%	0.051	14%	0.144	C	C	.	.	H	α-helix	trans	-104	-19.5	-167.9	-72.1	-69.9	0	0	0	115.6	R68 L71 M99 Y637 N638	R68-Y641 VanDerWaalsContact NH2-CE1 3.33Å; L71-Y641 WeakPolarHBondContact CD1-O 3.2Å; M99-Y641 WeakPolarHBondContact CG-OH 3.5Å; Y637-Y641 HydrophobicContact CD1-CD2 4.38Å; Y637-Y641 AromaticContact CD2-CD2 3.6Å; Y637-Y641 HydrophobicContact CD2-CD2 3.6Å; Y637-Y641 AromaticContact CD2-CE2 3.74Å; Y637-Y641 HydrophobicContact CD2-CE2 3.74Å; Y637-Y641 HydrophobicContact CE1-CD2 4.13Å; Y637-Y641 AromaticContact CE2-CD2 3.33Å; Y637-Y641 HydrophobicContact CE2-CD2 3.33Å; Y637-Y641 AromaticContact CE2-CE2 3.43Å; Y637-Y641 HydrophobicContact CE2-CE2 3.43Å; Y637-Y641 VanDerWaalsContact CE2-CE2 3.43Å; Y637-Y641 HydrophobicContact CE2-CG 4.32Å; Y637-Y641 HydrophobicContact CG-CD2 4.13Å; Y637-Y641 AromaticContact CZ-CD2 3.64Å; Y637-Y641 WeakPolarHBondContact O-CD2 3.27Å; Y637-Y641 PolarHBondContact O-N 2.87Å; Y637-Y641 VanDerWaalsContact O-N 3.08Å; N638-Y641 PolarHBondContact O-N 3.02Å
642	S	76.1	Confident	81.1	Confident	7 Å²	7	28.7 Å²	28.7	5%	0.049	15%	0.145	C	C	.	.	H	α-helix	trans	-125.4	-13.9	-163.6	-71.1	0	0	0	0	115	R563 N638	R563-S642 VanDerWaalsContact CZ-OG 3.24Å; R563-S642 VanDerWaalsContact NH1-CB 3.31Å; R563-S642 PolarHBondContact NH1-OG 2.87Å; N638-S642 WeakPolarHBondContact O-CA 3.46Å; N638-S642 VanDerWaalsContact O-CB 3.22Å; N638-S642 WeakPolarHBondContact O-CB 3.47Å; N638-S642 PolarHBondContact O-N 3.08Å
643	F	78.9	Confident	80.7	Confident	25 Å²	25	27.7 Å²	27.7	11%	0.11	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	148	-174.3	-69.2	-70.3	0	0	0	112.4	I592 F594 N638	I592-F643 HydrophobicContact CB-CD1 4.44Å; I592-F643 HydrophobicContact CB-CE1 4.39Å; I592-F643 HydrophobicContact CG2-CE1 4.3Å; I592-F643 WeakPolarHBondContact O-CA 3.28Å; I592-F643 WeakPolarHBondContact O-CD1 3.16Å; F594-F643 HydrophobicContact CB-CB 3.94Å; F594-F643 HydrophobicContact CB-CD1 4.3Å; F594-F643 HydrophobicContact CB-CD2 4.46Å; F594-F643 HydrophobicContact CB-CG 4.01Å; F594-F643 HydrophobicContact CD2-CD1 4.39Å; F594-F643 AromaticContact CD2-CD2 3.5Å; F594-F643 HydrophobicContact CD2-CD2 3.5Å; F594-F643 AromaticContact CD2-CE2 3.64Å; F594-F643 HydrophobicContact CD2-CE2 3.64Å; F594-F643 AromaticContact CD2-CG 3.9Å; F594-F643 HydrophobicContact CD2-CG 3.9Å; F594-F643 HydrophobicContact CD2-CZ 4.2Å; F594-F643 HydrophobicContact CE2-CD2 4.25Å; F594-F643 HydrophobicContact CE2-CE2 4.09Å; F594-F643 HydrophobicContact CG-CD2 4.44Å; F594-F643 HydrophobicContact CG-CG 4.46Å; N638-F643 HydrophobicContact CB-CD2 4.12Å; N638-F643 HydrophobicContact CB-CE2 3.84Å; N638-F643 WeakPolarHBondContact O-CD2 3.13Å; N638-F643 PolarHBondContact O-N 3.38Å
644	A	75.1	Confident	80.4	Confident	14 Å²	14	29.2 Å²	29.2	12%	0.116	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	147.1	171.7	0	0	0	0	0	110.7	L71 I592 T646	L71-A644 HydrophobicContact CD2-CB 4.11Å; I592-A644 PolarHBondContact O-N 3.32Å; I592-A644 VanDerWaalsContact O-N 3.11Å; A644-T646 PolarHBondContact O-N 2.83Å
645	P	72.9	Confident	80.3	Confident	86 Å²	86	29.4 Å²	29.4	56%	0.558	15%	0.149	S	C	*	.			trans	-66.9	128.5	176.4	27.2	-33.4	0	0	0	110.5
646	T	72.1	Confident	80.3	Confident	18 Å²	18	29.3 Å²	29.3	11%	0.11	15%	0.148	C	C	.	.			trans	-108.5	142.1	173.5	59.2	0	0	0	0	110.2	D593 F596 A644	D593-T646 HydrophobicContact CB-CG2 3.46Å; D593-T646 VanDerWaalsContact CB-CG2 3.46Å; F596-T646 WeakPolarHBondContact CE2-OG1 3.46Å; A644-T646 PolarHBondContact O-N 2.83Å
647	K	70.3	Confident	80.3	Confident	141 Å²	141	28.3 Å²	28.3	61%	0.613	15%	0.145	S	C	*	.			trans	-102	116	167.8	-67.7	-169.9	177.7	-173.4	0	109	D128	D128-K647 WeakPolarHBondContact OD2-CA 3.22Å
648	L	73	Confident	80.4	Confident	23 Å²	23	29.8 Å²	29.8	12%	0.12	16%	0.155	C	C	.	.			trans	-120.2	167.6	-179.8	-65.4	173.6	0	0	0	111.2	D128 R483 F596 I652	D128-L648 PolarHBondContact OD2-N 3Å; R483-L648 HydrophobicContact CB-CD2 4.33Å; F596-L648 HydrophobicContact CB-CD1 3.92Å; F596-L648 HydrophobicContact CD2-CD1 3.37Å; F596-L648 HydrophobicContact CE2-CD1 4.19Å; F596-L648 HydrophobicContact CG-CD1 3.93Å; L648-I652 HydrophobicContact CB-CD1 3.85Å; L648-I652 HydrophobicContact CD1-CD1 3.85Å; L648-I652 HydrophobicContact CD2-CD1 4.24Å; L648-I652 HydrophobicContact CG-CD1 4.21Å
649	N	73	Confident	80.7	Confident	37 Å²	37	30 Å²	30	20%	0.198	16%	0.156	C	C	.	.			trans	-78.7	135.6	172.7	-168	0.6	0	0	0	110.7	Q216 S484 Q651 I652	Q216-N649 PolarHBondContact NE2-OD1 3.45Å; S484-N649 PolarHBondContact OG-N 3.36Å; N649-Q651 PolarHBondContact O-N 3.17Å; N649-I652 PolarHBondContact O-N 3.37Å; N649-I652 VanDerWaalsContact O-N 3.15Å
650	E	73.2	Confident	81.1	Confident	26 Å²	26	29.7 Å²	29.7	12%	0.121	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-19.8	-178.2	-60.9	171.3	142.7	0	0	113.9	P212 S215 I652 H653 M654	P212-E650 WeakPolarHBondContact CB-OE2 3.34Å; P212-E650 WeakPolarHBondContact CG-OE2 3.34Å; S215-E650 VanDerWaalsContact CB-OE1 3.28Å; S215-E650 WeakPolarHBondContact CB-OE1 3.33Å; S215-E650 PolarHBondContact OG-OE1 2.9Å; E650-I652 PolarHBondContact O-N 2.86Å; E650-I652 VanDerWaalsContact O-N 3.09Å; E650-H653 WeakPolarHBondContact O-CB 3.29Å; E650-H653 PolarHBondContact O-N 3.31Å; E650-M654 PolarHBondContact O-N 2.64Å; E650-M654 VanDerWaalsContact O-N 3.16Å
651	Q	78.8	Confident	81.6	Confident	107 Å²	107	29.7 Å²	29.7	50%	0.5	16%	0.155	S	C	.	.	H	α-helix	trans	-53.9	-28.4	175.3	-68	-176.8	-3.3	0	0	113.3	L488 N649 M654 A655	L488-Q651 HydrophobicContact CD1-CB 4.44Å; L488-Q651 HydrophobicContact CD2-CB 4.5Å; N649-Q651 PolarHBondContact O-N 3.17Å; Q651-M654 PolarHBondContact O-N 2.77Å; Q651-A655 WeakPolarHBondContact O-CB 3.32Å; Q651-A655 PolarHBondContact O-N 2.95Å
652	I	84.2	Confident	82.3	Confident	2 Å²	2	32 Å²	32	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-44.6	177.5	-59.7	171	0	0	0	110.4	N487 L488 V491 Y600 L648 N649 E650 M654 A655 A656	N487-I652 HydrophobicContact CB-CD1 3.67Å; L488-I652 HydrophobicContact CB-CG1 4.15Å; L488-I652 HydrophobicContact CD1-CG1 4.27Å; V491-I652 HydrophobicContact CG2-CG2 4.01Å; Y600-I652 HydrophobicContact CD2-CG2 4.17Å; Y600-I652 HydrophobicContact CE2-CG2 4.31Å; L648-I652 HydrophobicContact CB-CD1 3.85Å; L648-I652 HydrophobicContact CD1-CD1 3.85Å; L648-I652 HydrophobicContact CD2-CD1 4.24Å; L648-I652 HydrophobicContact CG-CD1 4.21Å; N649-I652 PolarHBondContact O-N 3.37Å; N649-I652 VanDerWaalsContact O-N 3.15Å; E650-I652 PolarHBondContact O-N 2.86Å; E650-I652 VanDerWaalsContact O-N 3.09Å; I652-M654 VanDerWaalsContact C-N 3.31Å; I652-M654 PolarHBondContact O-N 2.75Å; I652-A655 WeakPolarHBondContact O-CB 3.46Å; I652-A655 PolarHBondContact O-N 3.35Å; I652-A656 PolarHBondContact O-N 3.22Å; I652-A656 VanDerWaalsContact O-N 3.15Å
653	H	85.8	Confident	83.1	Confident	7 Å²	7	31.7 Å²	31.7	3%	0.032	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-41.2	176.5	-57.5	-59.5	0	0	0	110.7	D128 I131 Y600 E650 A655 A656 V657	D128-H653 PolarHBondContact O-CE1 3.3Å; D128-H653 VanDerWaalsContact O-CE1 3.31Å; D128-H653 IonicContact OD1-NE2 2.59Å; D128-H653 PolarHBondContact OD1-NE2 2.94Å; I131-H653 HydrophobicContact CG2-CB 3.7Å; I131-H653 VanDerWaalsContact CG2-CG 3.47Å; Y600-H653 AromaticContact CE2-ND1 3.6Å; Y600-H653 AromaticContact CZ-ND1 3.57Å; Y600-H653 PolarHBondContact OH-ND1 3.5Å; E650-H653 WeakPolarHBondContact O-CB 3.29Å; E650-H653 PolarHBondContact O-N 3.31Å; H653-A655 VanDerWaalsContact C-N 3.33Å; H653-A655 PolarHBondContact O-N 3.32Å; H653-A656 PolarHBondContact O-N 3.49Å; H653-V657 WeakPolarHBondContact O-CG2 3.38Å; H653-V657 PolarHBondContact O-N 2.98Å
654	M	85.3	Confident	83.8	Confident	55 Å²	55	30.7 Å²	30.7	27%	0.271	16%	0.16	S	C	.	.	H	α-helix	trans	-66	-34	176.1	-64.8	-60.1	175.5	0	0	112.9	P212 E650 Q651 I652 V657 S658 M711	P212-M654 HydrophobicContact CG-CE 4.27Å; E650-M654 PolarHBondContact O-N 2.64Å; E650-M654 VanDerWaalsContact O-N 3.16Å; Q651-M654 PolarHBondContact O-N 2.77Å; I652-M654 VanDerWaalsContact C-N 3.31Å; I652-M654 PolarHBondContact O-N 2.75Å; M654-V657 PolarHBondContact O-N 3.43Å; M654-S658 WeakPolarHBondContact O-CB 3.41Å; M654-S658 PolarHBondContact O-N 3.16Å; M654-M711 HydrophobicContact CE-SD 4.38Å
655	A	88.4	Confident	84.7	Confident	8 Å²	8	30.5 Å²	30.5	7%	0.066	16%	0.157	C	C	.	.	H	α-helix	trans	-62.6	-43.8	173.4	0	0	0	0	0	111.6	L488 V491 H492 Q651 I652 H653 S658 Q659	L488-A655 HydrophobicContact CD1-CB 3.79Å; V491-A655 HydrophobicContact CG1-CB 4.28Å; H492-A655 VanDerWaalsContact CE1-CB 3.41Å; H492-A655 WeakPolarHBondContact CE1-CB 3.41Å; Q651-A655 WeakPolarHBondContact O-CB 3.32Å; Q651-A655 PolarHBondContact O-N 2.95Å; I652-A655 WeakPolarHBondContact O-CB 3.46Å; I652-A655 PolarHBondContact O-N 3.35Å; H653-A655 VanDerWaalsContact C-N 3.33Å; H653-A655 PolarHBondContact O-N 3.32Å; A655-S658 WeakPolarHBondContact O-CB 3.31Å; A655-S658 PolarHBondContact O-N 2.96Å; A655-Q659 WeakPolarHBondContact O-CG 3.39Å; A655-Q659 PolarHBondContact O-N 3.42Å
656	A	90.4	Very high	85.5	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.6	-41.2	176	0	0	0	0	0	112.3	F135 Y600 I652 H653 S658 Q659 A660	F135-A656 HydrophobicContact CE1-CB 4.27Å; F135-A656 HydrophobicContact CZ-CB 4.19Å; Y600-A656 HydrophobicContact CD1-CB 3.27Å; Y600-A656 HydrophobicContact CD2-CB 4.35Å; Y600-A656 HydrophobicContact CE1-CB 3.42Å; Y600-A656 VanDerWaalsContact CE1-CB 3.42Å; Y600-A656 HydrophobicContact CE2-CB 4.47Å; Y600-A656 HydrophobicContact CG-CB 3.78Å; I652-A656 PolarHBondContact O-N 3.22Å; I652-A656 VanDerWaalsContact O-N 3.15Å; H653-A656 PolarHBondContact O-N 3.49Å; A656-S658 VanDerWaalsContact C-N 3.35Å; A656-S658 PolarHBondContact O-N 3.18Å; A656-Q659 PolarHBondContact O-N 3.35Å; A656-A660 PolarHBondContact O-N 3.2Å
657	V	90.1	Very high	86.4	Confident	2 Å²	2	27 Å²	27	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-63.7	-42.2	175	-179.6	0	0	0	0	111.2	F135 M203 C207 H653 M654 Q659 A660 I661	F135-V657 HydrophobicContact CD2-CG2 4.03Å; F135-V657 HydrophobicContact CE2-CG2 3.88Å; M203-V657 HydrophobicContact CB-CG1 3.93Å; M203-V657 HydrophobicContact CG-CG1 4.39Å; M203-V657 HydrophobicContact SD-CG1 4.11Å; C207-V657 WeakPolarHBondContact SG-CG1 3.45Å; H653-V657 WeakPolarHBondContact O-CG2 3.38Å; H653-V657 PolarHBondContact O-N 2.98Å; M654-V657 PolarHBondContact O-N 3.43Å; V657-Q659 VanDerWaalsContact C-N 3.31Å; V657-Q659 PolarHBondContact O-N 3.11Å; V657-A660 PolarHBondContact O-N 3.15Å; V657-I661 HydrophobicContact CG1-CD1 4.18Å; V657-I661 WeakPolarHBondContact O-CG1 3.39Å; V657-I661 PolarHBondContact O-N 2.94Å
