G4LXR8_SCHMA Loading...

tryptophan--tRNA ligase

AlphaFold DB , UniProt , Accession G4LXR8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 404 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	31.6	Very low	238 Å²	238	164.5 Å²	164.5	100%	1.172	85%	0.852	S	S	*	*				0	129.8	0	-88.3	-165.7	169.9	0	0	108.9
2	L	33.4	Very low	31.2	Very low	158 Å²	158	169.6 Å²	169.6	83%	0.827	85%	0.851	S	S	*	*			trans	69.2	96.5	163	-74.1	147.7	0	0	0	119.2	Q4	L2-Q4 PolarHBondContact O-N 3.05Å
3	N	30.9	Very low	31	Very low	155 Å²	155	167.9 Å²	167.9	83%	0.829	85%	0.847	S	S	*	*			trans	-47	115.4	146.7	-74.9	-29.4	0	0	0	110.4	C5	N3-C5 PolarHBondContact O-N 3.01Å
4	Q	33.3	Very low	31	Very low	157 Å²	157	164.6 Å²	164.6	73%	0.734	84%	0.839	S	S	*	*			trans	-90.6	94.4	165.7	-76.2	-173.5	-9.7	0	0	109.3	L2 F6	L2-Q4 PolarHBondContact O-N 3.05Å; Q4-F6 HydrophobicContact CB-CE2 4.26Å; Q4-F6 PolarHBondContact O-N 2.62Å
5	C	31.1	Very low	31.1	Very low	121 Å²	121	166.6 Å²	166.6	82%	0.818	83%	0.834	S	S	*	*			trans	-67.4	106.7	161.8	-77.8	0	0	0	0	108.9	N3 S7	N3-C5 PolarHBondContact O-N 3.01Å; C5-S7 PolarHBondContact O-N 2.77Å; C5-S7 VanDerWaalsContact O-N 3.12Å
6	F	32.7	Very low	30.7	Very low	177 Å²	177	171.6 Å²	171.6	78%	0.776	84%	0.84	S	S	*	*			trans	-76.5	96.2	165.8	-80.8	-84	0	0	0	109.4	Q4 L8	Q4-F6 HydrophobicContact CB-CE2 4.26Å; Q4-F6 PolarHBondContact O-N 2.62Å; F6-L8 PolarHBondContact O-N 2.69Å
7	S	29.2	Very low	30.9	Very low	101 Å²	101	170.7 Å²	170.7	71%	0.706	83%	0.833	S	S	*	*			trans	-60.9	109.8	165.9	148.8	0	0	0	0	109.8	C5 R9	C5-S7 PolarHBondContact O-N 2.77Å; C5-S7 VanDerWaalsContact O-N 3.12Å; S7-R9 PolarHBondContact O-N 3.14Å; S7-R9 VanDerWaalsContact O-N 3.11Å
8	L	30.7	Very low	31	Very low	171 Å²	171	168.6 Å²	168.6	90%	0.895	83%	0.831	S	S	*	*			trans	-66.1	103.7	167.6	-68.6	167.4	0	0	0	109.3	F6	F6-L8 PolarHBondContact O-N 2.69Å
9	R	29.5	Very low	31.1	Very low	223 Å²	223	166.9 Å²	166.9	84%	0.842	83%	0.826	S	S	*	*			trans	-68.6	143.9	168.1	-76.9	-171.6	-177.4	-170	2.1	109.9	S7 L11	S7-R9 PolarHBondContact O-N 3.14Å; S7-R9 VanDerWaalsContact O-N 3.11Å; R9-L11 PolarHBondContact O-N 2.83Å
10	P	32	Very low	31.3	Very low	119 Å²	119	164.7 Å²	164.7	77%	0.773	83%	0.825	S	S	*	*			trans	-80.5	123.3	-171.6	27.9	-23.7	0	0	0	110.8	R12	P10-R12 VanDerWaalsContact C-N 3.31Å; P10-R12 PolarHBondContact O-N 3.39Å
11	L	32.7	Very low	31.4	Very low	190 Å²	190	162.9 Å²	162.9	100%	0.995	82%	0.816	S	S	*	*			trans	-70.2	86.8	169.1	-72.9	164.8	0	0	0	109.3	R9	R9-L11 PolarHBondContact O-N 2.83Å
12	R	25.9	Very low	31.6	Very low	225 Å²	225	160.1 Å²	160.1	85%	0.849	80%	0.8	S	S	*	*			trans	-106.1	130.1	162.8	-129.6	-179.2	-174.4	-165.1	2	107.8	P10	P10-R12 VanDerWaalsContact C-N 3.31Å; P10-R12 PolarHBondContact O-N 3.39Å
13	N	29	Very low	32	Very low	148 Å²	148	161.8 Å²	161.8	79%	0.791	80%	0.803	S	S	*	*			trans	93.4	68.1	168.6	-57	-20.7	0	0	0	119
14	V	31.3	Very low	32.4	Very low	122 Å²	122	158.2 Å²	158.2	74%	0.739	78%	0.783	S	S	*	*			trans	-149.3	101.7	139	-165.2	0	0	0	0	104.2
15	Y	31.7	Very low	32.8	Very low	194 Å²	194	156 Å²	156	76%	0.761	78%	0.776	S	S	*	*				-164.6	108	84.7	-91.1	-87.3	0	0	0	109.3	H17	Y15-H17 AromaticContact CD1-CD2 3.7Å; Y15-H17 AromaticContact CE1-CD2 3.96Å
16	R	25.9	Very low	33.7	Very low	246 Å²	246	154.7 Å²	154.7	93%	0.928	77%	0.766	S	S	*	*			trans	-88.2	84.6	151.2	-88.1	-178.3	173.4	161.6	-2.9	106.6
17	H	33	Very low	34.1	Very low	157 Å²	157	150 Å²	150	73%	0.727	76%	0.756	S	S	*	*			trans	-106	103.6	154.6	-90	-44.1	0	0	0	107.5	Y15 N19	Y15-H17 AromaticContact CD1-CD2 3.7Å; Y15-H17 AromaticContact CE1-CD2 3.96Å; H17-N19 PolarHBondContact O-N 3.4Å
18	V	33.8	Very low	34.6	Very low	132 Å²	132	149.9 Å²	149.9	80%	0.8	74%	0.743	S	S	*	*			trans	-61.9	112.6	172.9	177	0	0	0	0	107.4
19	N	31.3	Very low	35.1	Very low	138 Å²	138	146.8 Å²	146.8	74%	0.738	73%	0.725	S	S	*	*			trans	-62.9	123.4	168.7	-98	-37.7	0	0	0	109.2	H17 I21	H17-N19 PolarHBondContact O-N 3.4Å; N19-I21 VanDerWaalsContact C-N 3.3Å; N19-I21 PolarHBondContact O-N 3.13Å; N19-I21 VanDerWaalsContact O-N 3.1Å
20	P	36.5	Very low	35.6	Very low	122 Å²	122	140.8 Å²	140.8	79%	0.792	71%	0.713	S	S	*	*			trans	-86.6	75.1	173.4	35.2	-29.3	0	0	0	108.6
21	I	33	Very low	35.8	Very low	127 Å²	127	141 Å²	141	65%	0.651	71%	0.706	S	S	*	*			trans	-132	61.3	164.4	-46.6	177.9	0	0	0	108.3	N19	N19-I21 VanDerWaalsContact C-N 3.3Å; N19-I21 PolarHBondContact O-N 3.13Å; N19-I21 VanDerWaalsContact O-N 3.1Å
22	H	36.6	Very low	36	Very low	179 Å²	179	136.7 Å²	136.7	83%	0.829	68%	0.684	S	S	*	*			trans	-141	93.1	158.7	-88.2	-62.5	0	0	0	107.3
23	H	41.8	Very low	36.4	Very low	193 Å²	193	130.6 Å²	130.6	89%	0.894	67%	0.668	S	S	*	*			trans	176.9	67.2	145.1	-89.7	-60.2	0	0	0	108.1
24	I	39.3	Very low	36.8	Very low	81 Å²	81	126.2 Å²	126.2	42%	0.415	65%	0.653	S	S	.	*			trans	-91.6	121.7	160.7	-62.5	176.9	0	0	0	105.8	Q28 Q29 L32	I24-Q28 HydrophobicContact CG2-CB 3.66Å; I24-Q29 HydrophobicContact CG2-CB 4.46Å; I24-L32 HydrophobicContact CD1-CD1 4.26Å; I24-L32 HydrophobicContact CG2-CD1 4.26Å
25	L	42.6	Very low	37.2	Very low	109 Å²	109	123.8 Å²	123.8	57%	0.571	65%	0.645	S	S	*	*			trans	-64.3	145.6	178.5	-76.8	156.4	0	0	0	110.2	S27 Q28 Q29	L25-S27 PolarHBondContact O-N 3.24Å; L25-Q28 WeakPolarHBondContact O-CA 3.25Å; L25-Q28 WeakPolarHBondContact O-CB 3.41Å; L25-Q28 PolarHBondContact O-N 2.81Å; L25-Q29 PolarHBondContact O-N 3.4Å; L25-Q29 VanDerWaalsContact O-N 3.09Å
26	P	50.2	Low	38	Very low	94 Å²	94	118 Å²	118	61%	0.61	63%	0.633	S	S	*	*	H	α-helix	trans	-52.5	-34.9	-177.4	-28	34.2	0	0	0	114.2	Q29 V30	P26-Q29 WeakPolarHBondContact O-CB 3.32Å; P26-Q29 PolarHBondContact O-N 2.74Å; P26-V30 WeakPolarHBondContact O-CG2 3.23Å; P26-V30 PolarHBondContact O-N 3.19Å; P26-V30 VanDerWaalsContact O-N 3.09Å
27	S	40.9	Very low	39	Very low	80 Å²	80	114.6 Å²	114.6	56%	0.559	62%	0.62	S	S	*	*	H	α-helix	trans	-65.5	-36.7	176.5	54	0	0	0	0	113.3	L25 L31	L25-S27 PolarHBondContact O-N 3.24Å; S27-L31 PolarHBondContact O-N 3.33Å
28	Q	39.6	Very low	40	Very low	97 Å²	97	117 Å²	117	45%	0.453	62%	0.623	S	S	.	*	H	α-helix	trans	-73.8	-30.5	174.3	-68.4	176.4	-20.7	0	0	111.5	I24 L25 L31 L32	I24-Q28 HydrophobicContact CG2-CB 3.66Å; L25-Q28 WeakPolarHBondContact O-CA 3.25Å; L25-Q28 WeakPolarHBondContact O-CB 3.41Å; L25-Q28 PolarHBondContact O-N 2.81Å; Q28-L31 PolarHBondContact O-N 2.92Å; Q28-L32 WeakPolarHBondContact O-CB 3.49Å; Q28-L32 WeakPolarHBondContact O-CG 3.39Å; Q28-L32 PolarHBondContact O-N 3.17Å
29	Q	40.2	Very low	41.7	Very low	107 Å²	107	116.1 Å²	116.1	50%	0.5	61%	0.614	S	S	.	*	H	α-helix	trans	-65.8	-39.8	174.6	-133.7	164.7	9.6	0	0	111.5	I24 L25 P26 N33	I24-Q29 HydrophobicContact CG2-CB 4.46Å; L25-Q29 PolarHBondContact O-N 3.4Å; L25-Q29 VanDerWaalsContact O-N 3.09Å; P26-Q29 WeakPolarHBondContact O-CB 3.32Å; P26-Q29 PolarHBondContact O-N 2.74Å; Q29-N33 WeakPolarHBondContact O-CB 3.38Å; Q29-N33 PolarHBondContact O-N 3.22Å; Q29-N33 PolarHBondContact O-ND2 3.32Å; Q29-N33 VanDerWaalsContact O-ND2 3.1Å
30	V	40.3	Very low	44.3	Very low	97 Å²	97	110.2 Å²	110.2	59%	0.588	58%	0.584	S	S	*	*	H	α-helix	trans	-66	-42.8	173.6	175.6	0	0	0	0	111.5	P26 N33 A34	P26-V30 WeakPolarHBondContact O-CG2 3.23Å; P26-V30 PolarHBondContact O-N 3.19Å; P26-V30 VanDerWaalsContact O-N 3.09Å; V30-N33 PolarHBondContact O-N 3.47Å; V30-A34 VanDerWaalsContact O-CB 3.29Å; V30-A34 WeakPolarHBondContact O-CB 3.44Å; V30-A34 PolarHBondContact O-N 2.7Å
31	L	35.7	Very low	47	Very low	123 Å²	123	106.5 Å²	106.5	64%	0.644	56%	0.556	S	S	*	*	H	α-helix	trans	-68.6	-40.5	178.3	-78.7	165.6	0	0	0	112.9	S27 Q28 N33 A34 A35	S27-L31 PolarHBondContact O-N 3.33Å; Q28-L31 PolarHBondContact O-N 2.92Å; L31-N33 VanDerWaalsContact C-N 3.33Å; L31-A34 PolarHBondContact O-N 3.4Å; L31-A35 VanDerWaalsContact O-CB 3.23Å; L31-A35 WeakPolarHBondContact O-CB 2.94Å; L31-A35 PolarHBondContact O-N 3.42Å
32	L	38.4	Very low	50	Low	100 Å²	100	100.5 Å²	100.5	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-63.1	-40.8	171.5	-78.7	163.8	0	0	0	110.8	I24 Q28 S36	I24-L32 HydrophobicContact CD1-CD1 4.26Å; I24-L32 HydrophobicContact CG2-CD1 4.26Å; Q28-L32 WeakPolarHBondContact O-CB 3.49Å; Q28-L32 WeakPolarHBondContact O-CG 3.39Å; Q28-L32 PolarHBondContact O-N 3.17Å; L32-S36 WeakPolarHBondContact O-CA 3.34Å; L32-S36 WeakPolarHBondContact O-CB 3.47Å; L32-S36 PolarHBondContact O-N 3.09Å
33	N	34.3	Very low	52.9	Low	96 Å²	96	92.1 Å²	92.1	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-68.3	-36.7	176.3	-72.4	-20.8	0	0	0	112.5	Q29 V30 L31 R37	Q29-N33 WeakPolarHBondContact O-CB 3.38Å; Q29-N33 PolarHBondContact O-N 3.22Å; Q29-N33 PolarHBondContact O-ND2 3.32Å; Q29-N33 VanDerWaalsContact O-ND2 3.1Å; V30-N33 PolarHBondContact O-N 3.47Å; L31-N33 VanDerWaalsContact C-N 3.33Å; N33-R37 VanDerWaalsContact O-CG 3.24Å; N33-R37 WeakPolarHBondContact O-CG 3.11Å; N33-R37 PolarHBondContact O-N 2.7Å