658	S	89.6	Confident	87.5	Confident	32 Å²	32	20.4 Å²	20.4	22%	0.224	11%	0.105	C	C	.	.	H	α-helix	trans	-58.5	-44.8	174.4	-173.6	0	0	0	0	111.3	M654 A655 A656 A660 I661 F662 I704	M654-S658 WeakPolarHBondContact O-CB 3.41Å; M654-S658 PolarHBondContact O-N 3.16Å; A655-S658 WeakPolarHBondContact O-CB 3.31Å; A655-S658 PolarHBondContact O-N 2.96Å; A656-S658 VanDerWaalsContact C-N 3.35Å; A656-S658 PolarHBondContact O-N 3.18Å; S658-A660 VanDerWaalsContact C-N 3.34Å; S658-A660 PolarHBondContact O-N 3.33Å; S658-I661 PolarHBondContact O-N 2.89Å; S658-F662 WeakPolarHBondContact O-CD2 3.41Å; S658-F662 PolarHBondContact O-N 3.42Å; S658-F662 VanDerWaalsContact O-N 3.13Å; S658-I704 WeakPolarHBondContact OG-CD1 3.38Å
659	Q	92.4	Very high	88.3	Confident	9 Å²	9	23.4 Å²	23.4	4%	0.042	12%	0.117	C	C	.	.	H	α-helix	trans	-61.8	-41.4	176.9	-71.1	174.2	-11.1	0	0	112	V491 Y495 M604 A655 A656 V657 I661 F662 A663	V491-Q659 PolarHBondContact O-NE2 3.1Å; Y495-Q659 VanDerWaalsContact CB-NE2 3.32Å; Y495-Q659 HydrophobicContact CD1-CB 4.39Å; Y495-Q659 HydrophobicContact CD1-CG 3.74Å; Y495-Q659 HydrophobicContact CE1-CB 4.1Å; Y495-Q659 HydrophobicContact CE1-CG 3.83Å; Y495-Q659 HydrophobicContact CE2-CB 4.42Å; Y495-Q659 HydrophobicContact CG-CG 4.15Å; M604-Q659 HydrophobicContact CG-CB 4.3Å; A655-Q659 WeakPolarHBondContact O-CG 3.39Å; A655-Q659 PolarHBondContact O-N 3.42Å; A656-Q659 PolarHBondContact O-N 3.35Å; V657-Q659 VanDerWaalsContact C-N 3.31Å; V657-Q659 PolarHBondContact O-N 3.11Å; Q659-I661 VanDerWaalsContact C-N 3.34Å; Q659-I661 PolarHBondContact O-N 3.44Å; Q659-F662 PolarHBondContact O-N 2.97Å; Q659-F662 VanDerWaalsContact O-N 3.13Å; Q659-A663 PolarHBondContact O-N 2.88Å
660	A	93.1	Very high	89	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.4	-37.8	176	0	0	0	0	0	112.8	F135 N199 M203 M604 F607 A656 V657 S658 F662 A663 P664	F135-A660 HydrophobicContact CE2-CB 4.32Å; F135-A660 HydrophobicContact CZ-CB 4.13Å; N199-A660 PolarHBondContact OD1-O 3.44Å; M203-A660 HydrophobicContact CG-CB 4.18Å; M203-A660 HydrophobicContact SD-CB 3.62Å; M604-A660 HydrophobicContact SD-CB 3.93Å; F607-A660 HydrophobicContact CE1-CB 4.28Å; A656-A660 PolarHBondContact O-N 3.2Å; V657-A660 PolarHBondContact O-N 3.15Å; S658-A660 VanDerWaalsContact C-N 3.34Å; S658-A660 PolarHBondContact O-N 3.33Å; A660-F662 VanDerWaalsContact C-N 3.32Å; A660-A663 PolarHBondContact O-N 3.26Å; A660-P664 WeakPolarHBondContact O-CD 3.44Å
661	I	92.8	Very high	89.7	Confident	11 Å²	11	20.8 Å²	20.8	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-64.7	-36.3	173.7	-67.4	168	0	0	0	111.3	F200 M203 V657 S658 Q659 P664 A700	F200-I661 HydrophobicContact CD2-CG2 4.13Å; M203-I661 HydrophobicContact CB-CD1 4.03Å; M203-I661 HydrophobicContact CB-CG1 3.56Å; M203-I661 HydrophobicContact CG-CG1 3.88Å; V657-I661 HydrophobicContact CG1-CD1 4.18Å; V657-I661 WeakPolarHBondContact O-CG1 3.39Å; V657-I661 PolarHBondContact O-N 2.94Å; S658-I661 PolarHBondContact O-N 2.89Å; Q659-I661 VanDerWaalsContact C-N 3.34Å; Q659-I661 PolarHBondContact O-N 3.44Å; I661-P664 WeakPolarHBondContact O-CD 3.32Å; I661-A700 HydrophobicContact CG2-CB 3.92Å
662	F	91.9	Very high	90.2	Very high	61 Å²	61	16.4 Å²	16.4	27%	0.268	8%	0.084	S	C	.	.	H	α-helix	trans	-77.3	-25.1	178.9	-79	-73	0	0	0	113.6	S658 Q659 A660 L665 A700 F701 I704	S658-F662 WeakPolarHBondContact O-CD2 3.41Å; S658-F662 PolarHBondContact O-N 3.42Å; S658-F662 VanDerWaalsContact O-N 3.13Å; Q659-F662 PolarHBondContact O-N 2.97Å; Q659-F662 VanDerWaalsContact O-N 3.13Å; A660-F662 VanDerWaalsContact C-N 3.32Å; F662-L665 HydrophobicContact CD1-CD1 3.4Å; F662-L665 VanDerWaalsContact CD1-CD1 3.4Å; F662-L665 HydrophobicContact CE1-CD1 3.94Å; F662-L665 HydrophobicContact CG-CD1 4.34Å; F662-L665 VanDerWaalsContact O-CB 3.28Å; F662-L665 WeakPolarHBondContact O-CB 3.28Å; F662-L665 PolarHBondContact O-N 2.9Å; F662-L665 VanDerWaalsContact O-N 3.07Å; F662-A700 HydrophobicContact CE1-CB 4.48Å; F662-F701 HydrophobicContact CE1-CE1 4.15Å; F662-F701 HydrophobicContact CE1-CZ 4.24Å; F662-F701 HydrophobicContact CZ-CD1 4.2Å; F662-F701 AromaticContact CZ-CE1 3.87Å; F662-F701 HydrophobicContact CZ-CE1 3.87Å; F662-F701 HydrophobicContact CZ-CZ 4.41Å; F662-I704 HydrophobicContact CD2-CD1 4.19Å; F662-I704 HydrophobicContact CE2-CD1 3.24Å; F662-I704 HydrophobicContact CZ-CD1 3.58Å
663	A	93.4	Very high	90.2	Very high	1 Å²	1	18 Å²	18	1%	0.008	9%	0.09	C	C	.	.	H	α-helix	trans	-56.5	-45.2	-175.6	0	0	0	0	0	114.5	F607 S608 M611 Q659 A660 L665 L666	F607-A663 HydrophobicContact CD1-CB 3.75Å; F607-A663 HydrophobicContact CE1-CB 3.72Å; S608-A663 WeakPolarHBondContact OG-CB 3.15Å; M611-A663 HydrophobicContact CG-CB 4.47Å; Q659-A663 PolarHBondContact O-N 2.88Å; A660-A663 PolarHBondContact O-N 3.26Å; A663-L665 PolarHBondContact O-N 2.97Å; A663-L666 WeakPolarHBondContact O-CB 3.5Å; A663-L666 PolarHBondContact O-N 3.37Å
664	P	94.2	Very high	90	Very high	4 Å²	4	17.9 Å²	17.9	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-67.7	-19.2	177	-16.8	28.9	0	0	0	114.5	F196 N199 M611 A660 I661 L666 G667 L668	F196-P664 HydrophobicContact CB-CB 4.24Å; F196-P664 HydrophobicContact CD2-CB 4.22Å; N199-P664 HydrophobicContact CB-CG 3.8Å; M611-P664 HydrophobicContact CE-CB 4.02Å; M611-P664 HydrophobicContact CE-CG 4.01Å; M611-P664 HydrophobicContact CG-CG 4.44Å; A660-P664 WeakPolarHBondContact O-CD 3.44Å; I661-P664 WeakPolarHBondContact O-CD 3.32Å; P664-L666 PolarHBondContact O-N 2.81Å; P664-G667 PolarHBondContact O-N 2.92Å; P664-G667 VanDerWaalsContact O-N 3.09Å; P664-L668 PolarHBondContact O-N 3.44Å; P664-L668 VanDerWaalsContact O-N 3.08Å
665	L	93.7	Very high	90	Very high	10 Å²	10	15.4 Å²	15.4	5%	0.052	8%	0.078	C	C	.	.	H	α-helix	trans	-64.2	-30.4	174	-64.2	171.9	0	0	0	111.3	F196 F662 A663 G667 L668 F669 L693 A696 M697 A700	F196-L665 HydrophobicContact CD2-CD2 3.96Å; F196-L665 HydrophobicContact CD2-CG 4.36Å; F196-L665 HydrophobicContact CE2-CD2 3.72Å; F196-L665 HydrophobicContact CE2-CG 4.1Å; F196-L665 HydrophobicContact CZ-CD2 4.44Å; F662-L665 HydrophobicContact CD1-CD1 3.4Å; F662-L665 VanDerWaalsContact CD1-CD1 3.4Å; F662-L665 HydrophobicContact CE1-CD1 3.94Å; F662-L665 HydrophobicContact CG-CD1 4.34Å; F662-L665 VanDerWaalsContact O-CB 3.28Å; F662-L665 WeakPolarHBondContact O-CB 3.28Å; F662-L665 PolarHBondContact O-N 2.9Å; F662-L665 VanDerWaalsContact O-N 3.07Å; A663-L665 PolarHBondContact O-N 2.97Å; L665-G667 VanDerWaalsContact C-N 3.33Å; L665-L668 HydrophobicContact CD2-CD1 4.19Å; L665-L668 PolarHBondContact O-N 2.83Å; L665-F669 WeakPolarHBondContact O-CB 3.39Å; L665-F669 PolarHBondContact O-N 2.96Å; L665-L693 HydrophobicContact CD2-CD1 4.44Å; L665-A696 HydrophobicContact CD2-CB 3.49Å; L665-A696 VanDerWaalsContact CD2-CB 3.49Å; L665-M697 HydrophobicContact CB-SD 4.29Å; L665-M697 HydrophobicContact CD1-CE 4.3Å; L665-M697 HydrophobicContact CD1-SD 3.36Å; L665-M697 WeakPolarHBondContact CD1-SD 3.27Å; L665-M697 HydrophobicContact CD2-CG 4.42Å; L665-M697 HydrophobicContact CD2-SD 3.89Å; L665-M697 HydrophobicContact CG-SD 4.04Å; L665-A700 HydrophobicContact CD1-CB 4.01Å
666	L	90.6	Very high	89.8	Confident	27 Å²	27	18.6 Å²	18.6	14%	0.141	9%	0.093	C	C	.	.	H	α-helix	trans	-63.8	-40	172.7	-171	59.3	0	0	0	111.2	V499 V503 A612 A663 P664 F669 W670	V499-L666 HydrophobicContact CG1-CD2 4.32Å; V503-L666 HydrophobicContact CB-CD2 4.5Å; V503-L666 HydrophobicContact CG1-CD2 3.81Å; A612-L666 HydrophobicContact CB-CB 4.43Å; A612-L666 HydrophobicContact CB-CD2 3.86Å; A612-L666 HydrophobicContact CB-CG 3.9Å; A663-L666 WeakPolarHBondContact O-CB 3.5Å; A663-L666 PolarHBondContact O-N 3.37Å; P664-L666 PolarHBondContact O-N 2.81Å; L666-F669 PolarHBondContact O-N 3.24Å; L666-W670 PolarHBondContact O-N 2.94Å
667	G	90.6	Very high	89.1	Confident	4 Å²	4	20.5 Å²	20.5	4%	0.041	10%	0.103	C	C	.	.	H	α-helix	trans	-64.1	-43.5	174.1	0	0	0	0	0	113	P664 L665 F669 W670 M671	P664-G667 PolarHBondContact O-N 2.92Å; P664-G667 VanDerWaalsContact O-N 3.09Å; L665-G667 VanDerWaalsContact C-N 3.33Å; G667-F669 VanDerWaalsContact C-N 3.33Å; G667-F669 PolarHBondContact O-N 3.32Å; G667-W670 PolarHBondContact O-N 3.24Å; G667-M671 WeakPolarHBondContact O-CG 3.1Å; G667-M671 PolarHBondContact O-N 3.48Å
668	L	93.4	Very high	88.4	Confident	3 Å²	3	23 Å²	23	2%	0.016	11%	0.113	C	C	.	.	H	α-helix	trans	-62.7	-39.9	174	-74.4	167.8	0	0	0	112.1	S192 F196 P664 L665 M671 L672 L693 A696	S192-L668 VanDerWaalsContact OG-CD2 3.29Å; S192-L668 WeakPolarHBondContact OG-CD2 3.16Å; F196-L668 HydrophobicContact CB-CD1 3.93Å; F196-L668 HydrophobicContact CD2-CD1 4.41Å; F196-L668 HydrophobicContact CG-CD1 4.12Å; P664-L668 PolarHBondContact O-N 3.44Å; P664-L668 VanDerWaalsContact O-N 3.08Å; L665-L668 HydrophobicContact CD2-CD1 4.19Å; L665-L668 PolarHBondContact O-N 2.83Å; L668-M671 PolarHBondContact O-N 2.87Å; L668-L672 PolarHBondContact O-N 3.42Å; L668-L693 HydrophobicContact CB-CD1 3.81Å; L668-A696 HydrophobicContact CD1-CB 3.55Å
669	F	90.4	Very high	88	Confident	85 Å²	85	22.9 Å²	22.9	37%	0.373	11%	0.109	S	C	.	.	H	α-helix	trans	-61.8	-44.2	173.6	174.5	-97.4	0	0	0	111.7	L665 L666 G667 M671 L672 F673	L665-F669 WeakPolarHBondContact O-CB 3.39Å; L665-F669 PolarHBondContact O-N 2.96Å; L666-F669 PolarHBondContact O-N 3.24Å; G667-F669 VanDerWaalsContact C-N 3.33Å; G667-F669 PolarHBondContact O-N 3.32Å; F669-M671 VanDerWaalsContact C-N 3.32Å; F669-M671 PolarHBondContact O-N 3.38Å; F669-L672 WeakPolarHBondContact O-CB 3.36Å; F669-L672 PolarHBondContact O-N 2.93Å; F669-F673 WeakPolarHBondContact O-CB 3.45Å; F669-F673 PolarHBondContact O-N 3.01Å
670	W	86.1	Confident	87.5	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.015	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-36.8	175.5	-72.3	122.3	0	0	0	112.7	M508 F537 L666 G667 F673 F674	M508-W670 HydrophobicContact CG-CH2 4.08Å; F537-W670 AromaticContact CE1-CE3 3.89Å; F537-W670 HydrophobicContact CE1-CE3 3.89Å; F537-W670 AromaticContact CZ-CE3 3.85Å; F537-W670 HydrophobicContact CZ-CE3 3.85Å; F537-W670 HydrophobicContact CZ-CZ3 4.47Å; L666-W670 PolarHBondContact O-N 2.94Å; G667-W670 PolarHBondContact O-N 3.24Å; W670-F673 HydrophobicContact CE3-CB 4.42Å; W670-F673 AromaticContact CE3-CD1 3.82Å; W670-F673 HydrophobicContact CE3-CD1 3.82Å; W670-F673 HydrophobicContact CE3-CG 4.48Å; W670-F673 AromaticContact CZ3-CD1 3.68Å; W670-F673 HydrophobicContact CZ3-CD1 3.68Å; W670-F673 HydrophobicContact CZ3-CE1 4.09Å; W670-F673 PolarHBondContact O-N 2.99Å; W670-F674 VanDerWaalsContact O-CB 3.28Å; W670-F674 WeakPolarHBondContact O-CB 3.45Å; W670-F674 PolarHBondContact O-N 3.32Å
671	M	88.4	Confident	87	Confident	4 Å²	4	27.4 Å²	27.4	2%	0.02	15%	0.146	C	C	.	.	H	α-helix	trans	-65.4	-40.2	173.6	-74.6	-56.7	-58	0	0	112.6	I175 H188 I615 T616 G667 L668 F669 S675	I175-M671 HydrophobicContact CD1-CE 3.75Å; I175-M671 HydrophobicContact CD1-SD 3.88Å; H188-M671 HydrophobicContact CB-CE 3.75Å; I615-M671 HydrophobicContact CB-CG 4.47Å; I615-M671 HydrophobicContact CB-SD 4.04Å; I615-M671 HydrophobicContact CG2-CE 4.15Å; I615-M671 HydrophobicContact CG2-CG 4.27Å; I615-M671 HydrophobicContact CG2-SD 3.45Å; I615-M671 WeakPolarHBondContact CG2-SD 3.23Å; T616-M671 HydrophobicContact CG2-SD 4.3Å; G667-M671 WeakPolarHBondContact O-CG 3.1Å; G667-M671 PolarHBondContact O-N 3.48Å; L668-M671 PolarHBondContact O-N 2.87Å; F669-M671 VanDerWaalsContact C-N 3.32Å; F669-M671 PolarHBondContact O-N 3.38Å; M671-S675 WeakPolarHBondContact O-CB 3.26Å; M671-S675 PolarHBondContact O-N 3.33Å; M671-S675 PolarHBondContact O-OG 2.87Å
672	L	89.3	Confident	86.6	Confident	16 Å²	16	34.6 Å²	34.6	8%	0.084	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-47.1	172.1	175.6	62.3	0	0	0	111.1	L668 F669 F674 S675 L676 T686 L690 L693	L668-L672 PolarHBondContact O-N 3.42Å; F669-L672 WeakPolarHBondContact O-CB 3.36Å; F669-L672 PolarHBondContact O-N 2.93Å; L672-F674 VanDerWaalsContact C-N 3.33Å; L672-F674 PolarHBondContact O-N 3.02Å; L672-S675 WeakPolarHBondContact CA-OG 3.47Å; L672-S675 PolarHBondContact O-N 3.39Å; L672-S675 PolarHBondContact O-OG 3.32Å; L672-L676 HydrophobicContact CD1-CD1 3.95Å; L672-L676 HydrophobicContact CD1-CG 4.03Å; L672-L676 HydrophobicContact CG-CD1 3.85Å; L672-L676 HydrophobicContact CG-CG 4.38Å; L672-L676 WeakPolarHBondContact O-CB 3.32Å; L672-L676 VanDerWaalsContact O-CG 3.32Å; L672-L676 WeakPolarHBondContact O-CG 3.4Å; L672-L676 PolarHBondContact O-N 2.8Å; L672-T686 HydrophobicContact CD1-CG2 4.22Å; L672-L690 HydrophobicContact CD1-CB 3.93Å; L672-L690 HydrophobicContact CD1-CD1 4.49Å; L672-L690 HydrophobicContact CD2-CD1 3.86Å; L672-L693 HydrophobicContact CD2-CD2 3.66Å
673	F	83.9	Confident	86.4	Confident	34 Å²	34	35.2 Å²	35.2	15%	0.149	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-42.8	179.3	-172.7	-119.2	0	0	0	111.5	F533 V536 F537 F669 W670 L677	F533-F673 HydrophobicContact CD1-CZ 4.23Å; V536-F673 HydrophobicContact CG1-CE1 4.36Å; F537-F673 HydrophobicContact CD2-CD1 4.36Å; F537-F673 HydrophobicContact CD2-CE1 4.44Å; F537-F673 HydrophobicContact CE1-CD1 4.46Å; F537-F673 HydrophobicContact CE2-CB 4.48Å; F537-F673 AromaticContact CE2-CD1 3.25Å; F537-F673 HydrophobicContact CE2-CD1 3.25Å; F537-F673 AromaticContact CE2-CE1 3.7Å; F537-F673 HydrophobicContact CE2-CE1 3.7Å; F537-F673 HydrophobicContact CE2-CG 4.13Å; F537-F673 HydrophobicContact CZ-CB 4.2Å; F537-F673 AromaticContact CZ-CD1 3.35Å; F537-F673 HydrophobicContact CZ-CD1 3.35Å; F537-F673 HydrophobicContact CZ-CE1 4.13Å; F537-F673 HydrophobicContact CZ-CG 4.19Å; F669-F673 WeakPolarHBondContact O-CB 3.45Å; F669-F673 PolarHBondContact O-N 3.01Å; W670-F673 HydrophobicContact CE3-CB 4.42Å; W670-F673 AromaticContact CE3-CD1 3.82Å; W670-F673 HydrophobicContact CE3-CD1 3.82Å; W670-F673 HydrophobicContact CE3-CG 4.48Å; W670-F673 AromaticContact CZ3-CD1 3.68Å; W670-F673 HydrophobicContact CZ3-CD1 3.68Å; W670-F673 HydrophobicContact CZ3-CE1 4.09Å; W670-F673 PolarHBondContact O-N 2.99Å; F673-L677 HydrophobicContact CD1-CD1 4.09Å; F673-L677 HydrophobicContact CD2-CD1 4.37Å; F673-L677 HydrophobicContact CE1-CD1 3.59Å; F673-L677 HydrophobicContact CE2-CD1 3.92Å; F673-L677 HydrophobicContact CE2-CG 4.28Å; F673-L677 HydrophobicContact CG-CD1 4.44Å; F673-L677 HydrophobicContact CZ-CD1 3.51Å; F673-L677 HydrophobicContact CZ-CG 4.34Å; F673-L677 WeakPolarHBondContact O-CG 3.17Å; F673-L677 PolarHBondContact O-N 2.75Å; F673-L677 VanDerWaalsContact O-N 3.15Å
674	F	82	Confident	86.2	Confident	6 Å²	6	37.8 Å²	37.8	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-47.2	174.5	178.6	-93.4	0	0	0	112.5	I175 V176 L185 F537 W670 L672 L677 R678	I175-F674 HydrophobicContact CB-CZ 4.37Å; I175-F674 HydrophobicContact CD1-CD1 4.13Å; I175-F674 HydrophobicContact CD1-CE1 3.88Å; I175-F674 HydrophobicContact CD1-CZ 4.23Å; I175-F674 HydrophobicContact CG1-CE1 3.95Å; I175-F674 HydrophobicContact CG1-CZ 3.86Å; I175-F674 HydrophobicContact CG2-CD2 4.1Å; I175-F674 HydrophobicContact CG2-CE1 4.49Å; I175-F674 HydrophobicContact CG2-CE2 3.69Å; I175-F674 HydrophobicContact CG2-CZ 3.87Å; V176-F674 HydrophobicContact CG2-CE2 4.39Å; L185-F674 HydrophobicContact CD1-CE1 3.83Å; L185-F674 HydrophobicContact CD2-CE1 4.34Å; F537-F674 HydrophobicContact CD1-CD2 4.49Å; F537-F674 HydrophobicContact CD2-CD2 4.12Å; F537-F674 HydrophobicContact CE1-CB 4.36Å; F537-F674 HydrophobicContact CE2-CB 3.88Å; F537-F674 HydrophobicContact CE2-CD2 4.28Å; F537-F674 HydrophobicContact CG-CD2 4.19Å; F537-F674 HydrophobicContact CZ-CB 3.74Å; W670-F674 VanDerWaalsContact O-CB 3.28Å; W670-F674 WeakPolarHBondContact O-CB 3.45Å; W670-F674 PolarHBondContact O-N 3.32Å; L672-F674 VanDerWaalsContact C-N 3.33Å; L672-F674 PolarHBondContact O-N 3.02Å; F674-L677 PolarHBondContact O-N 3.22Å; F674-R678 WeakPolarHBondContact O-CB 3.47Å; F674-R678 PolarHBondContact O-N 3.1Å; F674-R678 VanDerWaalsContact O-N 3.1Å
675	S	84.9	Confident	86	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-39.3	-179.5	53.9	0	0	0	0	112.7	M671 L672 L679 G680 T686	M671-S675 WeakPolarHBondContact O-CB 3.26Å; M671-S675 PolarHBondContact O-N 3.33Å; M671-S675 PolarHBondContact O-OG 2.87Å; L672-S675 WeakPolarHBondContact CA-OG 3.47Å; L672-S675 PolarHBondContact O-N 3.39Å; L672-S675 PolarHBondContact O-OG 3.32Å; S675-L679 WeakPolarHBondContact O-CA 3.26Å; S675-L679 WeakPolarHBondContact O-CB 3.29Å; S675-L679 PolarHBondContact O-N 3.44Å; S675-G680 PolarHBondContact O-N 2.85Å; S675-T686 PolarHBondContact O-OG1 3.21Å
676	L	84.2	Confident	85.8	Confident	75 Å²	75	37.5 Å²	37.5	39%	0.393	21%	0.207	S	C	.	.	H	α-helix	trans	-59.4	-47.8	174.6	-77.6	167.7	0	0	0	112.3	L672 G680 T686	L672-L676 HydrophobicContact CD1-CD1 3.95Å; L672-L676 HydrophobicContact CD1-CG 4.03Å; L672-L676 HydrophobicContact CG-CD1 3.85Å; L672-L676 HydrophobicContact CG-CG 4.38Å; L672-L676 WeakPolarHBondContact O-CB 3.32Å; L672-L676 VanDerWaalsContact O-CG 3.32Å; L672-L676 WeakPolarHBondContact O-CG 3.4Å; L672-L676 PolarHBondContact O-N 2.8Å; L676-G680 WeakPolarHBondContact O-CA 3.34Å; L676-G680 PolarHBondContact O-N 3.48Å; L676-T686 HydrophobicContact CB-CG2 4.44Å; L676-T686 HydrophobicContact CD2-CG2 3.45Å; L676-T686 VanDerWaalsContact CD2-CG2 3.45Å; L676-T686 HydrophobicContact CG-CG2 3.68Å
677	L	76.6	Confident	86	Confident	40 Å²	40	40.8 Å²	40.8	21%	0.209	22%	0.223	C	C	.	.	H	α-helix	trans	-73.1	-32.1	-175.7	-71	177.9	0	0	0	113.8	F533 Q534 F537 F673 F674	F533-L677 HydrophobicContact CB-CD1 3.98Å; F533-L677 HydrophobicContact CB-CD2 3.88Å; F533-L677 WeakPolarHBondContact O-CD1 3.29Å; Q534-L677 PolarHBondContact NE2-O 3.27Å; F537-L677 HydrophobicContact CD2-CD1 4.21Å; F537-L677 HydrophobicContact CE2-CD1 4.01Å; F673-L677 HydrophobicContact CD1-CD1 4.09Å; F673-L677 HydrophobicContact CD2-CD1 4.37Å; F673-L677 HydrophobicContact CE1-CD1 3.59Å; F673-L677 HydrophobicContact CE2-CD1 3.92Å; F673-L677 HydrophobicContact CE2-CG 4.28Å; F673-L677 HydrophobicContact CG-CD1 4.44Å; F673-L677 HydrophobicContact CZ-CD1 3.51Å; F673-L677 HydrophobicContact CZ-CG 4.34Å; F673-L677 WeakPolarHBondContact O-CG 3.17Å; F673-L677 PolarHBondContact O-N 2.75Å; F673-L677 VanDerWaalsContact O-N 3.15Å; F674-L677 PolarHBondContact O-N 3.22Å
678	R	75.8	Confident	86.1	Confident	56 Å²	56	43.3 Å²	43.3	21%	0.211	23%	0.233	C	C	.	.	H	α-helix	trans	-103.3	-33.1	-171.2	-155.5	-170.3	-178.3	174.5	4.3	114.4	I175 V176 V178 T180 F674	I175-R678 PolarHBondContact O-NH1 3.03Å; V176-R678 VanDerWaalsContact O-CZ 3.28Å; V176-R678 PolarHBondContact O-NH1 2.73Å; V176-R678 PolarHBondContact O-NH2 3.46Å; V178-R678 PolarHBondContact O-NH1 3.08Å; V178-R678 PolarHBondContact O-NH2 3.03Å; T180-R678 HydrophobicContact CG2-CG 3.58Å; F674-R678 WeakPolarHBondContact O-CB 3.47Å; F674-R678 PolarHBondContact O-N 3.1Å; F674-R678 VanDerWaalsContact O-N 3.1Å
679	L	80.9	Confident	86	Confident	28 Å²	28	43.3 Å²	43.3	15%	0.147	23%	0.233	C	C	.	.	H	α-helix	trans	-108.2	-18	-178	-62.7	94.2	0	0	0	112.9	L185 S675 H683 I685	L185-L679 HydrophobicContact CD2-CD1 3.43Å; L185-L679 VanDerWaalsContact CD2-CD1 3.43Å; L185-L679 HydrophobicContact CD2-CD2 3.66Å; L185-L679 HydrophobicContact CD2-CG 4.18Å; S675-L679 WeakPolarHBondContact O-CA 3.26Å; S675-L679 WeakPolarHBondContact O-CB 3.29Å; S675-L679 PolarHBondContact O-N 3.44Å; L679-H683 HydrophobicContact CB-CB 3.83Å; L679-H683 WeakPolarHBondContact CD2-CD2 3.42Å; L679-H683 WeakPolarHBondContact CD2-NE2 3.2Å; L679-I685 HydrophobicContact CD2-CD1 4.06Å
680	G	81	Confident	86.2	Confident	28 Å²	28	42.5 Å²	42.5	29%	0.289	23%	0.232	S	C	.	.			trans	88.3	167.6	-176.6	0	0	0	0	0	113.4	S675 L676 L682 T686	S675-G680 PolarHBondContact O-N 2.85Å; L676-G680 WeakPolarHBondContact O-CA 3.34Å; L676-G680 PolarHBondContact O-N 3.48Å; G680-L682 PolarHBondContact O-N 3.29Å; G680-T686 WeakPolarHBondContact O-CB 3.41Å; G680-T686 PolarHBondContact O-OG1 2.89Å
681	S	82.3	Confident	86.6	Confident	76 Å²	76	45 Å²	45	53%	0.531	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-32.5	-172.8	55.7	0	0	0	0	114.3
682	L	84.6	Confident	86.9	Confident	162 Å²	162	45.1 Å²	45.1	85%	0.848	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-1.2	-175.2	-62.1	178.8	0	0	0	114	G680	G680-L682 PolarHBondContact O-N 3.29Å
683	H	87.8	Confident	87.2	Confident	74 Å²	74	45.4 Å²	45.4	34%	0.343	25%	0.253	S	S	.	.	S	Bend	trans	-74.9	144	-179.1	-164.7	83.4	0	0	0	111.8	L679 I685 T686 M687	L679-H683 HydrophobicContact CB-CB 3.83Å; L679-H683 WeakPolarHBondContact CD2-CD2 3.42Å; L679-H683 WeakPolarHBondContact CD2-NE2 3.2Å; H683-I685 VanDerWaalsContact C-N 3.32Å; H683-I685 PolarHBondContact CD2-N 2.89Å; H683-I685 PolarHBondContact O-N 2.88Å; H683-T686 WeakPolarHBondContact O-CB 3.43Å; H683-T686 PolarHBondContact O-N 2.82Å; H683-M687 PolarHBondContact O-N 3.26Å; H683-M687 VanDerWaalsContact O-N 3.11Å