34	A	36.3	Very low	55.5	Low	57 Å²	57	83.4 Å²	83.4	47%	0.471	45%	0.447	S	S	.	.	H	α-helix	trans	-75.1	-41.1	178.5	0	0	0	0	0	112.4	V30 L31	V30-A34 VanDerWaalsContact O-CB 3.29Å; V30-A34 WeakPolarHBondContact O-CB 3.44Å; V30-A34 PolarHBondContact O-N 2.7Å; L31-A34 PolarHBondContact O-N 3.4Å
35	A	39.1	Very low	58.2	Low	71 Å²	71	81.5 Å²	81.5	59%	0.587	45%	0.447	S	S	*	.	H	α-helix	trans	-70.6	-35.4	174.9	0	0	0	0	0	112	L31 R37	L31-A35 VanDerWaalsContact O-CB 3.23Å; L31-A35 WeakPolarHBondContact O-CB 2.94Å; L31-A35 PolarHBondContact O-N 3.42Å; A35-R37 VanDerWaalsContact C-N 3.33Å; A35-R37 PolarHBondContact O-N 2.96Å
36	S	48.3	Very low	60.7	Low	71 Å²	71	77.9 Å²	77.9	50%	0.497	43%	0.428	S	S	.	.	H	α-helix	trans	-71.4	-24.3	176.7	-174.5	0	0	0	0	113.2	L32 R38	L32-S36 WeakPolarHBondContact O-CA 3.34Å; L32-S36 WeakPolarHBondContact O-CB 3.47Å; L32-S36 PolarHBondContact O-N 3.09Å; S36-R38 VanDerWaalsContact C-N 3.31Å; S36-R38 PolarHBondContact O-N 3.44Å
37	R	48.1	Very low	62.8	Low	175 Å²	175	76.6 Å²	76.6	66%	0.66	41%	0.414	S	S	*	.	H	α-helix	trans	-68	-27.3	177.7	-84.6	175.5	-170.6	-154.8	3.8	113.5	N33 A35 N39 A40	N33-R37 VanDerWaalsContact O-CG 3.24Å; N33-R37 WeakPolarHBondContact O-CG 3.11Å; N33-R37 PolarHBondContact O-N 2.7Å; A35-R37 VanDerWaalsContact C-N 3.33Å; A35-R37 PolarHBondContact O-N 2.96Å; R37-N39 PolarHBondContact O-N 2.83Å; R37-N39 VanDerWaalsContact O-N 3.09Å; R37-A40 PolarHBondContact O-N 3.32Å
38	R	53.2	Low	65.3	Low	207 Å²	207	72.9 Å²	72.9	78%	0.781	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.4	-178	-87.4	-173	-178.5	153.8	1.3	114.8	S36 S74	S36-R38 VanDerWaalsContact C-N 3.31Å; S36-R38 PolarHBondContact O-N 3.44Å; R38-S74 VanDerWaalsContact C-OG 3.26Å; R38-S74 PolarHBondContact O-OG 2.86Å
39	N	70.9	Confident	67.3	Low	114 Å²	114	69.1 Å²	69.1	61%	0.61	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	29.2	179.4	-69.7	-16.7	0	0	0	112.4	R37 F41 S74	R37-N39 PolarHBondContact O-N 2.83Å; R37-N39 VanDerWaalsContact O-N 3.09Å; N39-F41 PolarHBondContact O-N 3.5Å; N39-S74 WeakPolarHBondContact CA-OG 3.29Å; N39-S74 PolarHBondContact N-OG 3.25Å
40	A	85.1	Confident	69.4	Low	15 Å²	15	65.5 Å²	65.5	12%	0.124	36%	0.364	C	S	.	.			trans	-73.1	119.4	177.8	0	0	0	0	0	110.3	R37 V73 S74	R37-A40 PolarHBondContact O-N 3.32Å; A40-V73 VanDerWaalsContact O-CG2 3.23Å; A40-V73 WeakPolarHBondContact O-CG2 3.29Å; A40-S74 PolarHBondContact N-OG 2.88Å; A40-S74 PolarHBondContact O-N 2.86Å
41	F	92.8	Very high	71.7	Confident	44 Å²	44	66.1 Å²	66.1	19%	0.193	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.2	170.3	-63.2	-18.8	0	0	0	110.3	N39 Q75 F77 Y196 A198 H199 L200 L377	N39-F41 PolarHBondContact O-N 3.5Å; F41-Q75 WeakPolarHBondContact CA-O 3.47Å; F41-Q75 HydrophobicContact CD1-CB 3.77Å; F41-Q75 HydrophobicContact CD1-CG 4.22Å; F41-Q75 HydrophobicContact CE1-CB 4Å; F41-Q75 HydrophobicContact CE1-CG 3.91Å; F41-F77 HydrophobicContact CB-CE2 4.42Å; F41-F77 HydrophobicContact CG-CE2 4.41Å; F41-Y196 WeakPolarHBondContact CD2-O 3.39Å; F41-A198 CarbonylContact O-C 3.22Å; F41-A198 WeakPolarHBondContact O-CA 3.32Å; F41-H199 PolarHBondContact O-N 3.07Å; F41-L200 PolarHBondContact O-N 3.36Å; F41-L377 HydrophobicContact CE2-CD2 4.41Å
42	A	96.2	Very high	74.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.9	173.2	0	0	0	0	0	110.6	Y67 V73 Q75 F76 F77 L200 P202	A42-Y67 HydrophobicContact CB-CE1 4.06Å; A42-V73 HydrophobicContact CB-CG2 3.83Å; A42-Q75 PolarHBondContact N-O 3.39Å; A42-F76 HydrophobicContact CB-CD2 3.83Å; A42-F76 HydrophobicContact CB-CE2 4.36Å; A42-F76 CarbonylContact O-C 3.08Å; A42-F76 WeakPolarHBondContact O-CA 3.3Å; A42-F77 WeakPolarHBondContact O-CD2 3.3Å; A42-F77 PolarHBondContact O-N 3.03Å; A42-L200 WeakPolarHBondContact CA-O 3.22Å; A42-L200 HydrophobicContact CB-CB 4.21Å; A42-P202 HydrophobicContact CB-CG 4.4Å
43	V	97	Very high	77.1	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	135	174.8	65.4	0	0	0	0	110.4	F77 I193 Y196 A198 L200 V201 P202	V43-F77 WeakPolarHBondContact CA-O 3.24Å; V43-F77 HydrophobicContact CB-CB 4.03Å; V43-F77 HydrophobicContact CG2-CB 3.77Å; V43-I193 HydrophobicContact CG1-CB 4.47Å; V43-I193 HydrophobicContact CG1-CG1 4.49Å; V43-I193 HydrophobicContact CG1-CG2 4.46Å; V43-Y196 HydrophobicContact CG2-CD2 4.33Å; V43-A198 HydrophobicContact CB-CB 3.9Å; V43-A198 HydrophobicContact CG1-CB 3.28Å; V43-L200 PolarHBondContact N-O 3.28Å; V43-L200 VanDerWaalsContact N-O 3.1Å; V43-V201 HydrophobicContact CG1-CG2 4.27Å; V43-V201 WeakPolarHBondContact O-CA 3.43Å; V43-V201 WeakPolarHBondContact O-CG1 3.49Å; V43-P202 VanDerWaalsContact O-CD 3.24Å; V43-P202 WeakPolarHBondContact O-CD 3.31Å
44	T	96.6	Very high	80.1	Confident	10 Å²	10	51.8 Å²	51.8	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	163.7	170.3	-168	0	0	0	0	109.2	F76 F77 M78 L79 P202	T44-F76 HydrophobicContact CG2-CE1 3.89Å; T44-F76 HydrophobicContact CG2-CZ 3.52Å; T44-F77 PolarHBondContact N-O 3.44Å; T44-M78 HydrophobicContact CG2-CE 3.54Å; T44-M78 HydrophobicContact CG2-SD 3.81Å; T44-L79 WeakPolarHBondContact O-CB 3.19Å; T44-L79 PolarHBondContact O-N 3.23Å; T44-P202 WeakPolarHBondContact CB-O 3.45Å; T44-P202 PolarHBondContact OG1-O 3.48Å
45	G	96.1	Very high	82.8	Confident	41 Å²	41	49.8 Å²	49.8	42%	0.423	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	144	-179.5	0	0	0	0	0	112.9	L79	G45-L79 CarbonylContact C-O 3.49Å; G45-L79 VanDerWaalsContact CA-O 3.22Å; G45-L79 WeakPolarHBondContact CA-O 3.35Å
46	I	95.2	Very high	85.4	Confident	34 Å²	34	48.9 Å²	48.9	17%	0.174	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.6	177.7	-56.7	173.5	0	0	0	108.6	I61 M78 L79 A81 L101 L105	I46-I61 HydrophobicContact CD1-CG1 4.21Å; I46-M78 HydrophobicContact CD1-CE 4Å; I46-M78 HydrophobicContact CD1-SD 3.85Å; I46-M78 HydrophobicContact CG1-SD 4.05Å; I46-L79 PolarHBondContact N-O 2.82Å; I46-A81 PolarHBondContact O-N 3.35Å; I46-L101 HydrophobicContact CB-CD1 4.47Å; I46-L101 HydrophobicContact CB-CD2 4.03Å; I46-L101 HydrophobicContact CG2-CD1 3.83Å; I46-L101 HydrophobicContact CG2-CD2 3.72Å; I46-L101 HydrophobicContact CG2-CG 4.44Å; I46-L105 HydrophobicContact CD1-CD2 4.04Å
47	Q	93.8	Very high	87.6	Confident	67 Å²	67	46 Å²	46	31%	0.313	23%	0.232	S	C	.	.			trans	-71.2	133.1	172.6	-70.6	-179.5	-18.7	0	0	110.4	S49 A81 H84 S85	Q47-S49 PolarHBondContact O-N 3.12Å; Q47-A81 HydrophobicContact CG-CB 4.15Å; Q47-H84 HydrophobicContact CG-CB 4.14Å; Q47-H84 PolarHBondContact NE2-O 3.07Å; Q47-S85 WeakPolarHBondContact CB-OG 3.3Å
48	P	93.2	Very high	89.9	Confident	1 Å²	1	38 Å²	38	1%	0.006	20%	0.202	C	C	.	.			trans	-70.1	44	168.1	30.8	-39.1	0	0	0	113.4	G50 I80 D82 S85 C91 L94 I98 L101	P48-G50 VanDerWaalsContact C-N 3.34Å; P48-G50 PolarHBondContact O-N 3.28Å; P48-G50 VanDerWaalsContact O-N 3.17Å; P48-I80 HydrophobicContact CB-CG2 4.36Å; P48-I80 HydrophobicContact CG-CG2 4.14Å; P48-D82 HydrophobicContact CG-CB 4.21Å; P48-S85 VanDerWaalsContact CD-OG 3.24Å; P48-S85 WeakPolarHBondContact CD-OG 3.48Å; P48-C91 PolarHBondContact O-SG 3.32Å; P48-L94 HydrophobicContact CB-CD1 4.27Å; P48-L94 HydrophobicContact CG-CD1 3.51Å; P48-I98 HydrophobicContact CB-CG1 3.99Å; P48-I98 HydrophobicContact CG-CG1 3.87Å; P48-L101 HydrophobicContact CB-CD2 4.17Å
49	S	83.1	Confident	91.7	Very high	19 Å²	19	29.1 Å²	29.1	13%	0.133	18%	0.175	C	C	.	.			trans	-91.1	48.1	-171.2	57.1	0	0	0	0	113.7	Q47 K257	Q47-S49 PolarHBondContact O-N 3.12Å; S49-K257 VanDerWaalsContact O-CD 3.23Å; S49-K257 WeakPolarHBondContact O-CD 3.48Å; S49-K257 PolarHBondContact O-NZ 3.36Å
50	G	83.2	Confident	92.7	Very high	31 Å²	31	25.6 Å²	25.6	32%	0.32	16%	0.158	S	C	.	.	S	Bend	trans	98.2	-179.7	177.4	0	0	0	0	0	115.1	P48 K257	P48-G50 VanDerWaalsContact C-N 3.34Å; P48-G50 PolarHBondContact O-N 3.28Å; P48-G50 VanDerWaalsContact O-N 3.17Å; G50-K257 PolarHBondContact O-NZ 3.34Å
51	K	88.8	Confident	93.2	Very high	110 Å²	110	25 Å²	25	48%	0.478	15%	0.152	S	C	.	.			trans	-56.2	126.8	-167.7	-63.8	-177.4	-179.4	178.4	0	113.5	H53 K257 Y267	K51-H53 PolarHBondContact O-N 3.06Å; K51-K257 WeakPolarHBondContact O-CE 3.42Å; K51-Y267 HydrophobicContact CB-CD1 3.71Å; K51-Y267 HydrophobicContact CB-CE1 3.9Å
52	P	92.9	Very high	93.3	Very high	9 Å²	9	25.2 Å²	25.2	6%	0.058	15%	0.153	C	C	.	.			trans	-61.4	133.2	172.6	-26.4	37.4	0	0	0	112.3	T104 L268	P52-T104 HydrophobicContact CB-CG2 4Å; P52-T104 HydrophobicContact CG-CG2 3.93Å; P52-L268 PolarHBondContact O-N 2.88Å; P52-L268 VanDerWaalsContact O-N 3.16Å
53	H	95	Very high	93.2	Very high	8 Å²	8	26.3 Å²	26.3	4%	0.037	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-114.5	168.8	177.7	65.1	88	0	0	0	112.3	K51 G55 N56 Y57 M255 I265 I266 Y267 L268	K51-H53 PolarHBondContact O-N 3.06Å; H53-G55 PolarHBondContact ND1-N 2.99Å; H53-G55 PolarHBondContact O-N 2.97Å; H53-G55 VanDerWaalsContact O-N 3.13Å; H53-N56 PolarHBondContact CD2-OD1 2.77Å; H53-N56 PolarHBondContact N-OD1 2.64Å; H53-N56 PolarHBondContact NE2-ND2 2.9Å; H53-N56 PolarHBondContact NE2-OD1 2.88Å; H53-N56 WeakPolarHBondContact O-CA 3.38Å; H53-N56 WeakPolarHBondContact O-CB 3.38Å; H53-N56 PolarHBondContact O-N 3.42Å; H53-Y57 PolarHBondContact O-N 3.42Å; H53-Y57 VanDerWaalsContact O-N 3.09Å; H53-M255 HydrophobicContact CB-SD 4.14Å; H53-M255 PolarHBondContact CE1-O 3.33Å; H53-M255 PolarHBondContact ND1-SD 2.71Å; H53-I265 HydrophobicContact CB-CG2 3.58Å; H53-I266 CarbonylContact C-O 3.58Å; H53-I266 VanDerWaalsContact CA-O 3.26Å; H53-I266 WeakPolarHBondContact CA-O 3.44Å; H53-I266 VanDerWaalsContact CB-O 3.31Å; H53-I266 WeakPolarHBondContact CB-O 3.31Å; H53-Y267 HydrophobicContact CB-CD1 4.06Å; H53-Y267 HydrophobicContact CB-CE1 4.34Å; H53-L268 VanDerWaalsContact C-CD1 3.42Å
54	L	96.8	Very high	93.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-51.9	-38.8	-176.9	178.8	64.2	0	0	0	112.9	N56 Y57 L58 I245 M255 I266 I306 L339 F343	L54-N56 PolarHBondContact O-N 2.89Å; L54-Y57 HydrophobicContact CD1-CD1 4.45Å; L54-Y57 PolarHBondContact O-N 3.44Å; L54-L58 HydrophobicContact CD1-CD1 3.6Å; L54-L58 HydrophobicContact CD1-CG 3.81Å; L54-L58 HydrophobicContact CD2-CD1 4.47Å; L54-L58 HydrophobicContact CG-CD1 3.91Å; L54-L58 HydrophobicContact CG-CG 4.39Å; L54-L58 PolarHBondContact O-N 2.94Å; L54-I245 HydrophobicContact CD2-CG2 4.33Å; L54-I245 HydrophobicContact CG-CG2 4.46Å; L54-M255 HydrophobicContact CB-SD 4.22Å; L54-I266 HydrophobicContact CB-CB 4.04Å; L54-I266 HydrophobicContact CB-CG2 4.44Å; L54-I266 HydrophobicContact CD2-CB 4.37Å; L54-I266 HydrophobicContact CD2-CD1 3.87Å; L54-I266 PolarHBondContact N-O 3.16Å; L54-I306 HydrophobicContact CD2-CD1 3.93Å; L54-I306 HydrophobicContact CD2-CG1 4.04Å; L54-I306 HydrophobicContact CD2-CG2 4.02Å; L54-L339 HydrophobicContact CD1-CD2 3.56Å; L54-L339 HydrophobicContact CD2-CD1 4.32Å; L54-L339 HydrophobicContact CD2-CD2 3.99Å; L54-L339 HydrophobicContact CG-CD2 4.44Å; L54-F343 HydrophobicContact CD1-CE1 4.17Å; L54-F343 HydrophobicContact CD1-CZ 3.65Å
55	G	94	Very high	93.1	Very high	15 Å²	15	26.1 Å²	26.1	16%	0.155	16%	0.159	C	C	.	.	H	α-helix	trans	-63.4	-35.2	174.8	0	0	0	0	0	114	H53 G59	H53-G55 PolarHBondContact ND1-N 2.99Å; H53-G55 PolarHBondContact O-N 2.97Å; H53-G55 VanDerWaalsContact O-N 3.13Å; G55-G59 WeakPolarHBondContact O-CA 3.38Å; G55-G59 PolarHBondContact O-N 3.41Å
56	N	92.7	Very high	93	Very high	52 Å²	52	27 Å²	27	28%	0.278	16%	0.156	S	C	.	.	H	α-helix	trans	-69.7	-41.4	172.4	-51	131.6	0	0	0	110.8	H53 L54 V60 I61	H53-N56 PolarHBondContact CD2-OD1 2.77Å; H53-N56 PolarHBondContact N-OD1 2.64Å; H53-N56 PolarHBondContact NE2-ND2 2.9Å; H53-N56 PolarHBondContact NE2-OD1 2.88Å; H53-N56 WeakPolarHBondContact O-CA 3.38Å; H53-N56 WeakPolarHBondContact O-CB 3.38Å; H53-N56 PolarHBondContact O-N 3.42Å; L54-N56 PolarHBondContact O-N 2.89Å; N56-V60 PolarHBondContact O-N 3.01Å; N56-I61 HydrophobicContact CB-CD1 4.43Å; N56-I61 PolarHBondContact O-N 2.98Å
57	Y	95.8	Very high	92.9	Very high	12 Å²	12	27 Å²	27	5%	0.047	16%	0.155	C	C	.	.	I	π-helix	trans	-63.1	-58.4	-179	176.6	-110.5	0	0	0	112.4	H53 L54 G59 I61 K62 C108 L268 I310 E342 F343 I346	H53-Y57 PolarHBondContact O-N 3.42Å; H53-Y57 VanDerWaalsContact O-N 3.09Å; L54-Y57 HydrophobicContact CD1-CD1 4.45Å; L54-Y57 PolarHBondContact O-N 3.44Å; Y57-G59 VanDerWaalsContact C-N 3.35Å; Y57-G59 PolarHBondContact O-N 3.49Å; Y57-I61 HydrophobicContact CD2-CB 4.36Å; Y57-I61 HydrophobicContact CD2-CG2 4.4Å; Y57-I61 PolarHBondContact O-N 2.89Å; Y57-K62 HydrophobicContact CD2-CB 4.27Å; Y57-K62 HydrophobicContact CE1-CB 4.28Å; Y57-K62 HydrophobicContact CE1-CD 3.92Å; Y57-K62 HydrophobicContact CE2-CB 3.9Å; Y57-K62 WeakPolarHBondContact O-CB 3.45Å; Y57-K62 PolarHBondContact O-N 3.15Å; Y57-C108 HydrophobicContact CE2-CB 4.13Å; Y57-L268 HydrophobicContact CD2-CD2 4.13Å; Y57-L268 HydrophobicContact CG-CD2 4.33Å; Y57-I310 HydrophobicContact CE1-CD1 4.39Å; Y57-E342 HydrophobicContact CE1-CG 4.05Å; Y57-E342 PolarHBondContact OH-OE1 2.83Å; Y57-F343 AromaticContact CD1-CE1 3.92Å; Y57-F343 HydrophobicContact CD1-CE1 3.92Å; Y57-F343 HydrophobicContact CE1-CE1 4.08Å; Y57-I346 HydrophobicContact CE2-CD1 3.75Å
58	L	95.3	Very high	92.9	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.026	14%	0.14	C	C	.	.	I	π-helix	trans	-72.2	-29.4	-178.6	-65.6	176.2	0	0	0	112.8	L54 K62 P63 I245 A309 I310	L54-L58 HydrophobicContact CD1-CD1 3.6Å; L54-L58 HydrophobicContact CD1-CG 3.81Å; L54-L58 HydrophobicContact CD2-CD1 4.47Å; L54-L58 HydrophobicContact CG-CD1 3.91Å; L54-L58 HydrophobicContact CG-CG 4.39Å; L54-L58 PolarHBondContact O-N 2.94Å; L58-K62 HydrophobicContact CD2-CD 4.22Å; L58-P63 WeakPolarHBondContact O-CD 3.39Å; L58-P63 VanDerWaalsContact O-CG 3.31Å; L58-P63 WeakPolarHBondContact O-CG 3.42Å; L58-I245 HydrophobicContact CB-CD1 4.49Å; L58-I245 HydrophobicContact CB-CG1 4.16Å; L58-I245 HydrophobicContact CD1-CD1 3.79Å; L58-I245 HydrophobicContact CD1-CG1 3.98Å; L58-A309 HydrophobicContact CB-CB 4.5Å; L58-A309 HydrophobicContact CD1-CB 3.82Å; L58-A309 HydrophobicContact CD2-CB 3.71Å; L58-A309 HydrophobicContact CG-CB 4.21Å; L58-I310 HydrophobicContact CD2-CD1 3.71Å; L58-I310 HydrophobicContact CD2-CG1 4.29Å
59	G	91.2	Very high	92.9	Very high	22 Å²	22	32.3 Å²	32.3	23%	0.227	17%	0.172	C	C	.	.	I	π-helix	trans	-80.9	-33.1	-176.4	0	0	0	0	0	114.5	G55 Y57	G55-G59 WeakPolarHBondContact O-CA 3.38Å; G55-G59 PolarHBondContact O-N 3.41Å; Y57-G59 VanDerWaalsContact C-N 3.35Å; Y57-G59 PolarHBondContact O-N 3.49Å
60	V	91.5	Very high	93.3	Very high	40 Å²	40	37 Å²	37	24%	0.242	20%	0.195	C	C	.	.	I	π-helix	trans	-137.6	-54.1	-171	-178.3	0	0	0	0	112.4	N56 P63 C64	N56-V60 PolarHBondContact O-N 3.01Å; V60-P63 WeakPolarHBondContact O-CD 3.39Å; V60-C64 VanDerWaalsContact O-CB 3.32Å; V60-C64 WeakPolarHBondContact O-CB 3.28Å; V60-C64 PolarHBondContact O-N 3.26Å; V60-C64 PolarHBondContact O-SG 3.27Å
61	I	95.2	Very high	93.6	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.01	19%	0.188	C	C	.	.	I	π-helix	trans	-65.3	-55.7	-168.9	-59	171.7	0	0	0	111.3	I46 N56 Y57 C64 V65 T104 L105 C108 F110	I46-I61 HydrophobicContact CD1-CG1 4.21Å; N56-I61 HydrophobicContact CB-CD1 4.43Å; N56-I61 PolarHBondContact O-N 2.98Å; Y57-I61 HydrophobicContact CD2-CB 4.36Å; Y57-I61 HydrophobicContact CD2-CG2 4.4Å; Y57-I61 PolarHBondContact O-N 2.89Å; I61-C64 PolarHBondContact O-N 2.6Å; I61-V65 WeakPolarHBondContact O-CG2 3.39Å; I61-V65 PolarHBondContact O-N 2.98Å; I61-T104 HydrophobicContact CD1-CG2 4.4Å; I61-L105 HydrophobicContact CD1-CD2 4.48Å; I61-L105 HydrophobicContact CG1-CD2 4.23Å; I61-L105 HydrophobicContact CG2-CD2 4.06Å; I61-C108 HydrophobicContact CG2-CB 3.56Å; I61-F110 HydrophobicContact CG2-CE2 4.2Å
62	K	95.3	Very high	93.6	Very high	48 Å²	48	38 Å²	38	21%	0.209	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-48.3	179.5	-178.9	179.5	-175.1	173.4	0	111.5	Y57 L58 C64 V65 T66 A309 I310 E342	Y57-K62 HydrophobicContact CD2-CB 4.27Å; Y57-K62 HydrophobicContact CE1-CB 4.28Å; Y57-K62 HydrophobicContact CE1-CD 3.92Å; Y57-K62 HydrophobicContact CE2-CB 3.9Å; Y57-K62 WeakPolarHBondContact O-CB 3.45Å; Y57-K62 PolarHBondContact O-N 3.15Å; L58-K62 HydrophobicContact CD2-CD 4.22Å; K62-C64 VanDerWaalsContact C-N 3.32Å; K62-C64 PolarHBondContact O-N 3.36Å; K62-V65 PolarHBondContact O-N 3.38Å; K62-V65 VanDerWaalsContact O-N 3.15Å; K62-T66 PolarHBondContact O-N 3.43Å; K62-T66 PolarHBondContact O-OG1 3.35Å; K62-A309 PolarHBondContact NZ-O 3.44Å; K62-I310 PolarHBondContact NZ-O 3.46Å; K62-E342 WeakPolarHBondContact CE-OE1 3.31Å; K62-E342 IonicContact NZ-OE1 3.33Å; K62-E342 PolarHBondContact NZ-OE1 3.18Å
63	P	94.7	Very high	93.5	Very high	23 Å²	23	37.9 Å²	37.9	15%	0.149	20%	0.199	C	C	.	.	H	α-helix	trans	-55.6	-40.7	173.2	-28.5	35.2	0	0	0	114.5	L58 V60 T66 Y67 F240 A242	L58-P63 WeakPolarHBondContact O-CD 3.39Å; L58-P63 VanDerWaalsContact O-CG 3.31Å; L58-P63 WeakPolarHBondContact O-CG 3.42Å; V60-P63 WeakPolarHBondContact O-CD 3.39Å; P63-T66 PolarHBondContact O-N 2.88Å; P63-Y67 VanDerWaalsContact O-CB 3.26Å; P63-Y67 WeakPolarHBondContact O-CB 3.2Å; P63-Y67 PolarHBondContact O-N 3.31Å; P63-F240 HydrophobicContact CB-CB 3.96Å; P63-F240 HydrophobicContact CB-CD1 4.11Å; P63-F240 HydrophobicContact CB-CD2 3.4Å; P63-F240 VanDerWaalsContact CB-CD2 3.4Å; P63-F240 HydrophobicContact CB-CE1 4.47Å; P63-F240 HydrophobicContact CB-CE2 3.81Å; P63-F240 HydrophobicContact CB-CG 3.55Å; P63-F240 HydrophobicContact CB-CZ 4.32Å; P63-F240 HydrophobicContact CG-CD2 4.39Å; P63-A242 HydrophobicContact CG-CB 4.05Å