684	A	90.6	Very high	87.8	Confident	55 Å²	55	48.5 Å²	48.5	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-58.4	-39.5	-174.1	0	0	0	0	0	113.5	W186 T686 M687 F688	W186-A684 HydrophobicContact CZ2-CB 3.94Å; A684-T686 VanDerWaalsContact C-N 3.33Å; A684-T686 PolarHBondContact O-N 3.17Å; A684-M687 PolarHBondContact O-N 3.15Å; A684-F688 WeakPolarHBondContact O-CB 3.4Å; A684-F688 PolarHBondContact O-N 3.08Å
685	I	89.3	Confident	88.4	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-36.7	177.6	-59.1	173.5	0	0	0	111.5	L185 W186 L679 H683 F688 S689	L185-I685 HydrophobicContact CB-CD1 3.89Å; L185-I685 HydrophobicContact CD2-CD1 3.9Å; L185-I685 HydrophobicContact CD2-CG2 4.36Å; L185-I685 HydrophobicContact CG-CD1 4.17Å; W186-I685 HydrophobicContact CD2-CG1 3.99Å; W186-I685 HydrophobicContact CG-CD1 4.25Å; W186-I685 HydrophobicContact CG-CG1 4.21Å; W186-I685 HydrophobicContact CZ2-CG1 3.98Å; L679-I685 HydrophobicContact CD2-CD1 4.06Å; H683-I685 VanDerWaalsContact C-N 3.32Å; H683-I685 PolarHBondContact CD2-N 2.89Å; H683-I685 PolarHBondContact O-N 2.88Å; I685-F688 PolarHBondContact O-N 3.29Å; I685-S689 WeakPolarHBondContact O-CB 3.48Å; I685-S689 PolarHBondContact O-N 2.9Å; I685-S689 PolarHBondContact O-OG 3.41Å
686	T	90.3	Very high	88.9	Confident	4 Å²	4	52 Å²	52	3%	0.025	29%	0.288	C	S	.	.	H	α-helix	trans	-66.6	-45.4	177.3	-47.1	0	0	0	0	110.7	L672 S675 L676 G680 H683 A684 F688 S689 L690	L672-T686 HydrophobicContact CD1-CG2 4.22Å; S675-T686 PolarHBondContact O-OG1 3.21Å; L676-T686 HydrophobicContact CB-CG2 4.44Å; L676-T686 HydrophobicContact CD2-CG2 3.45Å; L676-T686 VanDerWaalsContact CD2-CG2 3.45Å; L676-T686 HydrophobicContact CG-CG2 3.68Å; G680-T686 WeakPolarHBondContact O-CB 3.41Å; G680-T686 PolarHBondContact O-OG1 2.89Å; H683-T686 WeakPolarHBondContact O-CB 3.43Å; H683-T686 PolarHBondContact O-N 2.82Å; A684-T686 VanDerWaalsContact C-N 3.33Å; A684-T686 PolarHBondContact O-N 3.17Å; T686-F688 VanDerWaalsContact C-N 3.34Å; T686-F688 PolarHBondContact O-N 3.49Å; T686-S689 PolarHBondContact O-N 2.81Å; T686-L690 WeakPolarHBondContact O-CB 3.45Å; T686-L690 PolarHBondContact O-N 3.34Å
687	M	93.1	Very high	89.4	Confident	97 Å²	97	51.2 Å²	51.2	48%	0.478	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-38.9	175.7	-66.3	-59	-66.8	0	0	112.4	H683 A684 S691	H683-M687 PolarHBondContact O-N 3.26Å; H683-M687 VanDerWaalsContact O-N 3.11Å; A684-M687 PolarHBondContact O-N 3.15Å; M687-S691 WeakPolarHBondContact O-CB 3.35Å; M687-S691 PolarHBondContact O-N 3.27Å; M687-S691 PolarHBondContact O-OG 3.21Å
688	F	93.8	Very high	90.3	Very high	57 Å²	57	55.1 Å²	55.1	25%	0.25	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-42.5	174.3	178.7	-102.4	0	0	0	112	W186 S189 L190 A684 I685 T686 L690 S691 T692	W186-F688 HydrophobicContact CE3-CD1 4.38Å; W186-F688 HydrophobicContact CH2-CB 4.1Å; W186-F688 HydrophobicContact CH2-CG 4.3Å; W186-F688 HydrophobicContact CZ3-CB 4.01Å; W186-F688 AromaticContact CZ3-CD1 3.86Å; W186-F688 HydrophobicContact CZ3-CD1 3.86Å; W186-F688 HydrophobicContact CZ3-CD2 4.18Å; W186-F688 HydrophobicContact CZ3-CE1 4.44Å; W186-F688 AromaticContact CZ3-CG 3.74Å; W186-F688 HydrophobicContact CZ3-CG 3.74Å; S189-F688 WeakPolarHBondContact OG-CD1 3.38Å; S189-F688 VanDerWaalsContact OG-CE1 3.32Å; S189-F688 WeakPolarHBondContact OG-CE1 3.31Å; L190-F688 HydrophobicContact CD2-CE1 4.01Å; L190-F688 HydrophobicContact CD2-CZ 3.69Å; L190-F688 HydrophobicContact CG-CE1 4.46Å; A684-F688 WeakPolarHBondContact O-CB 3.4Å; A684-F688 PolarHBondContact O-N 3.08Å; I685-F688 PolarHBondContact O-N 3.29Å; T686-F688 VanDerWaalsContact C-N 3.34Å; T686-F688 PolarHBondContact O-N 3.49Å; F688-L690 VanDerWaalsContact C-N 3.34Å; F688-L690 PolarHBondContact O-N 2.94Å; F688-S691 PolarHBondContact O-N 2.87Å; F688-T692 HydrophobicContact CD1-CG2 4.24Å; F688-T692 HydrophobicContact CD2-CG2 4.25Å; F688-T692 HydrophobicContact CE1-CG2 3.74Å; F688-T692 HydrophobicContact CE2-CG2 3.75Å; F688-T692 HydrophobicContact CG-CG2 4.46Å; F688-T692 HydrophobicContact CZ-CG2 3.46Å; F688-T692 VanDerWaalsContact CZ-CG2 3.46Å; F688-T692 WeakPolarHBondContact O-CB 3.4Å; F688-T692 WeakPolarHBondContact O-CG2 3.27Å; F688-T692 PolarHBondContact O-N 3.38Å; F688-T692 PolarHBondContact O-OG1 3.41Å
689	S	91.4	Very high	91.1	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.014	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-38.5	175.8	-60.1	0	0	0	0	111.9	S189 I685 T686 T692 L693	S189-S689 PolarHBondContact OG-OG 3.49Å; I685-S689 WeakPolarHBondContact O-CB 3.48Å; I685-S689 PolarHBondContact O-N 2.9Å; I685-S689 PolarHBondContact O-OG 3.41Å; T686-S689 PolarHBondContact O-N 2.81Å; S689-T692 WeakPolarHBondContact CA-OG1 3.42Å; S689-T692 PolarHBondContact O-OG1 3.29Å; S689-L693 WeakPolarHBondContact O-CB 3.47Å; S689-L693 PolarHBondContact O-N 3.11Å
690	L	94.3	Very high	91.6	Very high	69 Å²	69	53.4 Å²	53.4	36%	0.361	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-46.7	174	-179.6	64.9	0	0	0	111.3	L672 T686 F688 L693 L694	L672-L690 HydrophobicContact CD1-CB 3.93Å; L672-L690 HydrophobicContact CD1-CD1 4.49Å; L672-L690 HydrophobicContact CD2-CD1 3.86Å; T686-L690 WeakPolarHBondContact O-CB 3.45Å; T686-L690 PolarHBondContact O-N 3.34Å; F688-L690 VanDerWaalsContact C-N 3.34Å; F688-L690 PolarHBondContact O-N 2.94Å; L690-L693 PolarHBondContact O-N 3.32Å; L690-L694 HydrophobicContact CD1-CD1 4.48Å; L690-L694 HydrophobicContact CG-CD1 4.26Å; L690-L694 WeakPolarHBondContact O-CG 3.47Å; L690-L694 PolarHBondContact O-N 3.5Å
691	S	95	Very high	92.1	Very high	57 Å²	57	57.7 Å²	57.7	40%	0.399	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-44.5	-179.6	-63.3	0	0	0	0	111.7	M687 F688 L694 I695	M687-S691 WeakPolarHBondContact O-CB 3.35Å; M687-S691 PolarHBondContact O-N 3.27Å; M687-S691 PolarHBondContact O-OG 3.21Å; F688-S691 PolarHBondContact O-N 2.87Å; S691-L694 PolarHBondContact O-N 2.94Å; S691-I695 WeakPolarHBondContact O-CB 3.5Å; S691-I695 VanDerWaalsContact O-CG1 3.23Å; S691-I695 WeakPolarHBondContact O-CG1 3.38Å; S691-I695 PolarHBondContact O-N 2.86Å
692	T	94.8	Very high	92.4	Very high	5 Å²	5	56.3 Å²	56.3	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-38.9	176	49.3	0	0	0	0	112.3	F193 F688 S689 A696	F193-T692 HydrophobicContact CB-CG2 4.13Å; F193-T692 HydrophobicContact CD1-CG2 4.44Å; F193-T692 HydrophobicContact CD2-CG2 3.99Å; F193-T692 HydrophobicContact CG-CG2 3.94Å; F688-T692 HydrophobicContact CD1-CG2 4.24Å; F688-T692 HydrophobicContact CD2-CG2 4.25Å; F688-T692 HydrophobicContact CE1-CG2 3.74Å; F688-T692 HydrophobicContact CE2-CG2 3.75Å; F688-T692 HydrophobicContact CG-CG2 4.46Å; F688-T692 HydrophobicContact CZ-CG2 3.46Å; F688-T692 VanDerWaalsContact CZ-CG2 3.46Å; F688-T692 WeakPolarHBondContact O-CB 3.4Å; F688-T692 WeakPolarHBondContact O-CG2 3.27Å; F688-T692 PolarHBondContact O-N 3.38Å; F688-T692 PolarHBondContact O-OG1 3.41Å; S689-T692 WeakPolarHBondContact CA-OG1 3.42Å; S689-T692 PolarHBondContact O-OG1 3.29Å; T692-A696 WeakPolarHBondContact O-CB 3.17Å; T692-A696 PolarHBondContact O-N 3.15Å
693	L	95.2	Very high	92.3	Very high	22 Å²	22	49.6 Å²	49.6	12%	0.115	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-48.5	172.6	179.6	64.4	0	0	0	111.4	L665 L668 L672 S689 L690 I695 A696 M697	L665-L693 HydrophobicContact CD2-CD1 4.44Å; L668-L693 HydrophobicContact CB-CD1 3.81Å; L672-L693 HydrophobicContact CD2-CD2 3.66Å; S689-L693 WeakPolarHBondContact O-CB 3.47Å; S689-L693 PolarHBondContact O-N 3.11Å; L690-L693 PolarHBondContact O-N 3.32Å; L693-I695 PolarHBondContact O-N 3.18Å; L693-A696 PolarHBondContact O-N 2.98Å; L693-M697 HydrophobicContact CD1-CG 4.38Å; L693-M697 VanDerWaalsContact O-CG 3.26Å; L693-M697 WeakPolarHBondContact O-CG 3.34Å; L693-M697 PolarHBondContact O-N 3.29Å
694	L	95.5	Very high	92	Very high	99 Å²	99	47.7 Å²	47.7	52%	0.518	27%	0.265	S	S	.	.	H	α-helix	trans	-61.3	-44.9	179	-70.2	174	0	0	0	112	L690 S691 M697 L698	L690-L694 HydrophobicContact CD1-CD1 4.48Å; L690-L694 HydrophobicContact CG-CD1 4.26Å; L690-L694 WeakPolarHBondContact O-CG 3.47Å; L690-L694 PolarHBondContact O-N 3.5Å; S691-L694 PolarHBondContact O-N 2.94Å; L694-M697 PolarHBondContact O-N 3.08Å; L694-L698 WeakPolarHBondContact O-CG 3.39Å; L694-L698 PolarHBondContact O-N 3.33Å
695	I	95.9	Very high	91.5	Very high	82 Å²	82	51.1 Å²	51.1	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-61.5	-44.6	175.5	-69.1	166.1	0	0	0	110.5	F193 S691 L693 M697 L698 I699	F193-I695 HydrophobicContact CE2-CG2 4.28Å; F193-I695 HydrophobicContact CZ-CG2 4.16Å; S691-I695 WeakPolarHBondContact O-CB 3.5Å; S691-I695 VanDerWaalsContact O-CG1 3.23Å; S691-I695 WeakPolarHBondContact O-CG1 3.38Å; S691-I695 PolarHBondContact O-N 2.86Å; L693-I695 PolarHBondContact O-N 3.18Å; I695-M697 PolarHBondContact O-N 3.32Å; I695-L698 PolarHBondContact O-N 2.95Å; I695-I699 HydrophobicContact CG2-CD1 3.72Å; I695-I699 HydrophobicContact CG2-CG1 4.35Å; I695-I699 VanDerWaalsContact O-CG1 3.31Å; I695-I699 WeakPolarHBondContact O-CG1 3.26Å; I695-I699 PolarHBondContact O-N 2.94Å
696	A	95.6	Very high	90.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.3	-41.3	178.4	0	0	0	0	0	112.1	F193 F196 L665 L668 T692 L693 L698 I699 A700	F193-A696 HydrophobicContact CE2-CB 4.49Å; F196-A696 HydrophobicContact CD1-CB 3.64Å; F196-A696 HydrophobicContact CD2-CB 4.08Å; F196-A696 HydrophobicContact CE1-CB 3.52Å; F196-A696 HydrophobicContact CE2-CB 3.96Å; F196-A696 HydrophobicContact CG-CB 3.93Å; F196-A696 HydrophobicContact CZ-CB 3.69Å; F196-A696 WeakPolarHBondContact CZ-O 3.31Å; L665-A696 HydrophobicContact CD2-CB 3.49Å; L665-A696 VanDerWaalsContact CD2-CB 3.49Å; L668-A696 HydrophobicContact CD1-CB 3.55Å; T692-A696 WeakPolarHBondContact O-CB 3.17Å; T692-A696 PolarHBondContact O-N 3.15Å; L693-A696 PolarHBondContact O-N 2.98Å; A696-L698 PolarHBondContact O-N 3.29Å; A696-I699 PolarHBondContact O-N 3.03Å; A696-A700 WeakPolarHBondContact O-CB 3.08Å; A696-A700 PolarHBondContact O-N 3.4Å