64	C	95.6	Very high	93.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-40.2	176.4	-74.5	0	0	0	0	112.3	V60 I61 K62 Y67 C68 F76 F110	V60-C64 VanDerWaalsContact O-CB 3.32Å; V60-C64 WeakPolarHBondContact O-CB 3.28Å; V60-C64 PolarHBondContact O-N 3.26Å; V60-C64 PolarHBondContact O-SG 3.27Å; I61-C64 PolarHBondContact O-N 2.6Å; K62-C64 VanDerWaalsContact C-N 3.32Å; K62-C64 PolarHBondContact O-N 3.36Å; C64-Y67 PolarHBondContact O-N 2.95Å; C64-C68 WeakPolarHBondContact O-CB 3.5Å; C64-C68 PolarHBondContact O-N 3.33Å; C64-C68 PolarHBondContact O-SG 3.46Å; C64-F76 HydrophobicContact CB-CZ 3.88Å; C64-F110 HydrophobicContact CB-CE2 4.45Å; C64-F110 HydrophobicContact CB-CZ 3.75Å
65	V	95.2	Very high	93.2	Very high	10 Å²	10	41.7 Å²	41.7	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-48.5	174.7	172.7	0	0	0	0	110.4	I61 K62 Y67 C68 R69 F110	I61-V65 WeakPolarHBondContact O-CG2 3.39Å; I61-V65 PolarHBondContact O-N 2.98Å; K62-V65 PolarHBondContact O-N 3.38Å; K62-V65 VanDerWaalsContact O-N 3.15Å; V65-Y67 PolarHBondContact O-N 3.42Å; V65-C68 PolarHBondContact O-N 3.38Å; V65-R69 PolarHBondContact O-N 2.99Å; V65-F110 HydrophobicContact CG2-CD2 3.49Å; V65-F110 VanDerWaalsContact CG2-CD2 3.49Å; V65-F110 HydrophobicContact CG2-CE2 3.4Å; V65-F110 VanDerWaalsContact CG2-CE2 3.4Å; V65-F110 HydrophobicContact CG2-CG 4.25Å; V65-F110 HydrophobicContact CG2-CZ 4.09Å
66	T	94.3	Very high	93.3	Very high	59 Å²	59	41 Å²	41	36%	0.362	21%	0.214	S	C	.	.	H	α-helix	trans	-59.4	-46.8	175.9	-58	0	0	0	0	111.3	K62 P63 C68 R69 D70	K62-T66 PolarHBondContact O-N 3.43Å; K62-T66 PolarHBondContact O-OG1 3.35Å; P63-T66 PolarHBondContact O-N 2.88Å; T66-C68 PolarHBondContact O-N 2.97Å; T66-R69 PolarHBondContact O-N 3.27Å; T66-R69 VanDerWaalsContact O-N 3.14Å; T66-D70 VanDerWaalsContact CG2-OD2 3.22Å; T66-D70 WeakPolarHBondContact CG2-OD2 3.25Å; T66-D70 WeakPolarHBondContact O-CB 3.22Å; T66-D70 PolarHBondContact O-N 3.42Å
67	Y	94.6	Very high	93.5	Very high	35 Å²	35	38.6 Å²	38.6	14%	0.137	20%	0.201	C	C	.	.	H	α-helix	trans	-59.5	-43.6	177.2	175.9	-99.5	0	0	0	112.4	A42 P63 C64 V65 R69 S71 V73 F76 L200 L238 F240	A42-Y67 HydrophobicContact CB-CE1 4.06Å; P63-Y67 VanDerWaalsContact O-CB 3.26Å; P63-Y67 WeakPolarHBondContact O-CB 3.2Å; P63-Y67 PolarHBondContact O-N 3.31Å; C64-Y67 PolarHBondContact O-N 2.95Å; V65-Y67 PolarHBondContact O-N 3.42Å; Y67-R69 VanDerWaalsContact C-N 3.28Å; Y67-R69 PolarHBondContact O-N 3.21Å; Y67-S71 WeakPolarHBondContact O-CB 3.5Å; Y67-S71 PolarHBondContact O-N 3.3Å; Y67-S71 PolarHBondContact O-OG 2.9Å; Y67-V73 HydrophobicContact CE1-CB 4.03Å; Y67-V73 HydrophobicContact CE1-CG1 3.95Å; Y67-V73 HydrophobicContact CE1-CG2 4.18Å; Y67-F76 AromaticContact CD1-CD2 3.9Å; Y67-F76 HydrophobicContact CD1-CD2 3.9Å; Y67-F76 AromaticContact CD1-CE2 3.87Å; Y67-F76 HydrophobicContact CD1-CE2 3.87Å; Y67-F76 AromaticContact CE1-CD2 3.95Å; Y67-F76 HydrophobicContact CE1-CD2 3.95Å; Y67-F76 HydrophobicContact CE1-CE2 4.21Å; Y67-L200 WeakPolarHBondContact OH-CD1 3.2Å; Y67-L238 HydrophobicContact CD1-CD2 4.41Å; Y67-L238 HydrophobicContact CD2-CD2 3.72Å; Y67-L238 HydrophobicContact CE1-CD2 4.16Å; Y67-L238 HydrophobicContact CE2-CD2 3.41Å; Y67-L238 VanDerWaalsContact CE2-CD2 3.41Å; Y67-L238 HydrophobicContact CG-CD2 4.21Å; Y67-F240 HydrophobicContact CD2-CE1 4.16Å; Y67-F240 HydrophobicContact CG-CE1 4.07Å; Y67-F240 HydrophobicContact CG-CZ 4.19Å
68	C	93.3	Very high	93.6	Very high	1 Å²	1	38 Å²	38	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-34.8	177	-69.2	0	0	0	0	112.4	C64 V65 T66 F76 K116 Q117	C64-C68 WeakPolarHBondContact O-CB 3.5Å; C64-C68 PolarHBondContact O-N 3.33Å; C64-C68 PolarHBondContact O-SG 3.46Å; V65-C68 PolarHBondContact O-N 3.38Å; T66-C68 PolarHBondContact O-N 2.97Å; C68-F76 VanDerWaalsContact SG-CD1 3.54Å; C68-F76 WeakPolarHBondContact SG-CD2 3.39Å; C68-F76 WeakPolarHBondContact SG-CG 3.27Å; C68-K116 VanDerWaalsContact O-CE 3.26Å; C68-K116 WeakPolarHBondContact O-CE 3.4Å; C68-K116 PolarHBondContact O-NZ 3.4Å; C68-Q117 HydrophobicContact CB-CG 3.95Å
69	R	91.6	Very high	93.7	Very high	177 Å²	177	38 Å²	38	67%	0.668	20%	0.199	S	C	*	.	H	α-helix	trans	-74.3	-48.2	179.3	-172.9	-176.5	-63.5	172.1	1.7	112	V65 T66 Y67	V65-R69 PolarHBondContact O-N 2.99Å; T66-R69 PolarHBondContact O-N 3.27Å; T66-R69 VanDerWaalsContact O-N 3.14Å; Y67-R69 VanDerWaalsContact C-N 3.28Å; Y67-R69 PolarHBondContact O-N 3.21Å
70	D	91.7	Very high	94.1	Very high	117 Å²	117	36.9 Å²	36.9	63%	0.626	19%	0.188	S	C	*	.	H	α-helix	trans	-98.1	-12.6	-163.2	-59.2	-12	0	0	0	113.4	T66	T66-D70 VanDerWaalsContact CG2-OD2 3.22Å; T66-D70 WeakPolarHBondContact CG2-OD2 3.25Å; T66-D70 WeakPolarHBondContact O-CB 3.22Å; T66-D70 PolarHBondContact O-N 3.42Å
71	S	90.4	Very high	94.3	Very high	25 Å²	25	35.2 Å²	35.2	18%	0.175	18%	0.178	C	C	.	.	S	Bend	trans	-99.8	155.4	179.7	77.2	0	0	0	0	114.1	Y67 V73 K116	Y67-S71 WeakPolarHBondContact O-CB 3.5Å; Y67-S71 PolarHBondContact O-N 3.3Å; Y67-S71 PolarHBondContact O-OG 2.9Å; S71-V73 PolarHBondContact O-N 3.48Å; S71-V73 VanDerWaalsContact O-N 3.14Å; S71-V73 VanDerWaalsContact OG-CG1 3.3Å; S71-V73 WeakPolarHBondContact OG-CG1 3.37Å; S71-V73 PolarHBondContact OG-N 2.95Å; S71-K116 PolarHBondContact O-NZ 2.74Å
72	D	88	Confident	94.3	Very high	139 Å²	139	35.6 Å²	35.6	74%	0.743	18%	0.181	S	C	*	.			trans	-76.5	16.9	173.4	-61.2	-40.2	0	0	0	113.7	S74	D72-S74 PolarHBondContact O-N 2.91Å
73	V	90.5	Very high	94.4	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.03	18%	0.182	C	C	.	.			trans	-58.4	128.4	178.2	69.7	0	0	0	0	110.2	A40 A42 Y67 S71 Q75 K116	A40-V73 VanDerWaalsContact O-CG2 3.23Å; A40-V73 WeakPolarHBondContact O-CG2 3.29Å; A42-V73 HydrophobicContact CB-CG2 3.83Å; Y67-V73 HydrophobicContact CE1-CB 4.03Å; Y67-V73 HydrophobicContact CE1-CG1 3.95Å; Y67-V73 HydrophobicContact CE1-CG2 4.18Å; S71-V73 PolarHBondContact O-N 3.48Å; S71-V73 VanDerWaalsContact O-N 3.14Å; S71-V73 VanDerWaalsContact OG-CG1 3.3Å; S71-V73 WeakPolarHBondContact OG-CG1 3.37Å; S71-V73 PolarHBondContact OG-N 2.95Å; V73-Q75 WeakPolarHBondContact CG2-O 3.44Å; V73-K116 WeakPolarHBondContact O-CE 3.41Å
74	S	91.9	Very high	94.4	Very high	38 Å²	38	34.8 Å²	34.8	27%	0.266	18%	0.176	S	C	.	.	S	Bend	trans	-73.7	-43.4	-174.7	-38.3	0	0	0	0	111.4	R38 N39 A40 D72	R38-S74 VanDerWaalsContact C-OG 3.26Å; R38-S74 PolarHBondContact O-OG 2.86Å; N39-S74 WeakPolarHBondContact CA-OG 3.29Å; N39-S74 PolarHBondContact N-OG 3.25Å; A40-S74 PolarHBondContact N-OG 2.88Å; A40-S74 PolarHBondContact O-N 2.86Å; D72-S74 PolarHBondContact O-N 2.91Å
75	Q	94	Very high	94.2	Very high	51 Å²	51	34.9 Å²	34.9	24%	0.238	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	137.9	175.3	-63.3	-171.7	-75.2	0	0	110.4	F41 A42 V73 F77 K116 I118	F41-Q75 WeakPolarHBondContact CA-O 3.47Å; F41-Q75 HydrophobicContact CD1-CB 3.77Å; F41-Q75 HydrophobicContact CD1-CG 4.22Å; F41-Q75 HydrophobicContact CE1-CB 4Å; F41-Q75 HydrophobicContact CE1-CG 3.91Å; A42-Q75 PolarHBondContact N-O 3.39Å; V73-Q75 WeakPolarHBondContact CG2-O 3.44Å; Q75-F77 HydrophobicContact CB-CE2 3.77Å; Q75-F77 HydrophobicContact CB-CZ 4.1Å; Q75-K116 CarbonylContact C-O 3.52Å; Q75-K116 WeakPolarHBondContact CA-O 3.46Å; Q75-I118 VanDerWaalsContact NE2-CD1 3.33Å
76	F	96.6	Very high	94	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.8	176.5	-175.5	-82	0	0	0	109.1	A42 T44 C64 Y67 C68 M78 F110 K116 Q117 I118 P202	A42-F76 HydrophobicContact CB-CD2 3.83Å; A42-F76 HydrophobicContact CB-CE2 4.36Å; A42-F76 CarbonylContact O-C 3.08Å; A42-F76 WeakPolarHBondContact O-CA 3.3Å; T44-F76 HydrophobicContact CG2-CE1 3.89Å; T44-F76 HydrophobicContact CG2-CZ 3.52Å; C64-F76 HydrophobicContact CB-CZ 3.88Å; Y67-F76 AromaticContact CD1-CD2 3.9Å; Y67-F76 HydrophobicContact CD1-CD2 3.9Å; Y67-F76 AromaticContact CD1-CE2 3.87Å; Y67-F76 HydrophobicContact CD1-CE2 3.87Å; Y67-F76 AromaticContact CE1-CD2 3.95Å; Y67-F76 HydrophobicContact CE1-CD2 3.95Å; Y67-F76 HydrophobicContact CE1-CE2 4.21Å; C68-F76 VanDerWaalsContact SG-CD1 3.54Å; C68-F76 WeakPolarHBondContact SG-CD2 3.39Å; C68-F76 WeakPolarHBondContact SG-CG 3.27Å; F76-M78 HydrophobicContact CD1-CB 4.46Å; F76-M78 HydrophobicContact CE1-CB 4.08Å; F76-M78 HydrophobicContact CE1-CE 4.04Å; F76-M78 HydrophobicContact CZ-CE 4.39Å; F76-F110 HydrophobicContact CD1-CE1 4.16Å; F76-F110 AromaticContact CE1-CE1 3.75Å; F76-F110 HydrophobicContact CE1-CE1 3.75Å; F76-F110 HydrophobicContact CE1-CZ 4.17Å; F76-K116 PolarHBondContact N-O 3.21Å; F76-Q117 CarbonylContact O-C 3.59Å; F76-Q117 WeakPolarHBondContact O-CA 3.27Å; F76-I118 PolarHBondContact O-N 3.44Å; F76-P202 HydrophobicContact CE2-CG 3.76Å; F76-P202 HydrophobicContact CZ-CG 4.34Å
77	F	97.7	Very high	93.7	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	117.5	179.8	-65.5	-85.3	0	0	0	109.4	F41 A42 V43 T44 Q75 I118 F120 Y196 L377	F41-F77 HydrophobicContact CB-CE2 4.42Å; F41-F77 HydrophobicContact CG-CE2 4.41Å; A42-F77 WeakPolarHBondContact O-CD2 3.3Å; A42-F77 PolarHBondContact O-N 3.03Å; V43-F77 WeakPolarHBondContact CA-O 3.24Å; V43-F77 HydrophobicContact CB-CB 4.03Å; V43-F77 HydrophobicContact CG2-CB 3.77Å; T44-F77 PolarHBondContact N-O 3.44Å; Q75-F77 HydrophobicContact CB-CE2 3.77Å; Q75-F77 HydrophobicContact CB-CZ 4.1Å; F77-I118 HydrophobicContact CD1-CB 3.95Å; F77-I118 HydrophobicContact CD1-CD1 4.18Å; F77-I118 HydrophobicContact CD1-CG2 4.12Å; F77-I118 HydrophobicContact CE1-CB 4.21Å; F77-I118 HydrophobicContact CE1-CD1 3.55Å; F77-I118 HydrophobicContact CE1-CG1 4.38Å; F77-I118 HydrophobicContact CE1-CG2 4.29Å; F77-I118 HydrophobicContact CZ-CD1 4Å; F77-F120 HydrophobicContact CB-CE1 4.03Å; F77-F120 AromaticContact CD1-CE1 3.89Å; F77-F120 HydrophobicContact CD1-CE1 3.89Å; F77-F120 HydrophobicContact CG-CE1 4.45Å; F77-Y196 HydrophobicContact CD1-CD1 4.32Å; F77-Y196 HydrophobicContact CD1-CG 4.42Å; F77-Y196 HydrophobicContact CD2-CG 4.48Å; F77-Y196 HydrophobicContact CE1-CD1 4.1Å; F77-Y196 HydrophobicContact CE1-CG 4.48Å; F77-Y196 HydrophobicContact CG-CG 4.43Å; F77-Y196 HydrophobicContact CZ-CD1 4.36Å; F77-L377 HydrophobicContact CE1-CD2 4.32Å; F77-L377 HydrophobicContact CE2-CD2 4.3Å; F77-L377 HydrophobicContact CZ-CD2 3.6Å
78	M	97.9	Very high	92.7	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	102.1	172.6	177.9	55.8	79.4	0	0	109.1	T44 I46 F76 L105 F110 I118 I119 F120	T44-M78 HydrophobicContact CG2-CE 3.54Å; T44-M78 HydrophobicContact CG2-SD 3.81Å; I46-M78 HydrophobicContact CD1-CE 4Å; I46-M78 HydrophobicContact CD1-SD 3.85Å; I46-M78 HydrophobicContact CG1-SD 4.05Å; F76-M78 HydrophobicContact CD1-CB 4.46Å; F76-M78 HydrophobicContact CE1-CB 4.08Å; F76-M78 HydrophobicContact CE1-CE 4.04Å; F76-M78 HydrophobicContact CZ-CE 4.39Å; M78-L105 HydrophobicContact CE-CD2 4.14Å; M78-L105 HydrophobicContact CG-CD1 3.74Å; M78-L105 HydrophobicContact SD-CD1 4.28Å; M78-F110 HydrophobicContact CB-CE1 4.48Å; M78-F110 HydrophobicContact CE-CE1 4.01Å; M78-F110 HydrophobicContact CE-CE2 3.98Å; M78-F110 HydrophobicContact CE-CZ 3.4Å; M78-F110 VanDerWaalsContact CE-CZ 3.4Å; M78-I118 PolarHBondContact N-O 2.97Å; M78-I119 HydrophobicContact CB-CB 4.5Å; M78-I119 HydrophobicContact CB-CG1 4.09Å; M78-I119 HydrophobicContact CG-CG1 4.43Å; M78-I119 HydrophobicContact CG-CG2 4.31Å; M78-I119 WeakPolarHBondContact O-CA 3.35Å; M78-F120 PolarHBondContact O-N 2.91Å; M78-F120 VanDerWaalsContact O-N 3.15Å
79	L	97.7	Very high	91.5	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	124.9	-178.7	-176.3	73.7	0	0	0	111	T44 G45 I46 A81 F120 Q122 D192	T44-L79 WeakPolarHBondContact O-CB 3.19Å; T44-L79 PolarHBondContact O-N 3.23Å; G45-L79 CarbonylContact C-O 3.49Å; G45-L79 VanDerWaalsContact CA-O 3.22Å; G45-L79 WeakPolarHBondContact CA-O 3.35Å; I46-L79 PolarHBondContact N-O 2.82Å; L79-A81 HydrophobicContact CD2-CB 4.5Å; L79-A81 PolarHBondContact O-N 3.37Å; L79-F120 HydrophobicContact CB-CZ 4.4Å; L79-F120 HydrophobicContact CD1-CD2 3.92Å; L79-F120 HydrophobicContact CD1-CE1 4.39Å; L79-F120 HydrophobicContact CD1-CE2 3.22Å; L79-F120 HydrophobicContact CD1-CZ 3.51Å; L79-Q122 HydrophobicContact CD1-CB 3.56Å; L79-Q122 HydrophobicContact CD1-CG 4.04Å; L79-Q122 HydrophobicContact CD2-CB 4.18Å; L79-Q122 HydrophobicContact CD2-CG 4.09Å; L79-Q122 HydrophobicContact CG-CB 3.95Å; L79-Q122 HydrophobicContact CG-CG 4.39Å; L79-D192 HydrophobicContact CD2-CB 3.83Å
80	I	97.8	Very high	90.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	101.6	163.9	-49.7	-55.7	0	0	0	107.4	P48 D82 I98 L101 V102 L105 I119 F120 L121 Q122 L367	P48-I80 HydrophobicContact CB-CG2 4.36Å; P48-I80 HydrophobicContact CG-CG2 4.14Å; I80-D82 VanDerWaalsContact C-N 3.26Å; I80-D82 PolarHBondContact O-N 2.99Å; I80-I98 HydrophobicContact CG2-CG1 4.21Å; I80-I98 HydrophobicContact CG2-CG2 4.39Å; I80-L101 HydrophobicContact CD1-CD2 3.91Å; I80-L101 HydrophobicContact CD1-CG 4.02Å; I80-L101 HydrophobicContact CG2-CD2 4.12Å; I80-V102 HydrophobicContact CD1-CG2 3.97Å; I80-V102 HydrophobicContact CG1-CG2 3.86Å; I80-L105 HydrophobicContact CD1-CD1 3.66Å; I80-I119 HydrophobicContact CD1-CG2 4.19Å; I80-I119 HydrophobicContact CG1-CG2 4.28Å; I80-F120 PolarHBondContact N-O 3.35Å; I80-L121 HydrophobicContact CB-CD1 3.89Å; I80-L121 HydrophobicContact CG2-CD1 3.74Å; I80-Q122 WeakPolarHBondContact O-CB 3.48Å; I80-Q122 PolarHBondContact O-N 2.61Å; I80-L367 HydrophobicContact CG1-CD2 4.35Å
81	A	96.6	Very high	88.9	Confident	5 Å²	5	38.3 Å²	38.3	4%	0.041	21%	0.213	C	C	.	.			trans	-81.6	63.8	-169.2	0	0	0	0	0	112.1	I46 Q47 L79 H84 S85	I46-A81 PolarHBondContact O-N 3.35Å; Q47-A81 HydrophobicContact CG-CB 4.15Å; L79-A81 HydrophobicContact CD2-CB 4.5Å; L79-A81 PolarHBondContact O-N 3.37Å; A81-H84 HydrophobicContact CB-CB 4.2Å; A81-S85 PolarHBondContact O-N 3.49Å; A81-S85 PolarHBondContact O-OG 2.99Å
82	D	96.2	Very high	88.1	Confident	10 Å²	10	45 Å²	45	5%	0.053	25%	0.247	C	C	.	.	H	α-helix	trans	-70.8	-37.8	-176.1	67.2	-31.3	0	0	0	113.3	P48 I80 H84 S85 L94 I98 L121 Q122 S123	P48-D82 HydrophobicContact CG-CB 4.21Å; I80-D82 VanDerWaalsContact C-N 3.26Å; I80-D82 PolarHBondContact O-N 2.99Å; D82-H84 VanDerWaalsContact C-N 3.33Å; D82-H84 PolarHBondContact O-N 2.94Å; D82-S85 VanDerWaalsContact O-CB 3.31Å; D82-S85 WeakPolarHBondContact O-CB 3.23Å; D82-S85 PolarHBondContact O-N 3.39Å; D82-L94 HydrophobicContact CB-CD1 4.29Å; D82-L94 HydrophobicContact CB-CD2 4.37Å; D82-I98 HydrophobicContact CB-CD1 4.04Å; D82-I98 HydrophobicContact CB-CG1 4.38Å; D82-L121 HydrophobicContact CB-CD1 3.65Å; D82-L121 HydrophobicContact CB-CG 4.46Å; D82-L121 WeakPolarHBondContact OD2-CD1 3.36Å; D82-L121 WeakPolarHBondContact OD2-CG 3.25Å; D82-Q122 WeakPolarHBondContact OD1-CB 3.48Å; D82-Q122 PolarHBondContact OD1-N 3.5Å; D82-S123 PolarHBondContact OD1-N 3.33Å; D82-S123 WeakPolarHBondContact OD2-CB 3.49Å; D82-S123 PolarHBondContact OD2-OG 3.15Å
83	L	96	Very high	88.2	Confident	44 Å²	44	42.8 Å²	42.8	23%	0.23	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-40.6	174.5	-59.1	178.3	0	0	0	111.7	S85 L86 Q122 T129 L188	L83-S85 PolarHBondContact O-N 3.18Å; L83-L86 HydrophobicContact CD2-CD1 4.22Å; L83-L86 VanDerWaalsContact O-CB 3.29Å; L83-L86 WeakPolarHBondContact O-CB 3.22Å; L83-L86 WeakPolarHBondContact O-CG 3.42Å; L83-L86 PolarHBondContact O-N 2.83Å; L83-L86 VanDerWaalsContact O-N 3.17Å; L83-Q122 HydrophobicContact CD1-CG 4.09Å; L83-Q122 HydrophobicContact CG-CG 4.31Å; L83-T129 HydrophobicContact CD1-CG2 3.74Å; L83-L188 HydrophobicContact CB-CD2 4.14Å
84	H	94.4	Very high	88.3	Confident	9 Å²	9	44.7 Å²	44.7	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-24.1	173.9	-74.1	-72.4	0	0	0	113.3	Q47 A81 D82 L86 T87 Q122 Y185 Q189 D192	Q47-H84 HydrophobicContact CG-CB 4.14Å; Q47-H84 PolarHBondContact NE2-O 3.07Å; A81-H84 HydrophobicContact CB-CB 4.2Å; D82-H84 VanDerWaalsContact C-N 3.33Å; D82-H84 PolarHBondContact O-N 2.94Å; H84-L86 PolarHBondContact O-N 2.91Å; H84-T87 PolarHBondContact O-OG1 3.48Å; H84-T87 VanDerWaalsContact O-OG1 3.06Å; H84-Q122 PolarHBondContact CD2-NE2 3.06Å; H84-Q122 PolarHBondContact CD2-OE1 3.39Å; H84-Q122 PolarHBondContact NE2-NE2 2.82Å; H84-Y185 AromaticContact CE1-CD2 3.96Å; H84-Y185 PolarHBondContact CE1-O 3.36Å; H84-Y185 AromaticContact ND1-CD2 3.68Å; H84-Q189 PolarHBondContact CE1-N 2.69Å; H84-D192 IonicContact CD2-OD2 2.76Å; H84-D192 PolarHBondContact CD2-OD2 2.86Å; H84-D192 IonicContact CE1-OD2 2.82Å; H84-D192 IonicContact NE2-OD2 3.41Å; H84-D192 PolarHBondContact NE2-OD2 2.95Å
85	S	92.4	Very high	88.3	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.014	27%	0.265	C	S	.	.	H	α-helix	trans	-72.4	-21.4	177.9	-57.9	0	0	0	0	112.1	Q47 P48 A81 D82 L83 T87 S88	Q47-S85 WeakPolarHBondContact CB-OG 3.3Å; P48-S85 VanDerWaalsContact CD-OG 3.24Å; P48-S85 WeakPolarHBondContact CD-OG 3.48Å; A81-S85 PolarHBondContact O-N 3.49Å; A81-S85 PolarHBondContact O-OG 2.99Å; D82-S85 VanDerWaalsContact O-CB 3.31Å; D82-S85 WeakPolarHBondContact O-CB 3.23Å; D82-S85 PolarHBondContact O-N 3.39Å; L83-S85 PolarHBondContact O-N 3.18Å; S85-T87 PolarHBondContact O-N 3.26Å; S85-S88 PolarHBondContact O-N 3.44Å; S85-S88 VanDerWaalsContact O-N 3.11Å; S85-S88 PolarHBondContact O-OG 2.96Å