697	M	94.6	Very high	89.7	Confident	58 Å²	58	57.5 Å²	57.5	29%	0.286	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-45.1	173.5	-67.5	-62.4	-58.1	0	0	111.2	L665 L693 L694 I695 A700 F701	L665-M697 HydrophobicContact CB-SD 4.29Å; L665-M697 HydrophobicContact CD1-CE 4.3Å; L665-M697 HydrophobicContact CD1-SD 3.36Å; L665-M697 WeakPolarHBondContact CD1-SD 3.27Å; L665-M697 HydrophobicContact CD2-CG 4.42Å; L665-M697 HydrophobicContact CD2-SD 3.89Å; L665-M697 HydrophobicContact CG-SD 4.04Å; L693-M697 HydrophobicContact CD1-CG 4.38Å; L693-M697 VanDerWaalsContact O-CG 3.26Å; L693-M697 WeakPolarHBondContact O-CG 3.34Å; L693-M697 PolarHBondContact O-N 3.29Å; L694-M697 PolarHBondContact O-N 3.08Å; I695-M697 PolarHBondContact O-N 3.32Å; M697-A700 PolarHBondContact O-N 2.99Å; M697-F701 HydrophobicContact CB-CD2 4.45Å; M697-F701 HydrophobicContact CB-CE2 4.49Å; M697-F701 HydrophobicContact CE-CD2 4.19Å; M697-F701 HydrophobicContact CE-CE2 3.29Å; M697-F701 HydrophobicContact CE-CZ 3.78Å; M697-F701 WeakPolarHBondContact O-CB 3.38Å; M697-F701 WeakPolarHBondContact O-CD2 3.49Å; M697-F701 PolarHBondContact O-N 2.82Å
698	L	94.6	Very high	88.4	Confident	122 Å²	122	59.7 Å²	59.7	64%	0.639	32%	0.318	S	S	*	.	H	α-helix	trans	-60.7	-45.8	176.3	-71.8	171.7	0	0	0	111.7	L694 I695 A696 A702	L694-L698 WeakPolarHBondContact O-CG 3.39Å; L694-L698 PolarHBondContact O-N 3.33Å; I695-L698 PolarHBondContact O-N 2.95Å; A696-L698 PolarHBondContact O-N 3.29Å; L698-A702 WeakPolarHBondContact O-CB 3.24Å; L698-A702 PolarHBondContact O-N 3.29Å
699	I	93.6	Very high	86.8	Confident	49 Å²	49	61.1 Å²	61.1	25%	0.251	33%	0.328	S	S	.	.	H	α-helix	trans	-62.5	-45.4	177.1	-68.4	168.5	0	0	0	110.9	F196 I197 F200 I695 A696 A702 G703	F196-I699 HydrophobicContact CE1-CB 4.11Å; F196-I699 HydrophobicContact CE1-CD1 4.32Å; F196-I699 HydrophobicContact CE1-CG2 4.04Å; F196-I699 HydrophobicContact CZ-CB 4.2Å; F196-I699 HydrophobicContact CZ-CG2 4.14Å; I197-I699 HydrophobicContact CD1-CD1 4.07Å; F200-I699 HydrophobicContact CD1-CG2 4.04Å; F200-I699 HydrophobicContact CD2-CG2 3.93Å; F200-I699 HydrophobicContact CE1-CG2 3.9Å; F200-I699 HydrophobicContact CE2-CG2 3.78Å; F200-I699 HydrophobicContact CG-CG2 4.05Å; F200-I699 HydrophobicContact CZ-CG2 3.77Å; I695-I699 HydrophobicContact CG2-CD1 3.72Å; I695-I699 HydrophobicContact CG2-CG1 4.35Å; I695-I699 VanDerWaalsContact O-CG1 3.31Å; I695-I699 WeakPolarHBondContact O-CG1 3.26Å; I695-I699 PolarHBondContact O-N 2.94Å; A696-I699 PolarHBondContact O-N 3.03Å; I699-A702 PolarHBondContact O-N 3.34Å; I699-G703 PolarHBondContact O-N 3.45Å
700	A	91.6	Very high	85.2	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.2	-48.7	179.8	0	0	0	0	0	111.5	F196 I661 F662 L665 A696 M697 G703 I704	F196-A700 HydrophobicContact CE2-CB 4.37Å; F196-A700 HydrophobicContact CZ-CB 4.27Å; I661-A700 HydrophobicContact CG2-CB 3.92Å; F662-A700 HydrophobicContact CE1-CB 4.48Å; L665-A700 HydrophobicContact CD1-CB 4.01Å; A696-A700 WeakPolarHBondContact O-CB 3.08Å; A696-A700 PolarHBondContact O-N 3.4Å; M697-A700 PolarHBondContact O-N 2.99Å; A700-G703 PolarHBondContact O-N 3.33Å; A700-I704 WeakPolarHBondContact O-CD1 3.41Å; A700-I704 VanDerWaalsContact O-CG1 3.29Å; A700-I704 WeakPolarHBondContact O-CG1 3.39Å; A700-I704 PolarHBondContact O-N 3.24Å
701	F	90.5	Very high	83.2	Confident	118 Å²	118	67.6 Å²	67.6	52%	0.518	35%	0.351	S	S	.	.	H	α-helix	trans	-66.7	-43.2	177.9	-75.6	-59.5	0	0	0	112.5	F662 M697 I704 F705	F662-F701 HydrophobicContact CE1-CE1 4.15Å; F662-F701 HydrophobicContact CE1-CZ 4.24Å; F662-F701 HydrophobicContact CZ-CD1 4.2Å; F662-F701 AromaticContact CZ-CE1 3.87Å; F662-F701 HydrophobicContact CZ-CE1 3.87Å; F662-F701 HydrophobicContact CZ-CZ 4.41Å; M697-F701 HydrophobicContact CB-CD2 4.45Å; M697-F701 HydrophobicContact CB-CE2 4.49Å; M697-F701 HydrophobicContact CE-CD2 4.19Å; M697-F701 HydrophobicContact CE-CE2 3.29Å; M697-F701 HydrophobicContact CE-CZ 3.78Å; M697-F701 WeakPolarHBondContact O-CB 3.38Å; M697-F701 WeakPolarHBondContact O-CD2 3.49Å; M697-F701 PolarHBondContact O-N 2.82Å; F701-I704 PolarHBondContact O-N 2.98Å; F701-F705 VanDerWaalsContact O-CB 3.23Å; F701-F705 WeakPolarHBondContact O-CB 3.32Å; F701-F705 PolarHBondContact O-N 3.09Å
702	A	88.1	Confident	81	Confident	46 Å²	46	69.8 Å²	69.8	38%	0.38	36%	0.361	S	S	.	.	H	α-helix	trans	-63.2	-42.4	176.4	0	0	0	0	0	111.3	L698 I699 F705 L706	L698-A702 WeakPolarHBondContact O-CB 3.24Å; L698-A702 PolarHBondContact O-N 3.29Å; I699-A702 PolarHBondContact O-N 3.34Å; A702-F705 PolarHBondContact O-N 3.03Å; A702-L706 VanDerWaalsContact O-CB 3.26Å; A702-L706 WeakPolarHBondContact O-CB 3.34Å; A702-L706 VanDerWaalsContact O-CG 3.23Å; A702-L706 WeakPolarHBondContact O-CG 3.34Å; A702-L706 PolarHBondContact O-N 3.39Å
703	G	82.9	Confident	78.4	Confident	22 Å²	22	72.4 Å²	72.4	23%	0.227	38%	0.383	C	S	.	.	H	α-helix	trans	-62.4	-42.5	177.2	0	0	0	0	0	112.7	I699 A700 G707	I699-G703 PolarHBondContact O-N 3.45Å; A700-G703 PolarHBondContact O-N 3.33Å; G703-G707 PolarHBondContact O-N 3.39Å
704	I	81.9	Confident	75.9	Confident	33 Å²	33	76.3 Å²	76.3	17%	0.169	40%	0.404	C	S	.	.	H	α-helix	trans	-67.9	-41.7	175	-67.3	164.1	0	0	0	110.9	S658 F662 A700 F701 G707 K708	S658-I704 WeakPolarHBondContact OG-CD1 3.38Å; F662-I704 HydrophobicContact CD2-CD1 4.19Å; F662-I704 HydrophobicContact CE2-CD1 3.24Å; F662-I704 HydrophobicContact CZ-CD1 3.58Å; A700-I704 WeakPolarHBondContact O-CD1 3.41Å; A700-I704 VanDerWaalsContact O-CG1 3.29Å; A700-I704 WeakPolarHBondContact O-CG1 3.39Å; A700-I704 PolarHBondContact O-N 3.24Å; F701-I704 PolarHBondContact O-N 2.98Å; I704-G707 PolarHBondContact O-N 2.98Å; I704-K708 HydrophobicContact CG2-CD 4.43Å; I704-K708 WeakPolarHBondContact O-CB 3.47Å; I704-K708 WeakPolarHBondContact O-CG 3.35Å; I704-K708 PolarHBondContact O-N 3.2Å
705	F	79.1	Confident	73.6	Confident	128 Å²	128	75 Å²	75	56%	0.561	39%	0.393	S	S	*	.	H	α-helix	trans	-65.7	-48.7	179.7	-177.7	-105.8	0	0	0	111.7	F701 A702 G707 K708 L709	F701-F705 VanDerWaalsContact O-CB 3.23Å; F701-F705 WeakPolarHBondContact O-CB 3.32Å; F701-F705 PolarHBondContact O-N 3.09Å; A702-F705 PolarHBondContact O-N 3.03Å; F705-G707 VanDerWaalsContact C-N 3.33Å; F705-G707 PolarHBondContact O-N 2.87Å; F705-K708 PolarHBondContact O-N 2.94Å; F705-L709 HydrophobicContact CD1-CD1 3.78Å; F705-L709 HydrophobicContact CD1-CG 4.42Å; F705-L709 HydrophobicContact CE1-CD1 3.32Å; F705-L709 HydrophobicContact CE1-CG 4.14Å; F705-L709 HydrophobicContact CZ-CD1 3.78Å; F705-L709 HydrophobicContact CZ-CD2 4.43Å; F705-L709 HydrophobicContact CZ-CG 4.23Å; F705-L709 WeakPolarHBondContact O-CG 3.47Å; F705-L709 PolarHBondContact O-N 3.43Å
706	L	74.6	Confident	71	Confident	108 Å²	108	78.2 Å²	78.2	57%	0.565	41%	0.406	S	S	*	.	H	α-helix	trans	-63.5	-38.6	174.6	-69.8	171.7	0	0	0	111.5	A702 L709 R710	A702-L706 VanDerWaalsContact O-CB 3.26Å; A702-L706 WeakPolarHBondContact O-CB 3.34Å; A702-L706 VanDerWaalsContact O-CG 3.23Å; A702-L706 WeakPolarHBondContact O-CG 3.34Å; A702-L706 PolarHBondContact O-N 3.39Å; L706-L709 PolarHBondContact O-N 2.86Å; L706-R710 WeakPolarHBondContact O-CB 3.33Å; L706-R710 PolarHBondContact O-N 2.79Å
707	G	67.9	Low	68.4	Low	34 Å²	34	82.5 Å²	82.5	35%	0.351	43%	0.434	S	S	.	.	H	α-helix	trans	-60.2	-43.9	172.7	0	0	0	0	0	112.2	G703 I704 F705 M711	G703-G707 PolarHBondContact O-N 3.39Å; I704-G707 PolarHBondContact O-N 2.98Å; F705-G707 VanDerWaalsContact C-N 3.33Å; F705-G707 PolarHBondContact O-N 2.87Å; G707-M711 VanDerWaalsContact O-CB 3.27Å; G707-M711 WeakPolarHBondContact O-CB 3.1Å; G707-M711 WeakPolarHBondContact O-CG 3.41Å; G707-M711 PolarHBondContact O-N 3.41Å
708	K	66.8	Low	65.6	Low	142 Å²	142	87.7 Å²	87.7	62%	0.617	46%	0.458	S	S	*	.	H	α-helix	trans	-65.3	-38.7	174	-76.3	-177.2	179.7	-177.3	0	112.7	I704 F705 V712	I704-K708 HydrophobicContact CG2-CD 4.43Å; I704-K708 WeakPolarHBondContact O-CB 3.47Å; I704-K708 WeakPolarHBondContact O-CG 3.35Å; I704-K708 PolarHBondContact O-N 3.2Å; F705-K708 PolarHBondContact O-N 2.94Å; K708-V712 VanDerWaalsContact O-CG2 3.26Å; K708-V712 WeakPolarHBondContact O-CG2 3.33Å; K708-V712 PolarHBondContact O-N 3.48Å; K708-V712 VanDerWaalsContact O-N 3.17Å
709	L	58.7	Low	63	Low	88 Å²	88	90.1 Å²	90.1	46%	0.461	47%	0.466	S	S	.	.	H	α-helix	trans	-68.3	-44.9	177.2	-73.2	177.1	0	0	0	111.9	F705 L706 M711 V712 A713	F705-L709 HydrophobicContact CD1-CD1 3.78Å; F705-L709 HydrophobicContact CD1-CG 4.42Å; F705-L709 HydrophobicContact CE1-CD1 3.32Å; F705-L709 HydrophobicContact CE1-CG 4.14Å; F705-L709 HydrophobicContact CZ-CD1 3.78Å; F705-L709 HydrophobicContact CZ-CD2 4.43Å; F705-L709 HydrophobicContact CZ-CG 4.23Å; F705-L709 WeakPolarHBondContact O-CG 3.47Å; F705-L709 PolarHBondContact O-N 3.43Å; L706-L709 PolarHBondContact O-N 2.86Å; L709-M711 VanDerWaalsContact C-N 3.33Å; L709-M711 PolarHBondContact O-N 3.43Å; L709-V712 PolarHBondContact O-N 2.85Å; L709-V712 VanDerWaalsContact O-N 3.08Å; L709-A713 PolarHBondContact O-N 2.84Å
710	R	57.4	Low	60	Low	145 Å²	145	95.7 Å²	95.7	55%	0.547	49%	0.491	S	S	.	.	H	α-helix	trans	-63.5	-40.1	176.5	-170.2	173.3	-176.1	165.5	3.5	111.6	L208 L706 V712 A713 D714	L208-R710 VanDerWaalsContact CD2-NH1 3.32Å; L706-R710 WeakPolarHBondContact O-CB 3.33Å; L706-R710 PolarHBondContact O-N 2.79Å; R710-V712 PolarHBondContact O-N 3.23Å; R710-A713 PolarHBondContact O-N 3.04Å; R710-A713 VanDerWaalsContact O-N 3.15Å; R710-D714 IonicContact NE-OD2 3.85Å; R710-D714 PolarHBondContact O-N 2.82Å
711	M	52.1	Low	57.1	Low	62 Å²	62	104.5 Å²	104.5	31%	0.305	53%	0.532	S	S	.	.	H	α-helix	trans	-59.5	-31.4	171.9	-80	-98.5	63.6	0	0	113.7	P212 M654 G707 L709	P212-M711 HydrophobicContact CB-CE 3.82Å; P212-M711 VanDerWaalsContact CD-SD 3.52Å; P212-M711 HydrophobicContact CG-CE 3.44Å; P212-M711 VanDerWaalsContact CG-CE 3.44Å; P212-M711 HydrophobicContact CG-SD 3.67Å; M654-M711 HydrophobicContact CE-SD 4.38Å; G707-M711 VanDerWaalsContact O-CB 3.27Å; G707-M711 WeakPolarHBondContact O-CB 3.1Å; G707-M711 WeakPolarHBondContact O-CG 3.41Å; G707-M711 PolarHBondContact O-N 3.41Å; L709-M711 VanDerWaalsContact C-N 3.33Å; L709-M711 PolarHBondContact O-N 3.43Å
712	V	50.4	Low	54.5	Low	103 Å²	103	105.8 Å²	105.8	62%	0.624	54%	0.543	S	S	*	.	H	α-helix	trans	-82.1	-32.7	176.4	171.3	0	0	0	0	111.4	K708 L709 R710 Y715	K708-V712 VanDerWaalsContact O-CG2 3.26Å; K708-V712 WeakPolarHBondContact O-CG2 3.33Å; K708-V712 PolarHBondContact O-N 3.48Å; K708-V712 VanDerWaalsContact O-N 3.17Å; L709-V712 PolarHBondContact O-N 2.85Å; L709-V712 VanDerWaalsContact O-N 3.08Å; R710-V712 PolarHBondContact O-N 3.23Å; V712-Y715 WeakPolarHBondContact O-CB 3.45Å
713	A	40.4	Very low	51.6	Low	60 Å²	60	112 Å²	112	50%	0.496	56%	0.564	S	S	.	*	H	α-helix	trans	-72.9	-46.8	177.9	0	0	0	0	0	112.5	L709 R710 Y715 E716	L709-A713 PolarHBondContact O-N 2.84Å; R710-A713 PolarHBondContact O-N 3.04Å; R710-A713 VanDerWaalsContact O-N 3.15Å; A713-Y715 PolarHBondContact O-N 3.47Å; A713-Y715 VanDerWaalsContact O-N 3.08Å; A713-E716 PolarHBondContact O-N 3.06Å; A713-E716 VanDerWaalsContact O-N 3.15Å
714	D	42.6	Very low	49.1	Very low	103 Å²	103	114.6 Å²	114.6	55%	0.551	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-5	175.2	-68.7	-21.5	0	0	0	112.4	R710	R710-D714 IonicContact NE-OD2 3.85Å; R710-D714 PolarHBondContact O-N 2.82Å
715	Y	46.8	Very low	46.8	Very low	72 Å²	72	118 Å²	118	28%	0.282	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	-7.1	173.9	-160.5	-91.4	0	0	0	113.2	R357 V712 A713 P717	R357-Y715 VanDerWaalsContact NH2-CE1 3.33Å; V712-Y715 WeakPolarHBondContact O-CB 3.45Å; A713-Y715 PolarHBondContact O-N 3.47Å; A713-Y715 VanDerWaalsContact O-N 3.08Å; Y715-P717 VanDerWaalsContact O-CD 3.3Å; Y715-P717 WeakPolarHBondContact O-CD 3.45Å
716	E	40.3	Very low	44.7	Very low	149 Å²	149	118.3 Å²	118.3	70%	0.696	60%	0.599	S	S	*	*	S	Bend	trans	-76.7	108.6	161.2	-74.9	-168.9	149.1	0	0	107.5	A713 E718	A713-E716 PolarHBondContact O-N 3.06Å; A713-E716 VanDerWaalsContact O-N 3.15Å; E716-E718 PolarHBondContact O-N 3.38Å
717	P	41.8	Very low	42.3	Very low	91 Å²	91	119.8 Å²	119.8	59%	0.591	61%	0.607	S	S	*	*			trans	-64.8	124.4	-175.9	27.8	-32.3	0	0	0	108.8	Y715	Y715-P717 VanDerWaalsContact O-CD 3.3Å; Y715-P717 WeakPolarHBondContact O-CD 3.45Å
718	E	35.5	Very low	40.3	Very low	166 Å²	166	126.6 Å²	126.6	78%	0.776	63%	0.632	S	S	*	*			trans	-55.8	136.2	154.5	-74.3	179.5	157.5	0	0	107.8	E716 E720	E716-E718 PolarHBondContact O-N 3.38Å; E718-E720 PolarHBondContact O-N 2.96Å
719	E	39.8	Very low	38.2	Very low	173 Å²	173	128.3 Å²	128.3	81%	0.808	64%	0.642	S	S	*	*			trans	-70.2	73.3	178.7	-68.1	-172.5	143	0	0	110.2
720	E	31.7	Very low	36.6	Very low	167 Å²	167	129.5 Å²	129.5	78%	0.78	66%	0.655	S	S	*	*			trans	-123.6	117.6	173.7	-77.8	-171.7	164.8	0	0	112.4	E718	E718-E720 PolarHBondContact O-N 2.96Å
721	E	30.4	Very low	34.9	Very low	185 Å²	185	126.9 Å²	126.9	86%	0.864	66%	0.659	S	S	*	*			trans	37.8	114.7	163.5	-64.9	-173.3	164.3	0	0	120	Q723	E721-Q723 VanDerWaalsContact C-N 3.34Å; E721-Q723 PolarHBondContact O-N 2.9Å
722	I	35	Very low	33.7	Very low	145 Å²	145	129.5 Å²	129.5	74%	0.744	68%	0.683	S	S	*	*			trans	-57.6	91.4	164.7	-59.7	164.5	0	0	0	108.4	T724	I722-T724 HydrophobicContact CG2-CG2 3.96Å
723	Q	27.1	Very low	32.6	Very low	176 Å²	176	130.2 Å²	130.2	82%	0.822	69%	0.688	S	S	*	*			trans	-98.3	91.3	149.2	-86.3	-176.2	-7.8	0	0	108.1	E721 V725	E721-Q723 VanDerWaalsContact C-N 3.34Å; E721-Q723 PolarHBondContact O-N 2.9Å; Q723-V725 PolarHBondContact O-N 3.41Å
724	T	31	Very low	31.9	Very low	76 Å²	76	131.8 Å²	131.8	47%	0.466	70%	0.696	S	S	.	*			trans	-48.6	106.2	156.4	35.4	0	0	0	0	108.7	I722 F726 D727	I722-T724 HydrophobicContact CG2-CG2 3.96Å; T724-F726 PolarHBondContact O-N 3.29Å; T724-D727 PolarHBondContact OG1-OD2 2.79Å
725	V	32.8	Very low	31.2	Very low	105 Å²	105	132.9 Å²	132.9	64%	0.636	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	45.1	163.1	-174.1	0	0	0	0	109.6	Q723	Q723-V725 PolarHBondContact O-N 3.41Å
726	F	34.9	Very low	30.4	Very low	135 Å²	135	134.8 Å²	134.8	59%	0.592	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.4	6.7	174.9	-89.7	-75.3	0	0	0	113.6	T724 T738	T724-F726 PolarHBondContact O-N 3.29Å; F726-T738 HydrophobicContact CE1-CG2 4.24Å
727	D	24.7	Very low	30.3	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	72%	0.724	S	S	*	*			trans	-100.5	43.9	167.6	-63	-47.1	0	0	0	112.1	T724	T724-D727 PolarHBondContact OG1-OD2 2.79Å
728	M	26.5	Very low	30.3	Very low	178 Å²	178	132.9 Å²	132.9	88%	0.877	73%	0.729	S	S	*	*	S	Bend	trans	-99.6	105.6	146.9	-135.3	165.9	89.8	0	0	104.2
729	E	21.7	Very low	30.8	Very low	177 Å²	177	126.3 Å²	126.3	83%	0.827	70%	0.702	S	S	*	*			trans	-40.4	139.5	170.3	-81.7	179.6	129.3	0	0	109.8	S731	E729-S731 PolarHBondContact O-N 3.33Å
730	P	25.2	Very low	31.6	Very low	114 Å²	114	121 Å²	121	74%	0.74	68%	0.679	S	S	*	*			trans	-62.2	112.4	169	26.6	-29	0	0	0	107.2	S732	P730-S732 VanDerWaalsContact C-N 3.34Å; P730-S732 PolarHBondContact O-N 2.8Å
731	S	22.6	Very low	33.4	Very low	90 Å²	90	118 Å²	118	63%	0.629	67%	0.667	S	S	*	*			trans	-53.7	114.2	143	52.6	0	0	0	0	105.3	E729 T733	E729-S731 PolarHBondContact O-N 3.33Å; S731-T733 PolarHBondContact O-N 3.23Å
732	S	27.3	Very low	35.9	Very low	116 Å²	116	109.9 Å²	109.9	81%	0.811	63%	0.629	S	S	*	*	S	Bend	trans	-66.2	53.9	-168.2	52.7	0	0	0	0	113.9	P730	P730-S732 VanDerWaalsContact C-N 3.34Å; P730-S732 PolarHBondContact O-N 2.8Å
733	T	26.7	Very low	38.2	Very low	118 Å²	118	103.5 Å²	103.5	72%	0.724	60%	0.597	S	S	*	*			trans	-147.8	19.6	-174.6	55.3	0	0	0	0	115.3	S731	S731-T733 PolarHBondContact O-N 3.23Å
734	S	26.3	Very low	40.7	Very low	93 Å²	93	95.3 Å²	95.3	65%	0.65	56%	0.559	S	S	*	*			trans	-122.7	103	164.4	78.2	0	0	0	0	111.2	T736	S734-T736 PolarHBondContact O-N 2.95Å; S734-T736 VanDerWaalsContact O-N 3.15Å
735	S	26.5	Very low	43	Very low	126 Å²	126	95.4 Å²	95.4	88%	0.881	56%	0.56	S	S	*	*			trans	-76.8	18.8	-179.3	51.8	0	0	0	0	114.7	P737	S735-P737 VanDerWaalsContact O-CD 3.25Å; S735-P737 WeakPolarHBondContact O-CD 3.14Å
736	T	31.7	Very low	45.3	Very low	113 Å²	113	90.8 Å²	90.8	69%	0.693	53%	0.532	S	S	*	.			trans	-92.6	106.7	166.2	43.2	0	0	0	0	109.6	S734 T738	S734-T736 PolarHBondContact O-N 2.95Å; S734-T736 VanDerWaalsContact O-N 3.15Å; T736-T738 PolarHBondContact O-N 2.9Å
737	P	37	Very low	47.5	Very low	85 Å²	85	86.7 Å²	86.7	55%	0.552	52%	0.516	S	S	*	.			trans	-62.6	138.6	176.6	26.5	-32.9	0	0	0	109.3	S735 S739	S735-P737 VanDerWaalsContact O-CD 3.25Å; S735-P737 WeakPolarHBondContact O-CD 3.14Å; P737-S739 WeakPolarHBondContact CB-OG 3.17Å; P737-S739 WeakPolarHBondContact CG-OG 3.31Å; P737-S739 PolarHBondContact O-N 3.34Å; P737-S739 PolarHBondContact O-OG 3.46Å
738	T	42.4	Very low	49.7	Very low	114 Å²	114	83.2 Å²	83.2	70%	0.699	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	4.4	173.7	37.6	0	0	0	0	114.5	F726 T736	F726-T738 HydrophobicContact CE1-CG2 4.24Å; T736-T738 PolarHBondContact O-N 2.9Å
739	S	45	Very low	51.1	Low	29 Å²	29	79 Å²	79	20%	0.203	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-17.1	-175.7	56.3	0	0	0	0	115.6	R252 P737	R252-S739 WeakPolarHBondContact CD-O 3.32Å; R252-S739 VanDerWaalsContact CZ-CB 3.46Å; P737-S739 WeakPolarHBondContact CB-OG 3.17Å; P737-S739 WeakPolarHBondContact CG-OG 3.31Å; P737-S739 PolarHBondContact O-N 3.34Å; P737-S739 PolarHBondContact O-OG 3.46Å
740	L	58	Low	51.9	Low	61 Å²	61	75 Å²	75	32%	0.319	46%	0.463	S	S	.	.			trans	-111.1	15.3	-172	-70.8	170.8	0	0	0	115.2	Y742 V743 Q748	L740-Y742 VanDerWaalsContact C-N 3.27Å; L740-Y742 PolarHBondContact O-N 2.99Å; L740-V743 HydrophobicContact CB-CG2 4.35Å; L740-V743 HydrophobicContact CD2-CG2 3.92Å; L740-V743 WeakPolarHBondContact O-CB 3.44Å; L740-V743 WeakPolarHBondContact O-CG2 3.48Å; L740-V743 PolarHBondContact O-N 3.01Å; L740-V743 VanDerWaalsContact O-N 3.16Å; L740-Q748 HydrophobicContact CB-CG 4.13Å; L740-Q748 HydrophobicContact CD1-CB 4.34Å; L740-Q748 HydrophobicContact CD1-CG 4.26Å; L740-Q748 PolarHBondContact O-NE2 3.5Å
741	L	69.6	Low	52.3	Low	103 Å²	103	78.1 Å²	78.1	54%	0.539	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-33.6	-167.5	-157.9	92.6	0	0	0	115.9	P391	P391-L741 WeakPolarHBondContact CB-O 3.34Å; P391-L741 HydrophobicContact CG-CD2 3.5Å; P391-L741 VanDerWaalsContact CG-CD2 3.5Å; P391-L741 HydrophobicContact CG-CG 3.6Å; P391-L741 WeakPolarHBondContact CG-O 3.48Å
742	Y	82.1	Confident	52.9	Low	15 Å²	15	78.4 Å²	78.4	6%	0.059	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	47.7	-179.5	-72.4	-82.4	0	0	0	112.5	T221 F344 A388 P389 P391 I394 L740	T221-Y742 HydrophobicContact CG2-CD2 3.75Å; T221-Y742 HydrophobicContact CG2-CE2 3.63Å; T221-Y742 HydrophobicContact CG2-CG 4.35Å; T221-Y742 VanDerWaalsContact OG1-CE2 3.31Å; T221-Y742 WeakPolarHBondContact OG1-CE2 3.26Å; F344-Y742 HydrophobicContact CB-CG 4.34Å; F344-Y742 AromaticContact CD1-CD1 3.82Å; F344-Y742 HydrophobicContact CD1-CD1 3.82Å; F344-Y742 HydrophobicContact CD1-CE1 4.3Å; F344-Y742 HydrophobicContact CD1-CG 4.21Å; F344-Y742 HydrophobicContact CD2-CD1 4.33Å; F344-Y742 HydrophobicContact CD2-CG 4.43Å; F344-Y742 AromaticContact CE1-CD1 3.89Å; F344-Y742 HydrophobicContact CE1-CD1 3.89Å; F344-Y742 HydrophobicContact CE1-CE1 4.24Å; F344-Y742 HydrophobicContact CE2-CD1 4.4Å; F344-Y742 HydrophobicContact CG-CD1 4.06Å; F344-Y742 HydrophobicContact CG-CG 4.08Å; F344-Y742 HydrophobicContact CZ-CD1 4.2Å; A388-Y742 HydrophobicContact CB-CE1 3.76Å; P389-Y742 VanDerWaalsContact O-CE1 3.26Å; P389-Y742 WeakPolarHBondContact O-CE1 3.23Å; P389-Y742 PolarHBondContact O-OH 3.32Å; P391-Y742 HydrophobicContact CG-CD1 4.28Å; P391-Y742 HydrophobicContact CG-CE1 3.93Å; P391-Y742 HydrophobicContact CG-CE2 4.42Å; I394-Y742 HydrophobicContact CD1-CD1 3.9Å; I394-Y742 HydrophobicContact CD1-CE1 4.03Å; L740-Y742 VanDerWaalsContact C-N 3.27Å; L740-Y742 PolarHBondContact O-N 2.99Å
743	V	83.2	Confident	53.1	Low	11 Å²	11	79.7 Å²	79.7	7%	0.067	46%	0.459	C	S	.	.	S	Bend	trans	-125.7	140.9	176	-172.3	0	0	0	0	108.1	H254 L740 T745 L747 Q748	H254-V743 WeakPolarHBondContact CE1-CG2 3.24Å; H254-V743 WeakPolarHBondContact NE2-CG2 3.27Å; L740-V743 HydrophobicContact CB-CG2 4.35Å; L740-V743 HydrophobicContact CD2-CG2 3.92Å; L740-V743 WeakPolarHBondContact O-CB 3.44Å; L740-V743 WeakPolarHBondContact O-CG2 3.48Å; L740-V743 PolarHBondContact O-N 3.01Å; L740-V743 VanDerWaalsContact O-N 3.16Å; V743-T745 PolarHBondContact O-N 3.33Å; V743-L747 HydrophobicContact CG1-CB 3.8Å; V743-Q748 HydrophobicContact CB-CG 3.74Å; V743-Q748 HydrophobicContact CG1-CG 3.79Å; V743-Q748 PolarHBondContact O-NE2 3.24Å; V743-Q748 VanDerWaalsContact O-NE2 3.1Å
744	A	80.6	Confident	53.7	Low	4 Å²	4	77.6 Å²	77.6	3%	0.033	44%	0.443	C	S	.	.			trans	-61	134.8	172.1	0	0	0	0	0	108.9	V259 W396 V746 L747 Q748	V259-A744 HydrophobicContact CG2-CB 4Å; W396-A744 HydrophobicContact CB-CB 4.47Å; W396-A744 HydrophobicContact CD2-CB 3.91Å; W396-A744 HydrophobicContact CE3-CB 3.94Å; W396-A744 HydrophobicContact CG-CB 4.14Å; A744-V746 HydrophobicContact CB-CG2 3.93Å; A744-V746 PolarHBondContact O-N 3.47Å; A744-V746 VanDerWaalsContact O-N 3.14Å; A744-L747 PolarHBondContact O-N 3.24Å; A744-Q748 PolarHBondContact O-N 2.91Å
745	T	79.1	Confident	54.3	Low	79 Å²	79	78.6 Å²	78.6	49%	0.485	45%	0.446	S	S	.	.	H	α-helix	trans	-53.9	-38.2	-175.7	51.5	0	0	0	0	112.8	V743 L747 Q748 E749	V743-T745 PolarHBondContact O-N 3.33Å; T745-L747 PolarHBondContact O-N 2.86Å; T745-L747 VanDerWaalsContact O-N 3.15Å; T745-Q748 WeakPolarHBondContact O-CB 3.45Å; T745-Q748 PolarHBondContact O-N 2.98Å; T745-E749 PolarHBondContact O-N 3.37Å