86	L	91.8	Very high	88.3	Confident	121 Å²	121	52.2 Å²	52.2	63%	0.634	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.2	178	-56.8	178	0	0	0	113.3	L83 H84 S88 L94	L83-L86 HydrophobicContact CD2-CD1 4.22Å; L83-L86 VanDerWaalsContact O-CB 3.29Å; L83-L86 WeakPolarHBondContact O-CB 3.22Å; L83-L86 WeakPolarHBondContact O-CG 3.42Å; L83-L86 PolarHBondContact O-N 2.83Å; L83-L86 VanDerWaalsContact O-N 3.17Å; H84-L86 PolarHBondContact O-N 2.91Å; L86-S88 VanDerWaalsContact C-N 3.29Å; L86-L94 HydrophobicContact CD2-CD2 4.09Å
87	T	86.2	Confident	88.1	Confident	33 Å²	33	52.5 Å²	52.5	20%	0.202	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	2	177.2	65.8	0	0	0	0	112.9	H84 S85 G181	H84-T87 PolarHBondContact O-OG1 3.48Å; H84-T87 VanDerWaalsContact O-OG1 3.06Å; S85-T87 PolarHBondContact O-N 3.26Å; T87-G181 VanDerWaalsContact CG2-C 3.43Å
88	S	74.3	Confident	88	Confident	26 Å²	26	53.2 Å²	53.2	18%	0.182	28%	0.281	C	S	.	.	S	Bend	trans	-116.6	138.6	-178.8	74.3	0	0	0	0	111	S85 L86 N90	S85-S88 PolarHBondContact O-N 3.44Å; S85-S88 VanDerWaalsContact O-N 3.11Å; S85-S88 PolarHBondContact O-OG 2.96Å; L86-S88 VanDerWaalsContact C-N 3.29Å; S88-N90 PolarHBondContact O-N 3.39Å; S88-N90 VanDerWaalsContact O-N 3.12Å
89	N	67.9	Low	87.9	Confident	153 Å²	153	55.5 Å²	55.5	82%	0.818	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	8.6	-178.7	-65.8	-13.8	0	0	0	114
90	N	64.4	Low	87.8	Confident	106 Å²	106	56.3 Å²	56.3	57%	0.567	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-0.4	-163.9	-66.9	-16.7	0	0	0	114.4	S88	S88-N90 PolarHBondContact O-N 3.39Å; S88-N90 VanDerWaalsContact O-N 3.12Å
91	C	64.9	Low	87.7	Confident	32 Å²	32	56.6 Å²	56.6	22%	0.216	30%	0.296	C	S	.	.			trans	-121.9	88.1	-171.6	-162.9	0	0	0	0	112.2	P48 L94	P48-C91 PolarHBondContact O-SG 3.32Å; C91-L94 WeakPolarHBondContact SG-CA 3.39Å
92	N	74.5	Confident	87.8	Confident	166 Å²	166	56.4 Å²	56.4	89%	0.888	29%	0.294	S	S	*	.	S	Bend	trans	-71.8	-35	176.4	-68	-18.4	0	0	0	112.4
93	D	89.5	Confident	87.9	Confident	93 Å²	93	55.9 Å²	55.9	50%	0.497	29%	0.292	S	S	.	.			trans	-125.5	88.1	176.3	-172.6	-12.9	0	0	0	110.3	K95 H96 G97	D93-K95 VanDerWaalsContact C-N 3.28Å; D93-K95 PolarHBondContact O-N 3.46Å; D93-K95 PolarHBondContact OD1-N 2.91Å; D93-K95 VanDerWaalsContact OD1-N 3.14Å; D93-H96 HydrophobicContact CB-CB 4.04Å; D93-H96 PolarHBondContact O-N 3.03Å; D93-H96 PolarHBondContact OD1-N 3Å; D93-H96 VanDerWaalsContact OD2-CB 3.27Å; D93-H96 WeakPolarHBondContact OD2-CB 3.32Å; D93-G97 PolarHBondContact O-N 3.09Å
94	L	91.9	Very high	88	Confident	45 Å²	45	53.9 Å²	53.9	24%	0.236	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-33.9	179	-175.3	60.5	0	0	0	112.4	P48 D82 L86 C91 G97 I98	P48-L94 HydrophobicContact CB-CD1 4.27Å; P48-L94 HydrophobicContact CG-CD1 3.51Å; D82-L94 HydrophobicContact CB-CD1 4.29Å; D82-L94 HydrophobicContact CB-CD2 4.37Å; L86-L94 HydrophobicContact CD2-CD2 4.09Å; C91-L94 WeakPolarHBondContact SG-CA 3.39Å; L94-G97 PolarHBondContact O-N 3.2Å; L94-I98 HydrophobicContact CD1-CD1 4.3Å; L94-I98 HydrophobicContact CD1-CG1 4.32Å; L94-I98 HydrophobicContact CG-CD1 3.93Å; L94-I98 HydrophobicContact CG-CG1 4.43Å; L94-I98 WeakPolarHBondContact O-CB 3.4Å; L94-I98 WeakPolarHBondContact O-CD1 3.28Å; L94-I98 WeakPolarHBondContact O-CG1 3.33Å; L94-I98 PolarHBondContact O-N 3.21Å
95	K	92.9	Very high	88.1	Confident	155 Å²	155	53.4 Å²	53.4	67%	0.674	28%	0.279	S	S	*	.	H	α-helix	trans	-65	-47.8	179.1	-178.8	-178.4	176.4	-176.5	0	110.3	D93 I98 H99	D93-K95 VanDerWaalsContact C-N 3.28Å; D93-K95 PolarHBondContact O-N 3.46Å; D93-K95 PolarHBondContact OD1-N 2.91Å; D93-K95 VanDerWaalsContact OD1-N 3.14Å; K95-I98 PolarHBondContact O-N 3.37Å; K95-H99 PolarHBondContact O-N 2.84Å; K95-H99 PolarHBondContact O-ND1 3.01Å
96	H	92.9	Very high	88.4	Confident	91 Å²	91	54 Å²	54	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-44.7	175.5	-177	80	0	0	0	111.4	D93 I98 H99 E100	D93-H96 HydrophobicContact CB-CB 4.04Å; D93-H96 PolarHBondContact O-N 3.03Å; D93-H96 PolarHBondContact OD1-N 3Å; D93-H96 VanDerWaalsContact OD2-CB 3.27Å; D93-H96 WeakPolarHBondContact OD2-CB 3.32Å; H96-I98 VanDerWaalsContact C-N 3.31Å; H96-I98 PolarHBondContact O-N 3.23Å; H96-H99 PolarHBondContact O-N 2.81Å; H96-H99 VanDerWaalsContact O-N 3.14Å; H96-E100 WeakPolarHBondContact O-CB 3.31Å; H96-E100 PolarHBondContact O-N 2.87Å
97	G	93.3	Very high	88.7	Confident	7 Å²	7	48.8 Å²	48.8	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-38.2	177.8	0	0	0	0	0	113.6	D93 L94 L101	D93-G97 PolarHBondContact O-N 3.09Å; L94-G97 PolarHBondContact O-N 3.2Å; G97-L101 VanDerWaalsContact O-CB 3.27Å; G97-L101 WeakPolarHBondContact O-CB 3.17Å; G97-L101 PolarHBondContact O-N 2.89Å
98	I	95.6	Very high	89.3	Confident	16 Å²	16	48 Å²	48	8%	0.082	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-49.7	173.6	-71.3	161	0	0	0	110.5	P48 I80 D82 L94 K95 H96 L101 V102 L121 L367	P48-I98 HydrophobicContact CB-CG1 3.99Å; P48-I98 HydrophobicContact CG-CG1 3.87Å; I80-I98 HydrophobicContact CG2-CG1 4.21Å; I80-I98 HydrophobicContact CG2-CG2 4.39Å; D82-I98 HydrophobicContact CB-CD1 4.04Å; D82-I98 HydrophobicContact CB-CG1 4.38Å; L94-I98 HydrophobicContact CD1-CD1 4.3Å; L94-I98 HydrophobicContact CD1-CG1 4.32Å; L94-I98 HydrophobicContact CG-CD1 3.93Å; L94-I98 HydrophobicContact CG-CG1 4.43Å; L94-I98 WeakPolarHBondContact O-CB 3.4Å; L94-I98 WeakPolarHBondContact O-CD1 3.28Å; L94-I98 WeakPolarHBondContact O-CG1 3.33Å; L94-I98 PolarHBondContact O-N 3.21Å; K95-I98 PolarHBondContact O-N 3.37Å; H96-I98 VanDerWaalsContact C-N 3.31Å; H96-I98 PolarHBondContact O-N 3.23Å; I98-L101 PolarHBondContact O-N 2.75Å; I98-V102 WeakPolarHBondContact O-CG2 3.39Å; I98-V102 PolarHBondContact O-N 2.9Å; I98-L121 HydrophobicContact CD1-CD1 3.73Å; I98-L121 HydrophobicContact CD1-CD2 4.3Å; I98-L121 HydrophobicContact CG1-CD1 3.93Å; I98-L121 HydrophobicContact CG2-CD1 4.06Å; I98-L367 HydrophobicContact CG2-CD1 4.06Å
99	H	95.4	Very high	90.3	Very high	48 Å²	48	48.3 Å²	48.3	22%	0.222	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-45.4	-179.6	-75.2	75.8	0	0	0	111.5	K95 H96 L101 V102 A103 M354	K95-H99 PolarHBondContact O-N 2.84Å; K95-H99 PolarHBondContact O-ND1 3.01Å; H96-H99 PolarHBondContact O-N 2.81Å; H96-H99 VanDerWaalsContact O-N 3.14Å; H99-L101 PolarHBondContact O-N 3.39Å; H99-V102 PolarHBondContact O-N 3.22Å; H99-A103 VanDerWaalsContact O-CB 3.22Å; H99-A103 WeakPolarHBondContact O-CB 3.3Å; H99-A103 PolarHBondContact O-N 3.09Å; H99-M354 HydrophobicContact CB-CE 4.32Å; H99-M354 HydrophobicContact CB-SD 4.35Å
100	E	95.5	Very high	91.7	Very high	20 Å²	20	41.4 Å²	41.4	9%	0.093	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-42.2	178.8	-172.5	-178.7	-131.1	0	0	111.6	H96 T104 M354	H96-E100 WeakPolarHBondContact O-CB 3.31Å; H96-E100 PolarHBondContact O-N 2.87Å; E100-T104 WeakPolarHBondContact O-CB 3.21Å; E100-T104 PolarHBondContact O-N 3.06Å; E100-T104 PolarHBondContact O-OG1 3.44Å; E100-M354 HydrophobicContact CB-CE 4.09Å
101	L	96.3	Very high	93.2	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-46.7	178.4	177.6	57.1	0	0	0	111.9	I46 P48 I80 G97 I98 H99 A103 T104 L105	I46-L101 HydrophobicContact CB-CD1 4.47Å; I46-L101 HydrophobicContact CB-CD2 4.03Å; I46-L101 HydrophobicContact CG2-CD1 3.83Å; I46-L101 HydrophobicContact CG2-CD2 3.72Å; I46-L101 HydrophobicContact CG2-CG 4.44Å; P48-L101 HydrophobicContact CB-CD2 4.17Å; I80-L101 HydrophobicContact CD1-CD2 3.91Å; I80-L101 HydrophobicContact CD1-CG 4.02Å; I80-L101 HydrophobicContact CG2-CD2 4.12Å; G97-L101 VanDerWaalsContact O-CB 3.27Å; G97-L101 WeakPolarHBondContact O-CB 3.17Å; G97-L101 PolarHBondContact O-N 2.89Å; I98-L101 PolarHBondContact O-N 2.75Å; H99-L101 PolarHBondContact O-N 3.39Å; L101-A103 VanDerWaalsContact C-N 3.35Å; L101-A103 PolarHBondContact O-N 2.72Å; L101-T104 WeakPolarHBondContact O-CB 3.37Å; L101-T104 PolarHBondContact O-N 3.24Å; L101-L105 HydrophobicContact CD1-CD1 4.38Å; L101-L105 HydrophobicContact CD1-CG 4.28Å; L101-L105 HydrophobicContact CG-CD1 4.32Å; L101-L105 WeakPolarHBondContact O-CG 3.5Å; L101-L105 PolarHBondContact O-N 2.69Å