746	V	80.1	Confident	55	Low	7 Å²	7	74.9 Å²	74.9	4%	0.042	42%	0.418	C	S	.	.	H	α-helix	trans	-59.2	-21.7	174.2	-87.7	0	0	0	0	115.3	V259 L262 I263 D266 A744	V259-V746 HydrophobicContact CB-CG2 4.49Å; L262-V746 HydrophobicContact CD2-CB 4.15Å; L262-V746 HydrophobicContact CD2-CG2 4.28Å; L262-V746 HydrophobicContact CG-CB 4.49Å; I263-V746 HydrophobicContact CD1-CG2 4.41Å; I263-V746 HydrophobicContact CG1-CG1 4.31Å; I263-V746 HydrophobicContact CG1-CG2 3.56Å; D266-V746 HydrophobicContact CB-CG1 3.57Å; D266-V746 WeakPolarHBondContact OD2-CG1 3.24Å; A744-V746 HydrophobicContact CB-CG2 3.93Å; A744-V746 PolarHBondContact O-N 3.47Å; A744-V746 VanDerWaalsContact O-N 3.14Å
747	L	80.8	Confident	55.7	Low	50 Å²	50	71.5 Å²	71.5	26%	0.262	40%	0.402	S	S	.	.	H	α-helix	trans	-98.5	-11.5	175.8	-62.3	178.1	0	0	0	112.5	Y257 V259 L262 L332 V335 V743 A744 T745	Y257-L747 HydrophobicContact CD2-CD1 4.47Å; V259-L747 HydrophobicContact CG1-CD1 3.64Å; V259-L747 HydrophobicContact CG1-CD2 4.29Å; V259-L747 HydrophobicContact CG1-CG 3.99Å; L262-L747 HydrophobicContact CD2-CD2 3.65Å; L262-L747 HydrophobicContact CD2-CG 4.45Å; L332-L747 HydrophobicContact CD1-CD2 3.91Å; V335-L747 HydrophobicContact CG1-CD2 4.26Å; V743-L747 HydrophobicContact CG1-CB 3.8Å; A744-L747 PolarHBondContact O-N 3.24Å; T745-L747 PolarHBondContact O-N 2.86Å; T745-L747 VanDerWaalsContact O-N 3.15Å
748	Q	71.9	Confident	56	Low	65 Å²	65	72.2 Å²	72.2	30%	0.304	41%	0.409	S	S	.	.	H	α-helix	trans	-84.5	-17.6	176.6	-64.7	175.2	-13.8	0	0	112.5	L740 V743 A744 T745 P750	L740-Q748 HydrophobicContact CB-CG 4.13Å; L740-Q748 HydrophobicContact CD1-CB 4.34Å; L740-Q748 HydrophobicContact CD1-CG 4.26Å; L740-Q748 PolarHBondContact O-NE2 3.5Å; V743-Q748 HydrophobicContact CB-CG 3.74Å; V743-Q748 HydrophobicContact CG1-CG 3.79Å; V743-Q748 PolarHBondContact O-NE2 3.24Å; V743-Q748 VanDerWaalsContact O-NE2 3.1Å; A744-Q748 PolarHBondContact O-N 2.91Å; T745-Q748 WeakPolarHBondContact O-CB 3.45Å; T745-Q748 PolarHBondContact O-N 2.98Å; Q748-P750 WeakPolarHBondContact O-CD 3.48Å
749	E	54.6	Low	55.8	Low	88 Å²	88	67 Å²	67	41%	0.411	38%	0.377	S	S	.	.			trans	-104.8	55.9	-176.4	-64.3	176.7	165.8	0	0	113.2	R270 T745 E751	R270-E749 IonicContact CZ-OE2 2.7Å; R270-E749 IonicContact NH2-OE2 3.78Å; R270-E749 PolarHBondContact NH2-OE2 3.48Å; T745-E749 PolarHBondContact O-N 3.37Å; E749-E751 VanDerWaalsContact C-N 3.28Å
750	P	38.8	Very low	55.7	Low	94 Å²	94	69.9 Å²	69.9	61%	0.61	40%	0.395	S	S	*	.			trans	-81.5	-2.7	171.8	33.6	-31	0	0	0	113.5	Q748	Q748-P750 WeakPolarHBondContact O-CD 3.48Å
751	E	34	Very low	55	Low	179 Å²	179	69.9 Å²	69.9	84%	0.836	40%	0.404	S	S	*	.			trans	-117.2	36.1	-173.1	-65.4	-169.8	175.6	0	0	114.8	E749	E749-E751 VanDerWaalsContact C-N 3.28Å
752	L	36.3	Very low	53.6	Low	97 Å²	97	73 Å²	73	51%	0.508	41%	0.408	S	S	.	.			trans	-99.2	90.3	147.5	-92.1	117.1	0	0	0	106.9	L754	L752-L754 HydrophobicContact CB-CD1 4.37Å; L752-L754 HydrophobicContact CB-CG 4.47Å; L752-L754 HydrophobicContact CD2-CD1 3.44Å; L752-L754 VanDerWaalsContact CD2-CD1 3.44Å; L752-L754 HydrophobicContact CD2-CG 3.82Å; L752-L754 PolarHBondContact O-N 3.36Å
753	N	30.5	Very low	51.4	Low	143 Å²	143	80.4 Å²	80.4	77%	0.765	44%	0.443	S	S	*	.			trans	-65.4	60.3	155.8	-73.4	-22.1	0	0	0	108.8	T755	N753-T755 PolarHBondContact O-N 3.49Å; N753-T755 VanDerWaalsContact O-N 3.13Å
754	L	39.7	Very low	49.1	Very low	74 Å²	74	85.7 Å²	85.7	39%	0.387	48%	0.476	S	S	.	.			trans	-78	87.4	152.8	-72.9	161.9	0	0	0	103.7	M273 L752 P756	M273-L754 HydrophobicContact CE-CD1 3.37Å; M273-L754 HydrophobicContact SD-CD1 4.15Å; L752-L754 HydrophobicContact CB-CD1 4.37Å; L752-L754 HydrophobicContact CB-CG 4.47Å; L752-L754 HydrophobicContact CD2-CD1 3.44Å; L752-L754 VanDerWaalsContact CD2-CD1 3.44Å; L752-L754 HydrophobicContact CD2-CG 3.82Å; L752-L754 PolarHBondContact O-N 3.36Å; L754-P756 WeakPolarHBondContact O-CD 3.25Å; L754-P756 VanDerWaalsContact O-N 3.14Å
755	T	38.5	Very low	46.9	Very low	114 Å²	114	96.8 Å²	96.8	70%	0.699	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-48.6	122.6	159.5	34.1	0	0	0	0	106.2	N753 A757	N753-T755 PolarHBondContact O-N 3.49Å; N753-T755 VanDerWaalsContact O-N 3.13Å; T755-A757 PolarHBondContact O-N 2.84Å
756	P	42	Very low	45.1	Very low	48 Å²	48	96 Å²	96	31%	0.312	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-56.4	123.7	174.6	20.5	-28.6	0	0	0	106.7	L754 S758	L754-P756 WeakPolarHBondContact O-CD 3.25Å; L754-P756 VanDerWaalsContact O-N 3.14Å; P756-S758 PolarHBondContact O-N 3.49Å; P756-S758 VanDerWaalsContact O-N 3.13Å
757	A	44.8	Very low	42.7	Very low	42 Å²	42	102.5 Å²	102.5	35%	0.347	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-55.8	124.3	174.7	0	0	0	0	0	107.2	T755 S759	T755-A757 PolarHBondContact O-N 2.84Å; A757-S759 PolarHBondContact O-N 3.21Å
758	S	43.4	Very low	40.3	Very low	99 Å²	99	109.1 Å²	109.1	69%	0.692	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-54.2	125.6	-176.8	53.8	0	0	0	0	109.8	P756	P756-S758 PolarHBondContact O-N 3.49Å; P756-S758 VanDerWaalsContact O-N 3.13Å
759	S	39.5	Very low	38.1	Very low	5 Å²	5	113.4 Å²	113.4	4%	0.035	62%	0.623	C	S	.	*	P	Polyproline II helix	trans	-52.8	133.2	176.7	171.7	0	0	0	0	110.4	A757 A761 R762	A757-S759 PolarHBondContact O-N 3.21Å; S759-A761 PolarHBondContact O-N 3.35Å; S759-A761 PolarHBondContact OG-N 3.29Å; S759-R762 PolarHBondContact O-N 3.38Å
760	P	43.2	Very low	36.9	Very low	89 Å²	89	116.7 Å²	116.7	58%	0.578	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-8.9	177.3	22.4	-30.9	0	0	0	113.5
761	A	41.9	Very low	36.2	Very low	61 Å²	61	120.8 Å²	120.8	50%	0.504	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	-20.4	172.9	0	0	0	0	0	113.9	S759 H763	S759-A761 PolarHBondContact O-N 3.35Å; S759-A761 PolarHBondContact OG-N 3.29Å; A761-H763 PolarHBondContact O-N 3.2Å
762	R	40.4	Very low	36.1	Very low	170 Å²	170	117 Å²	117	64%	0.642	65%	0.645	S	S	*	*			trans	-95.1	73.5	176.2	-79.9	-177.8	169	173.5	-5.3	110.2	E322 S759 T764	E322-R762 IonicContact OE1-CZ 3.28Å; E322-R762 IonicContact OE1-NH1 2.78Å; E322-R762 PolarHBondContact OE1-NH1 2.86Å; S759-R762 PolarHBondContact O-N 3.38Å; R762-T764 VanDerWaalsContact C-N 3.31Å; R762-T764 PolarHBondContact O-N 3.34Å
763	H	37.2	Very low	35.7	Very low	169 Å²	169	121 Å²	121	78%	0.782	66%	0.661	S	S	*	*			trans	-70.6	94.3	156.9	-84.8	-68.4	0	0	0	108.5	A761 Y765	A761-H763 PolarHBondContact O-N 3.2Å; H763-Y765 PolarHBondContact O-N 2.85Å
764	T	33.6	Very low	35.7	Very low	123 Å²	123	120.7 Å²	120.7	76%	0.755	66%	0.655	S	S	*	*			trans	-62.8	117.1	166.9	-30.2	0	0	0	0	107.6	R762 G766	R762-T764 VanDerWaalsContact C-N 3.31Å; R762-T764 PolarHBondContact O-N 3.34Å; T764-G766 PolarHBondContact O-N 2.88Å
765	Y	34.9	Very low	35.1	Very low	237 Å²	237	120.1 Å²	120.1	93%	0.929	67%	0.667	S	S	*	*	S	Bend	trans	-65.2	102.8	176.1	-116.7	-94.9	0	0	0	108.9	H763	H763-Y765 PolarHBondContact O-N 2.85Å
766	G	41.2	Very low	34.8	Very low	63 Å²	63	121.9 Å²	121.9	65%	0.649	67%	0.668	S	S	*	*			trans	97.4	93	164.2	0	0	0	0	0	115.7	T764	T764-G766 PolarHBondContact O-N 2.88Å
767	T	28.7	Very low	34.5	Very low	142 Å²	142	124.8 Å²	124.8	87%	0.871	68%	0.677	S	S	*	*				-169.4	117.9	127.6	28.1	0	0	0	0	107.8	N769	T767-N769 PolarHBondContact O-N 2.79Å
768	M	31.6	Very low	34	Very low	190 Å²	190	128.2 Å²	128.2	94%	0.936	69%	0.686	S	S	*	*			trans	-72.7	113.3	169.4	-68.9	179.1	87.6	0	0	108.2
769	N	26	Very low	33.5	Very low	154 Å²	154	125.5 Å²	125.5	82%	0.824	67%	0.666	S	S	*	*			trans	-143.6	107.5	154.4	-139.1	19.2	0	0	0	108.9	T767	T767-N769 PolarHBondContact O-N 2.79Å
770	N	29	Very low	33.3	Very low	158 Å²	158	126 Å²	126	85%	0.845	67%	0.673	S	S	*	*			trans	-85.3	104.6	174	-85.1	-13.8	0	0	0	108.7
771	Q	23.9	Very low	33	Very low	179 Å²	179	123.3 Å²	123.3	84%	0.836	65%	0.653	S	S	*	*			trans	-145.6	129.4	148.2	-81.9	-167.1	-30.7	0	0	108.5
772	P	30.8	Very low	32.7	Very low	100 Å²	100	128.6 Å²	128.6	65%	0.649	66%	0.66	S	S	*	*			trans	-81.9	119	176	-1.5	19.5	0	0	0	110.3	E774	P772-E774 HydrophobicContact CB-CB 4.41Å; P772-E774 HydrophobicContact CB-CG 3.69Å; P772-E774 PolarHBondContact O-N 2.78Å; P772-E774 VanDerWaalsContact O-N 3.11Å
773	E	29	Very low	32.5	Very low	181 Å²	181	120.8 Å²	120.8	85%	0.846	63%	0.633	S	S	*	*			trans	-78.7	71.1	160.3	-73.1	-174.6	162.1	0	0	108.9
774	E	29.8	Very low	32.6	Very low	137 Å²	137	114.7 Å²	114.7	64%	0.64	60%	0.604	S	S	*	*			trans	-84.9	-6.4	-176.8	-86.3	173	174.9	0	0	114	P772	P772-E774 HydrophobicContact CB-CB 4.41Å; P772-E774 HydrophobicContact CB-CG 3.69Å; P772-E774 PolarHBondContact O-N 2.78Å; P772-E774 VanDerWaalsContact O-N 3.11Å
775	G	26.9	Very low	32.6	Very low	62 Å²	62	110.4 Å²	110.4	64%	0.639	58%	0.581	S	S	*	*	H	α-helix	trans	-78.4	-38.8	-167.7	0	0	0	0	0	116.3
776	E	32.7	Very low	32.6	Very low	151 Å²	151	107.1 Å²	107.1	71%	0.706	57%	0.567	S	S	*	*	H	α-helix	trans	-88.8	-35.8	-174.9	-72	-173	166.6	0	0	112.6	E778 S779 G780	E776-E778 PolarHBondContact O-N 3.26Å; E776-S779 PolarHBondContact O-N 3.41Å; E776-S779 PolarHBondContact O-OG 3.25Å; E776-G780 PolarHBondContact O-N 3.19Å
777	E	37	Very low	32.5	Very low	109 Å²	109	106.8 Å²	106.8	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-63	-39.5	175.9	-72.8	-163.9	152.9	0	0	112.3	S779 L781	E777-S779 VanDerWaalsContact C-N 3.29Å; E777-S779 PolarHBondContact O-N 2.9Å; E777-L781 HydrophobicContact CB-CD1 4.37Å; E777-L781 VanDerWaalsContact O-CB 3.26Å; E777-L781 WeakPolarHBondContact O-CB 3.36Å; E777-L781 VanDerWaalsContact O-CD1 3.27Å; E777-L781 WeakPolarHBondContact O-CD1 3.46Å; E777-L781 PolarHBondContact O-N 2.95Å
778	E	32.3	Very low	33	Very low	114 Å²	114	101.4 Å²	101.4	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-31.7	177.9	-87.7	-156.4	139.9	0	0	113.1	E776 R782	E776-E778 PolarHBondContact O-N 3.26Å; E778-R782 VanDerWaalsContact O-CB 3.32Å; E778-R782 WeakPolarHBondContact O-CB 3.33Å; E778-R782 WeakPolarHBondContact O-CG 3.46Å; E778-R782 PolarHBondContact O-N 2.96Å
779	S	34.3	Very low	33	Very low	41 Å²	41	96.8 Å²	96.8	29%	0.287	49%	0.493	S	S	.	.	H	α-helix	trans	-70.8	-47.2	-178.9	80.9	0	0	0	0	111.7	E776 E777 R782 G783	E776-S779 PolarHBondContact O-N 3.41Å; E776-S779 PolarHBondContact O-OG 3.25Å; E777-S779 VanDerWaalsContact C-N 3.29Å; E777-S779 PolarHBondContact O-N 2.9Å; S779-R782 PolarHBondContact O-N 2.87Å; S779-G783 PolarHBondContact O-N 3.42Å
780	G	35.2	Very low	33.4	Very low	16 Å²	16	92.2 Å²	92.2	17%	0.165	47%	0.474	C	S	.	.	H	α-helix	trans	-68.5	-36	175.9	0	0	0	0	0	112.8	E776 F784	E776-G780 PolarHBondContact O-N 3.19Å; G780-F784 WeakPolarHBondContact O-CB 3.3Å; G780-F784 PolarHBondContact O-N 3.44Å
781	L	37.3	Very low	33.6	Very low	33 Å²	33	87.4 Å²	87.4	17%	0.173	46%	0.456	C	S	.	.	H	α-helix	trans	-66.2	-36.8	172	-96.2	133.6	0	0	0	112.5	K284 E777 A785	K284-L781 HydrophobicContact CD-CD2 3.83Å; E777-L781 HydrophobicContact CB-CD1 4.37Å; E777-L781 VanDerWaalsContact O-CB 3.26Å; E777-L781 WeakPolarHBondContact O-CB 3.36Å; E777-L781 VanDerWaalsContact O-CD1 3.27Å; E777-L781 WeakPolarHBondContact O-CD1 3.46Å; E777-L781 PolarHBondContact O-N 2.95Å; L781-A785 WeakPolarHBondContact O-CB 3.38Å; L781-A785 PolarHBondContact O-N 3.29Å
782	R	34.1	Very low	34	Very low	171 Å²	171	83.2 Å²	83.2	65%	0.645	44%	0.436	S	S	*	.	H	α-helix	trans	-70.2	-39	175.7	-84.1	-178.2	-174.9	-174.6	6.6	112.6	E778 S779 R786	E778-R782 VanDerWaalsContact O-CB 3.32Å; E778-R782 WeakPolarHBondContact O-CB 3.33Å; E778-R782 WeakPolarHBondContact O-CG 3.46Å; E778-R782 PolarHBondContact O-N 2.96Å; S779-R782 PolarHBondContact O-N 2.87Å; R782-R786 PolarHBondContact O-N 3.22Å; R782-R786 VanDerWaalsContact O-N 3.08Å
783	G	36.1	Very low	33.9	Very low	7 Å²	7	85.9 Å²	85.9	7%	0.072	44%	0.438	C	S	.	.	H	α-helix	trans	-60.6	-49.4	173.7	0	0	0	0	0	111.8	S779 R786 E787	S779-G783 PolarHBondContact O-N 3.42Å; G783-R786 PolarHBondContact O-N 3.26Å; G783-E787 PolarHBondContact O-N 2.97Å
784	F	39.1	Very low	34	Very low	41 Å²	41	82.5 Å²	82.5	18%	0.18	42%	0.422	C	S	.	.	H	α-helix	trans	-73.5	-31.8	179.9	-149.3	-94.6	0	0	0	113.3	F278 G780 E787 L788	F278-F784 HydrophobicContact CB-CE1 3.97Å; F278-F784 HydrophobicContact CB-CZ 4.24Å; F278-F784 AromaticContact CD2-CE1 3.97Å; F278-F784 HydrophobicContact CD2-CE1 3.97Å; F278-F784 HydrophobicContact CD2-CZ 4.39Å; F278-F784 HydrophobicContact CG-CE1 4.44Å; G780-F784 WeakPolarHBondContact O-CB 3.3Å; G780-F784 PolarHBondContact O-N 3.44Å; F784-E787 WeakPolarHBondContact O-CB 3.37Å; F784-E787 PolarHBondContact O-N 3.31Å; F784-L788 HydrophobicContact CD1-CD1 4.22Å; F784-L788 HydrophobicContact CE1-CD1 4.09Å; F784-L788 PolarHBondContact O-N 3.01Å
785	A	34	Very low	34.1	Very low	33 Å²	33	81.6 Å²	81.6	27%	0.273	42%	0.418	S	S	.	.	H	α-helix	trans	-67.8	-34.5	173.4	0	0	0	0	0	112.5	L781 E787 L788 D789	L781-A785 WeakPolarHBondContact O-CB 3.38Å; L781-A785 PolarHBondContact O-N 3.29Å; A785-E787 VanDerWaalsContact C-N 3.32Å; A785-L788 PolarHBondContact O-N 3.2Å; A785-D789 WeakPolarHBondContact O-CB 3.23Å; A785-D789 PolarHBondContact O-N 3.12Å
786	R	36.2	Very low	34.1	Very low	167 Å²	167	80.3 Å²	80.3	63%	0.63	40%	0.404	S	S	*	.	H	α-helix	trans	-64.8	-35.7	169.7	-92	179.8	158.1	171.1	-5.3	112.3	R782 G783 S790	R782-R786 PolarHBondContact O-N 3.22Å; R782-R786 VanDerWaalsContact O-N 3.08Å; G783-R786 PolarHBondContact O-N 3.26Å; R786-S790 WeakPolarHBondContact O-CB 3.36Å; R786-S790 PolarHBondContact O-N 3.26Å; R786-S790 PolarHBondContact O-OG 3.48Å
787	E	38.3	Very low	33.9	Very low	57 Å²	57	78 Å²	78	27%	0.266	40%	0.397	S	S	.	.	H	α-helix	trans	-70	-35.7	173.9	-138.7	-176.4	-177.5	0	0	112	L81 G783 F784 A785 S790 A791	L81-E787 HydrophobicContact CD2-CB 4.45Å; L81-E787 HydrophobicContact CD2-CG 3.67Å; L81-E787 WeakPolarHBondContact CD2-OE1 3.46Å; G783-E787 PolarHBondContact O-N 2.97Å; F784-E787 WeakPolarHBondContact O-CB 3.37Å; F784-E787 PolarHBondContact O-N 3.31Å; A785-E787 VanDerWaalsContact C-N 3.32Å; E787-S790 WeakPolarHBondContact CA-OG 3.37Å; E787-S790 PolarHBondContact O-OG 3.37Å; E787-A791 VanDerWaalsContact O-CB 3.29Å; E787-A791 WeakPolarHBondContact O-CB 3.36Å; E787-A791 PolarHBondContact O-N 3.11Å
788	L	38.5	Very low	33.8	Very low	29 Å²	29	79.2 Å²	79.2	15%	0.152	40%	0.402	C	S	.	.	H	α-helix	trans	-72	-37.5	174.8	-134.2	102	0	0	0	111.8	F278 K285 F784 A785 Q792	F278-L788 HydrophobicContact CD2-CD1 4.23Å; F278-L788 HydrophobicContact CE2-CD1 4.19Å; K285-L788 HydrophobicContact CD-CD2 4.28Å; F784-L788 HydrophobicContact CD1-CD1 4.22Å; F784-L788 HydrophobicContact CE1-CD1 4.09Å; F784-L788 PolarHBondContact O-N 3.01Å; A785-L788 PolarHBondContact O-N 3.2Å; L788-Q792 WeakPolarHBondContact O-CB 3.42Å; L788-Q792 VanDerWaalsContact O-CG 3.27Å; L788-Q792 WeakPolarHBondContact O-CG 3.32Å; L788-Q792 PolarHBondContact O-N 3.47Å
789	D	32.8	Very low	33.7	Very low	92 Å²	92	79.5 Å²	79.5	49%	0.492	41%	0.406	S	S	.	.	H	α-helix	trans	-74.4	-30.9	176.3	-79	1.4	0	0	0	111.3	K285 A785 F793	K285-D789 IonicContact NZ-OD1 3.37Å; K285-D789 PolarHBondContact NZ-OD1 3.49Å; A785-D789 WeakPolarHBondContact O-CB 3.23Å; A785-D789 PolarHBondContact O-N 3.12Å; D789-F793 WeakPolarHBondContact O-CA 3.43Å; D789-F793 WeakPolarHBondContact O-CB 3.34Å; D789-F793 PolarHBondContact O-N 2.89Å
790	S	34.2	Very low	33.5	Very low	58 Å²	58	84.5 Å²	84.5	41%	0.406	43%	0.425	S	S	.	.	H	α-helix	trans	-70.8	-39.8	170.1	63	0	0	0	0	112.1	R786 E787 Q794	R786-S790 WeakPolarHBondContact O-CB 3.36Å; R786-S790 PolarHBondContact O-N 3.26Å; R786-S790 PolarHBondContact O-OG 3.48Å; E787-S790 WeakPolarHBondContact CA-OG 3.37Å; E787-S790 PolarHBondContact O-OG 3.37Å; S790-Q794 PolarHBondContact O-N 3.05Å; S790-Q794 VanDerWaalsContact O-N 3.14Å; S790-Q794 PolarHBondContact O-OE1 3.48Å
791	A	32.5	Very low	33.3	Very low	57 Å²	57	86 Å²	86	47%	0.471	44%	0.441	S	S	.	.	H	α-helix	trans	-66.3	-40.2	172.4	0	0	0	0	0	112.7	E787 Q794 E795	E787-A791 VanDerWaalsContact O-CB 3.29Å; E787-A791 WeakPolarHBondContact O-CB 3.36Å; E787-A791 PolarHBondContact O-N 3.11Å; A791-Q794 PolarHBondContact O-N 3.4Å; A791-E795 PolarHBondContact O-N 2.85Å
792	Q	32.9	Very low	33	Very low	92 Å²	92	91.6 Å²	91.6	43%	0.43	47%	0.466	S	S	.	.	H	α-helix	trans	-74.1	-32.7	175.5	-78	-171.6	-64.7	0	0	112.8	L788 Q794 E795 G796	L788-Q792 WeakPolarHBondContact O-CB 3.42Å; L788-Q792 VanDerWaalsContact O-CG 3.27Å; L788-Q792 WeakPolarHBondContact O-CG 3.32Å; L788-Q792 PolarHBondContact O-N 3.47Å; Q792-Q794 PolarHBondContact O-N 3.28Å; Q792-E795 PolarHBondContact O-N 2.86Å; Q792-G796 PolarHBondContact O-N 2.82Å
793	F	27.8	Very low	32.7	Very low	155 Å²	155	90.1 Å²	90.1	68%	0.68	47%	0.471	S	S	*	.	H	α-helix	trans	-65.5	-30.1	172.7	-167.3	-94.3	0	0	0	110.8	D789 L797	D789-F793 WeakPolarHBondContact O-CA 3.43Å; D789-F793 WeakPolarHBondContact O-CB 3.34Å; D789-F793 PolarHBondContact O-N 2.89Å; F793-L797 HydrophobicContact CD1-CD1 4.23Å; F793-L797 HydrophobicContact CE1-CD1 4.23Å; F793-L797 PolarHBondContact O-N 2.85Å
794	Q	32.2	Very low	32.4	Very low	110 Å²	110	97.5 Å²	97.5	51%	0.514	50%	0.504	S	S	.	.	H	α-helix	trans	-80.2	-36.1	171.6	-97.2	155	-74.1	0	0	114	S790 A791 Q792 G796 L797 E798	S790-Q794 PolarHBondContact O-N 3.05Å; S790-Q794 VanDerWaalsContact O-N 3.14Å; S790-Q794 PolarHBondContact O-OE1 3.48Å; A791-Q794 PolarHBondContact O-N 3.4Å; Q792-Q794 PolarHBondContact O-N 3.28Å; Q794-G796 VanDerWaalsContact C-N 3.31Å; Q794-G796 PolarHBondContact O-N 3.46Å; Q794-L797 PolarHBondContact O-N 3.45Å; Q794-E798 PolarHBondContact O-N 2.92Å
795	E	31	Very low	32.2	Very low	119 Å²	119	105.8 Å²	105.8	56%	0.556	54%	0.535	S	S	*	.	H	α-helix	trans	-65.4	-32.3	168.2	-80.7	-177	160.7	0	0	112.4	A791 Q792 E798 L799	A791-E795 PolarHBondContact O-N 2.85Å; Q792-E795 PolarHBondContact O-N 2.86Å; E795-E798 WeakPolarHBondContact O-CB 3.48Å; E795-E798 PolarHBondContact O-N 3.28Å; E795-L799 PolarHBondContact O-N 2.97Å
796	G	27.8	Very low	32.1	Very low	34 Å²	34	116.4 Å²	116.4	35%	0.351	58%	0.578	S	S	.	*	H	α-helix	trans	-65.5	-36	173.8	0	0	0	0	0	113.2	Q792 Q794 E798 L799 E800	Q792-G796 PolarHBondContact O-N 2.82Å; Q794-G796 VanDerWaalsContact C-N 3.31Å; Q794-G796 PolarHBondContact O-N 3.46Å; G796-E798 VanDerWaalsContact C-N 3.29Å; G796-E798 PolarHBondContact O-N 3.15Å; G796-L799 PolarHBondContact O-N 3.46Å; G796-E800 PolarHBondContact O-N 3.2Å; G796-E800 VanDerWaalsContact O-N 3.12Å
797	L	29.1	Very low	31.9	Very low	104 Å²	104	113.9 Å²	113.9	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-68.8	-23.7	172.6	-84.9	157.7	0	0	0	113	F793 Q794	F793-L797 HydrophobicContact CD1-CD1 4.23Å; F793-L797 HydrophobicContact CE1-CD1 4.23Å; F793-L797 PolarHBondContact O-N 2.85Å; Q794-L797 PolarHBondContact O-N 3.45Å
798	E	34.3	Very low	31.6	Very low	134 Å²	134	116.8 Å²	116.8	63%	0.626	59%	0.592	S	S	*	*	H	α-helix	trans	-76.4	-31.3	173.3	-69	-170.7	154.1	0	0	112.7	Q794 E795 G796	Q794-E798 PolarHBondContact O-N 2.92Å; E795-E798 WeakPolarHBondContact O-CB 3.48Å; E795-E798 PolarHBondContact O-N 3.28Å; G796-E798 VanDerWaalsContact C-N 3.29Å; G796-E798 PolarHBondContact O-N 3.15Å
799	L	30.7	Very low	31.2	Very low	119 Å²	119	121.7 Å²	121.7	62%	0.623	62%	0.617	S	S	*	*	H	α-helix	trans	-81.3	-33.1	177.4	-80.5	159.8	0	0	0	113.2	E795 G796 G801 Q802	E795-L799 PolarHBondContact O-N 2.97Å; G796-L799 PolarHBondContact O-N 3.46Å; L799-G801 VanDerWaalsContact C-N 3.28Å; L799-G801 PolarHBondContact O-N 3.23Å; L799-Q802 PolarHBondContact O-N 3.35Å
800	E	29.8	Very low	31.1	Very low	146 Å²	146	123.5 Å²	123.5	68%	0.682	62%	0.624	S	S	*	*	H	α-helix	trans	-68.5	-25.8	173	-86.9	-175.7	154.2	0	0	113	G796	G796-E800 PolarHBondContact O-N 3.2Å; G796-E800 VanDerWaalsContact O-N 3.12Å
801	G	29.9	Very low	30.9	Very low	47 Å²	47	127.6 Å²	127.6	49%	0.485	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.6	-21.2	174.6	0	0	0	0	0	115	L799	L799-G801 VanDerWaalsContact C-N 3.28Å; L799-G801 PolarHBondContact O-N 3.23Å
802	Q	31	Very low	30.8	Very low	151 Å²	151	132.3 Å²	132.3	71%	0.706	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-14.6	178.1	-84.8	-174.7	-22.4	0	0	113.9	L799	L799-Q802 PolarHBondContact O-N 3.35Å
803	N	28.2	Very low	30.7	Very low	140 Å²	140	135.1 Å²	135.1	75%	0.749	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	5.2	177.1	-88.1	-11.6	0	0	0	114.6
804	Q	31	Very low	30.9	Very low	163 Å²	163	133.6 Å²	133.6	76%	0.762	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	8.6	175.7	-94.6	-173.5	-9.9	0	0	115.1
805	Y	34.3	Very low	30.8	Very low	215 Å²	215	135.6 Å²	135.6	84%	0.843	68%	0.676	S	S	*	*			trans	-130.7	65	168.9	-70.8	-78.4	0	0	0	111
806	H	32.5	Very low	30.8	Very low	255 Å²	255	137.1 Å²	137.1	100%	1.181	69%	0.686	S	S	*	*			trans	-129.2	0	148.6	-102.3	-52	0	0	0	109.5

Retrieved 806 of 806 residues in 306.3 ms (Link to these results)

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