102	V	97.8	Very high	94.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-44.6	177.7	176.5	0	0	0	0	110.5	I80 I98 H99 T104 L105 L106 I363 L367	I80-V102 HydrophobicContact CD1-CG2 3.97Å; I80-V102 HydrophobicContact CG1-CG2 3.86Å; I98-V102 WeakPolarHBondContact O-CG2 3.39Å; I98-V102 PolarHBondContact O-N 2.9Å; H99-V102 PolarHBondContact O-N 3.22Å; V102-T104 VanDerWaalsContact C-N 3.27Å; V102-T104 PolarHBondContact O-N 3.09Å; V102-L105 PolarHBondContact O-N 3Å; V102-L106 HydrophobicContact CG1-CD1 4.12Å; V102-L106 HydrophobicContact CG1-CG 4.38Å; V102-L106 WeakPolarHBondContact O-CG 3.33Å; V102-L106 PolarHBondContact O-N 2.94Å; V102-I363 HydrophobicContact CB-CG2 3.98Å; V102-I363 HydrophobicContact CG1-CB 4.45Å; V102-I363 HydrophobicContact CG1-CG2 3.81Å; V102-L367 HydrophobicContact CG2-CD1 4.25Å; V102-L367 HydrophobicContact CG2-CD2 3.8Å; V102-L367 HydrophobicContact CG2-CG 4.12Å
103	A	97.7	Very high	95.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.4	-41.3	175.4	0	0	0	0	0	111.7	H99 L101 L106 A107 L350 L353 M354 I363	H99-A103 VanDerWaalsContact O-CB 3.22Å; H99-A103 WeakPolarHBondContact O-CB 3.3Å; H99-A103 PolarHBondContact O-N 3.09Å; L101-A103 VanDerWaalsContact C-N 3.35Å; L101-A103 PolarHBondContact O-N 2.72Å; A103-L106 PolarHBondContact O-N 2.75Å; A103-A107 WeakPolarHBondContact O-CB 3.27Å; A103-A107 PolarHBondContact O-N 3.38Å; A103-L350 HydrophobicContact CB-CD1 3.5Å; A103-L353 HydrophobicContact CB-CB 3.9Å; A103-L353 HydrophobicContact CB-CD1 4.32Å; A103-L353 VanDerWaalsContact O-CD1 3.31Å; A103-L353 WeakPolarHBondContact O-CD1 3.37Å; A103-M354 HydrophobicContact CB-CG 3.88Å; A103-M354 HydrophobicContact CB-SD 3.54Å; A103-M354 VanDerWaalsContact CB-SD 3.54Å; A103-I363 HydrophobicContact CB-CD1 3.74Å; A103-I363 HydrophobicContact CB-CG1 4.34Å
104	T	97.7	Very high	95.3	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-45.6	176.9	-60.8	0	0	0	0	111.7	P52 I61 E100 L101 V102 L106 A107 C108 L268	P52-T104 HydrophobicContact CB-CG2 4Å; P52-T104 HydrophobicContact CG-CG2 3.93Å; I61-T104 HydrophobicContact CD1-CG2 4.4Å; E100-T104 WeakPolarHBondContact O-CB 3.21Å; E100-T104 PolarHBondContact O-N 3.06Å; E100-T104 PolarHBondContact O-OG1 3.44Å; L101-T104 WeakPolarHBondContact O-CB 3.37Å; L101-T104 PolarHBondContact O-N 3.24Å; V102-T104 VanDerWaalsContact C-N 3.27Å; V102-T104 PolarHBondContact O-N 3.09Å; T104-L106 PolarHBondContact O-N 3.04Å; T104-A107 PolarHBondContact O-N 2.87Å; T104-C108 WeakPolarHBondContact O-CB 3.5Å; T104-C108 PolarHBondContact O-N 2.96Å; T104-C108 PolarHBondContact O-SG 3.33Å; T104-L268 HydrophobicContact CG2-CD2 3.67Å
105	L	98	Very high	95.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-47.4	178.1	-69.5	169.6	0	0	0	111.1	I46 I61 M78 I80 L101 V102 A107 C108 G109 F110 I119	I46-L105 HydrophobicContact CD1-CD2 4.04Å; I61-L105 HydrophobicContact CD1-CD2 4.48Å; I61-L105 HydrophobicContact CG1-CD2 4.23Å; I61-L105 HydrophobicContact CG2-CD2 4.06Å; M78-L105 HydrophobicContact CE-CD2 4.14Å; M78-L105 HydrophobicContact CG-CD1 3.74Å; M78-L105 HydrophobicContact SD-CD1 4.28Å; I80-L105 HydrophobicContact CD1-CD1 3.66Å; L101-L105 HydrophobicContact CD1-CD1 4.38Å; L101-L105 HydrophobicContact CD1-CG 4.28Å; L101-L105 HydrophobicContact CG-CD1 4.32Å; L101-L105 WeakPolarHBondContact O-CG 3.5Å; L101-L105 PolarHBondContact O-N 2.69Å; V102-L105 PolarHBondContact O-N 3Å; L105-A107 VanDerWaalsContact C-N 3.35Å; L105-A107 PolarHBondContact O-N 3.47Å; L105-C108 PolarHBondContact O-N 3.33Å; L105-G109 PolarHBondContact O-N 2.93Å; L105-F110 HydrophobicContact CB-CB 4.37Å; L105-F110 HydrophobicContact CB-CD2 3.92Å; L105-F110 HydrophobicContact CB-CG 4.35Å; L105-F110 HydrophobicContact CD2-CD2 3.87Å; L105-F110 HydrophobicContact CD2-CE2 3.74Å; L105-F110 HydrophobicContact CG-CD2 4.5Å; L105-F110 WeakPolarHBondContact O-CB 3.35Å; L105-F110 WeakPolarHBondContact O-CD2 3.37Å; L105-F110 PolarHBondContact O-N 3.14Å; L105-I119 HydrophobicContact CD1-CG2 4.41Å
106	L	98.2	Very high	95.2	Very high	13 Å²	13	33.8 Å²	33.8	7%	0.068	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-41.5	176.6	-64.8	179.1	0	0	0	111.9	V102 A103 T104 C108 G109 F110 A112 I119 L353 T362 I363 C366	V102-L106 HydrophobicContact CG1-CD1 4.12Å; V102-L106 HydrophobicContact CG1-CG 4.38Å; V102-L106 WeakPolarHBondContact O-CG 3.33Å; V102-L106 PolarHBondContact O-N 2.94Å; A103-L106 PolarHBondContact O-N 2.75Å; T104-L106 PolarHBondContact O-N 3.04Å; L106-C108 VanDerWaalsContact C-N 3.28Å; L106-C108 PolarHBondContact O-N 3.16Å; L106-G109 PolarHBondContact O-N 2.96Å; L106-G109 VanDerWaalsContact O-N 3.16Å; L106-F110 WeakPolarHBondContact CD2-O 3.45Å; L106-A112 HydrophobicContact CD1-CB 4.29Å; L106-A112 HydrophobicContact CD2-CB 3.79Å; L106-I119 HydrophobicContact CD2-CD1 3.94Å; L106-L353 HydrophobicContact CB-CD1 3.75Å; L106-L353 HydrophobicContact CD1-CD2 4.33Å; L106-T362 HydrophobicContact CD1-CG2 4.27Å; L106-I363 HydrophobicContact CD1-CG1 4.48Å; L106-C366 HydrophobicContact CD1-CB 4.46Å
107	A	98.1	Very high	95.3	Very high	12 Å²	12	30.2 Å²	30.2	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-30.5	176.2	0	0	0	0	0	113.2	A103 T104 L105 G109 I346 R349 L350 L353	A103-A107 WeakPolarHBondContact O-CB 3.27Å; A103-A107 PolarHBondContact O-N 3.38Å; T104-A107 PolarHBondContact O-N 2.87Å; L105-A107 VanDerWaalsContact C-N 3.35Å; L105-A107 PolarHBondContact O-N 3.47Å; A107-G109 VanDerWaalsContact C-N 3.28Å; A107-G109 PolarHBondContact O-N 2.93Å; A107-I346 HydrophobicContact CB-CG2 3.99Å; A107-I346 WeakPolarHBondContact CB-O 3.39Å; A107-R349 HydrophobicContact CB-CB 3.94Å; A107-R349 HydrophobicContact CB-CG 3.94Å; A107-L350 HydrophobicContact CB-CB 4.05Å; A107-L353 HydrophobicContact CB-CD1 4.35Å
108	C	97.7	Very high	95.5	Very high	16 Å²	16	30 Å²	30	11%	0.108	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-5.6	175.8	-65.9	0	0	0	0	113.6	Y57 I61 T104 L105 L106	Y57-C108 HydrophobicContact CE2-CB 4.13Å; I61-C108 HydrophobicContact CG2-CB 3.56Å; T104-C108 WeakPolarHBondContact O-CB 3.5Å; T104-C108 PolarHBondContact O-N 2.96Å; T104-C108 PolarHBondContact O-SG 3.33Å; L105-C108 PolarHBondContact O-N 3.33Å; L106-C108 VanDerWaalsContact C-N 3.28Å; L106-C108 PolarHBondContact O-N 3.16Å
109	G	96.7	Very high	95.7	Very high	34 Å²	34	29.3 Å²	29.3	35%	0.351	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	112.6	9.6	173.9	0	0	0	0	0	116	L105 L106 A107	L105-G109 PolarHBondContact O-N 2.93Å; L106-G109 PolarHBondContact O-N 2.96Å; L106-G109 VanDerWaalsContact O-N 3.16Å; A107-G109 VanDerWaalsContact C-N 3.28Å; A107-G109 PolarHBondContact O-N 2.93Å
110	F	97.3	Very high	95.8	Very high	8 Å²	8	27 Å²	27	4%	0.035	15%	0.15	C	C	.	.			trans	-69.6	147.4	164.9	-78.8	-89.5	0	0	0	111	I61 C64 V65 F76 M78 L105 L106 I119	I61-F110 HydrophobicContact CG2-CE2 4.2Å; C64-F110 HydrophobicContact CB-CE2 4.45Å; C64-F110 HydrophobicContact CB-CZ 3.75Å; V65-F110 HydrophobicContact CG2-CD2 3.49Å; V65-F110 VanDerWaalsContact CG2-CD2 3.49Å; V65-F110 HydrophobicContact CG2-CE2 3.4Å; V65-F110 VanDerWaalsContact CG2-CE2 3.4Å; V65-F110 HydrophobicContact CG2-CG 4.25Å; V65-F110 HydrophobicContact CG2-CZ 4.09Å; F76-F110 HydrophobicContact CD1-CE1 4.16Å; F76-F110 AromaticContact CE1-CE1 3.75Å; F76-F110 HydrophobicContact CE1-CE1 3.75Å; F76-F110 HydrophobicContact CE1-CZ 4.17Å; M78-F110 HydrophobicContact CB-CE1 4.48Å; M78-F110 HydrophobicContact CE-CE1 4.01Å; M78-F110 HydrophobicContact CE-CE2 3.98Å; M78-F110 HydrophobicContact CE-CZ 3.4Å; M78-F110 VanDerWaalsContact CE-CZ 3.4Å; L105-F110 HydrophobicContact CB-CB 4.37Å; L105-F110 HydrophobicContact CB-CD2 3.92Å; L105-F110 HydrophobicContact CB-CG 4.35Å; L105-F110 HydrophobicContact CD2-CD2 3.87Å; L105-F110 HydrophobicContact CD2-CE2 3.74Å; L105-F110 HydrophobicContact CG-CD2 4.5Å; L105-F110 WeakPolarHBondContact O-CB 3.35Å; L105-F110 WeakPolarHBondContact O-CD2 3.37Å; L105-F110 PolarHBondContact O-N 3.14Å; L106-F110 WeakPolarHBondContact CD2-O 3.45Å; F110-I119 HydrophobicContact CB-CD1 3.69Å; F110-I119 HydrophobicContact CD1-CD1 4.35Å; F110-I119 HydrophobicContact CG-CD1 4.24Å
111	E	94.8	Very high	95.9	Very high	111 Å²	111	27.5 Å²	27.5	52%	0.519	15%	0.153	S	C	.	.			trans	-98	125.6	-176.1	-68.7	175.5	-178.2	0	0	111.9	N113 S114	E111-N113 PolarHBondContact O-N 2.86Å; E111-S114 WeakPolarHBondContact OE2-CB 3.43Å
112	A	91.9	Very high	96	Very high	20 Å²	20	27.1 Å²	27.1	17%	0.165	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-38.5	-171.5	0	0	0	0	0	115.1	L106 T362 C366	L106-A112 HydrophobicContact CD1-CB 4.29Å; L106-A112 HydrophobicContact CD2-CB 3.79Å; A112-T362 HydrophobicContact CB-CG2 4.08Å; A112-C366 HydrophobicContact CB-CB 3.88Å; A112-C366 WeakPolarHBondContact O-CA 3.37Å; A112-C366 PolarHBondContact O-SG 2.99Å
113	N	90.5	Very high	96	Very high	103 Å²	103	29.8 Å²	29.8	55%	0.551	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.6	32.6	-172.7	-62	-47.4	0	0	0	111.7	E111	E111-N113 PolarHBondContact O-N 2.86Å
114	S	91.6	Very high	96	Very high	10 Å²	10	31.4 Å²	31.4	7%	0.07	18%	0.181	C	C	.	.			trans	-82.8	142.5	-175.8	128.9	0	0	0	0	111	E111 K116 Q117	E111-S114 WeakPolarHBondContact OE2-CB 3.43Å; S114-K116 VanDerWaalsContact C-N 3.32Å; S114-K116 PolarHBondContact OG-N 3.41Å; S114-K116 VanDerWaalsContact OG-N 3.09Å; S114-Q117 VanDerWaalsContact O-O 3.05Å; S114-Q117 WeakPolarHBondContact OG-CA 3.45Å; S114-Q117 WeakPolarHBondContact OG-CB 3.09Å; S114-Q117 PolarHBondContact OG-N 3.03Å; S114-Q117 PolarHBondContact OG-O 3.14Å; S114-Q117 VanDerWaalsContact OG-O 3.09Å
115	L	89.8	Confident	96.1	Very high	127 Å²	127	31.4 Å²	31.4	67%	0.665	18%	0.181	S	C	*	.	S	Bend	trans	-78.3	-18	172.1	-60.2	-179.7	0	0	0	113.1	Q373	L115-Q373 VanDerWaalsContact CD2-NE2 3.26Å
116	K	92.9	Very high	96.1	Very high	66 Å²	66	34.7 Å²	34.7	29%	0.287	20%	0.202	S	C	.	.	S	Bend	trans	-89.3	-57.8	-178.5	-177.1	-179.4	-173.6	-179.2	0	110.8	C68 S71 V73 Q75 F76 S114	C68-K116 VanDerWaalsContact O-CE 3.26Å; C68-K116 WeakPolarHBondContact O-CE 3.4Å; C68-K116 PolarHBondContact O-NZ 3.4Å; S71-K116 PolarHBondContact O-NZ 2.74Å; V73-K116 WeakPolarHBondContact O-CE 3.41Å; Q75-K116 CarbonylContact C-O 3.52Å; Q75-K116 WeakPolarHBondContact CA-O 3.46Å; F76-K116 PolarHBondContact N-O 3.21Å; S114-K116 VanDerWaalsContact C-N 3.32Å; S114-K116 PolarHBondContact OG-N 3.41Å; S114-K116 VanDerWaalsContact OG-N 3.09Å
117	Q	95.7	Very high	96.1	Very high	15 Å²	15	34.2 Å²	34.2	7%	0.07	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	113.1	174.8	-51.9	173.2	51.6	0	0	110.1	C68 F76 S114	C68-Q117 HydrophobicContact CB-CG 3.95Å; F76-Q117 CarbonylContact O-C 3.59Å; F76-Q117 WeakPolarHBondContact O-CA 3.27Å; S114-Q117 VanDerWaalsContact O-O 3.05Å; S114-Q117 WeakPolarHBondContact OG-CA 3.45Å; S114-Q117 WeakPolarHBondContact OG-CB 3.09Å; S114-Q117 PolarHBondContact OG-N 3.03Å; S114-Q117 PolarHBondContact OG-O 3.14Å; S114-Q117 VanDerWaalsContact OG-O 3.09Å
118	I	97.2	Very high	96.1	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	107.1	-176.8	-57.4	-178.6	0	0	0	107.7	Q75 F76 F77 M78 F120 Q373	Q75-I118 VanDerWaalsContact NE2-CD1 3.33Å; F76-I118 PolarHBondContact O-N 3.44Å; F77-I118 HydrophobicContact CD1-CB 3.95Å; F77-I118 HydrophobicContact CD1-CD1 4.18Å; F77-I118 HydrophobicContact CD1-CG2 4.12Å; F77-I118 HydrophobicContact CE1-CB 4.21Å; F77-I118 HydrophobicContact CE1-CD1 3.55Å; F77-I118 HydrophobicContact CE1-CG1 4.38Å; F77-I118 HydrophobicContact CE1-CG2 4.29Å; F77-I118 HydrophobicContact CZ-CD1 4Å; M78-I118 PolarHBondContact N-O 2.97Å; I118-F120 HydrophobicContact CG2-CD1 3.99Å; I118-Q373 HydrophobicContact CD1-CB 4.1Å; I118-Q373 HydrophobicContact CG2-CB 4.19Å
119	I	98.4	Very high	96.2	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.8	177.7	-49.9	172.4	0	0	0	108.8	M78 I80 L105 L106 F110 G370	M78-I119 HydrophobicContact CB-CB 4.5Å; M78-I119 HydrophobicContact CB-CG1 4.09Å; M78-I119 HydrophobicContact CG-CG1 4.43Å; M78-I119 HydrophobicContact CG-CG2 4.31Å; M78-I119 WeakPolarHBondContact O-CA 3.35Å; I80-I119 HydrophobicContact CD1-CG2 4.19Å; I80-I119 HydrophobicContact CG1-CG2 4.28Å; L105-I119 HydrophobicContact CD1-CG2 4.41Å; L106-I119 HydrophobicContact CD2-CD1 3.94Å; F110-I119 HydrophobicContact CB-CD1 3.69Å; F110-I119 HydrophobicContact CD1-CD1 4.35Å; F110-I119 HydrophobicContact CG-CD1 4.24Å; I119-G370 WeakPolarHBondContact O-CA 3.25Å
120	F	98.2	Very high	96.3	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	160.7	-176.6	65.9	-78.3	0	0	0	112.3	F77 M78 L79 I80 I118 V125 H128 Y196 G370 A374	F77-F120 HydrophobicContact CB-CE1 4.03Å; F77-F120 AromaticContact CD1-CE1 3.89Å; F77-F120 HydrophobicContact CD1-CE1 3.89Å; F77-F120 HydrophobicContact CG-CE1 4.45Å; M78-F120 PolarHBondContact O-N 2.91Å; M78-F120 VanDerWaalsContact O-N 3.15Å; L79-F120 HydrophobicContact CB-CZ 4.4Å; L79-F120 HydrophobicContact CD1-CD2 3.92Å; L79-F120 HydrophobicContact CD1-CE1 4.39Å; L79-F120 HydrophobicContact CD1-CE2 3.22Å; L79-F120 HydrophobicContact CD1-CZ 3.51Å; I80-F120 PolarHBondContact N-O 3.35Å; I118-F120 HydrophobicContact CG2-CD1 3.99Å; F120-V125 HydrophobicContact CD2-CG2 3.76Å; F120-V125 HydrophobicContact CE2-CG2 3.96Å; F120-H128 AromaticContact CE2-NE2 3.52Å; F120-Y196 HydrophobicContact CE2-CE2 4.36Å; F120-Y196 AromaticContact CE2-CZ 3.89Å; F120-Y196 WeakPolarHBondContact CE2-OH 3.46Å; F120-Y196 HydrophobicContact CZ-CE1 4.4Å; F120-Y196 AromaticContact CZ-CE2 3.7Å; F120-Y196 HydrophobicContact CZ-CE2 3.7Å; F120-Y196 AromaticContact CZ-CZ 3.51Å; F120-Y196 WeakPolarHBondContact CZ-OH 3.49Å; F120-G370 VanDerWaalsContact CB-C 3.49Å; F120-A374 HydrophobicContact CB-CB 4.47Å; F120-A374 HydrophobicContact CD1-CB 3.97Å; F120-A374 HydrophobicContact CD2-CB 3.7Å; F120-A374 HydrophobicContact CE1-CB 4.1Å; F120-A374 HydrophobicContact CE2-CB 3.83Å; F120-A374 HydrophobicContact CG-CB 3.77Å; F120-A374 HydrophobicContact CZ-CB 4.03Å
121	L	97.8	Very high	96.3	Very high	29 Å²	29	37.7 Å²	37.7	15%	0.152	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.2	179	-169.8	66	0	0	0	110.8	I80 D82 I98 S123 S124 L367	I80-L121 HydrophobicContact CB-CD1 3.89Å; I80-L121 HydrophobicContact CG2-CD1 3.74Å; D82-L121 HydrophobicContact CB-CD1 3.65Å; D82-L121 HydrophobicContact CB-CG 4.46Å; D82-L121 WeakPolarHBondContact OD2-CD1 3.36Å; D82-L121 WeakPolarHBondContact OD2-CG 3.25Å; I98-L121 HydrophobicContact CD1-CD1 3.73Å; I98-L121 HydrophobicContact CD1-CD2 4.3Å; I98-L121 HydrophobicContact CG1-CD1 3.93Å; I98-L121 HydrophobicContact CG2-CD1 4.06Å; L121-S123 VanDerWaalsContact CD2-OG 3.3Å; L121-S123 WeakPolarHBondContact CD2-OG 3.42Å; L121-S123 WeakPolarHBondContact CG-OG 3.49Å; L121-S123 PolarHBondContact O-N 2.92Å; L121-S124 WeakPolarHBondContact O-CB 3.22Å; L121-S124 PolarHBondContact O-N 2.89Å; L121-S124 PolarHBondContact O-OG 2.85Å; L121-L367 HydrophobicContact CB-CD2 4.3Å
122	Q	98.4	Very high	96.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-58.3	-48	-178.8	-175.7	-172	19.6	0	0	111.9	L79 I80 D82 L83 H84 S124 V125 H128 D192	L79-Q122 HydrophobicContact CD1-CB 3.56Å; L79-Q122 HydrophobicContact CD1-CG 4.04Å; L79-Q122 HydrophobicContact CD2-CB 4.18Å; L79-Q122 HydrophobicContact CD2-CG 4.09Å; L79-Q122 HydrophobicContact CG-CB 3.95Å; L79-Q122 HydrophobicContact CG-CG 4.39Å; I80-Q122 WeakPolarHBondContact O-CB 3.48Å; I80-Q122 PolarHBondContact O-N 2.61Å; D82-Q122 WeakPolarHBondContact OD1-CB 3.48Å; D82-Q122 PolarHBondContact OD1-N 3.5Å; L83-Q122 HydrophobicContact CD1-CG 4.09Å; L83-Q122 HydrophobicContact CG-CG 4.31Å; H84-Q122 PolarHBondContact CD2-NE2 3.06Å; H84-Q122 PolarHBondContact CD2-OE1 3.39Å; H84-Q122 PolarHBondContact NE2-NE2 2.82Å; Q122-S124 PolarHBondContact O-N 3.5Å; Q122-S124 VanDerWaalsContact O-N 3.12Å; Q122-V125 PolarHBondContact O-N 3.31Å; Q122-V125 VanDerWaalsContact O-N 3.1Å; Q122-H128 HydrophobicContact CG-CB 4.31Å; Q122-H128 PolarHBondContact O-CD2 2.92Å; Q122-D192 VanDerWaalsContact NE2-CG 3.32Å; Q122-D192 PolarHBondContact NE2-OD1 3.04Å; Q122-D192 PolarHBondContact NE2-OD2 3.28Å; Q122-D192 VanDerWaalsContact NE2-OD2 3.07Å
123	S	97.9	Very high	96.8	Very high	55 Å²	55	41.7 Å²	41.7	39%	0.385	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-61.8	-18.3	177.1	65.3	0	0	0	0	114.4	D82 L121 V125	D82-S123 PolarHBondContact OD1-N 3.33Å; D82-S123 WeakPolarHBondContact OD2-CB 3.49Å; D82-S123 PolarHBondContact OD2-OG 3.15Å; L121-S123 VanDerWaalsContact CD2-OG 3.3Å; L121-S123 WeakPolarHBondContact CD2-OG 3.42Å; L121-S123 WeakPolarHBondContact CG-OG 3.49Å; L121-S123 PolarHBondContact O-N 2.92Å; S123-V125 VanDerWaalsContact C-N 3.25Å; S123-V125 PolarHBondContact O-N 3.49Å
124	S	98.2	Very high	97.2	Very high	34 Å²	34	37.1 Å²	37.1	24%	0.238	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-78.7	-7.4	177.3	80	0	0	0	0	113.8	L121 Q122 S371 N375	L121-S124 WeakPolarHBondContact O-CB 3.22Å; L121-S124 PolarHBondContact O-N 2.89Å; L121-S124 PolarHBondContact O-OG 2.85Å; Q122-S124 PolarHBondContact O-N 3.5Å; Q122-S124 VanDerWaalsContact O-N 3.12Å; S124-S371 VanDerWaalsContact CB-OG 3.24Å; S124-S371 WeakPolarHBondContact CB-OG 3.38Å; S124-S371 PolarHBondContact O-OG 3.11Å; S124-S371 VanDerWaalsContact OG-CB 3.31Å; S124-S371 WeakPolarHBondContact OG-CB 3.45Å; S124-S371 PolarHBondContact OG-OG 3.34Å; S124-N375 PolarHBondContact O-ND2 3.09Å
125	V	98.7	Very high	97.5	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	19%	0.19	C	C	.	.			trans	-122.5	94.3	178.1	-178.4	0	0	0	0	108.5	F120 Q122 S123 G127 H128 L195 A374 A378	F120-V125 HydrophobicContact CD2-CG2 3.76Å; F120-V125 HydrophobicContact CE2-CG2 3.96Å; Q122-V125 PolarHBondContact O-N 3.31Å; Q122-V125 VanDerWaalsContact O-N 3.1Å; S123-V125 VanDerWaalsContact C-N 3.25Å; S123-V125 PolarHBondContact O-N 3.49Å; V125-G127 PolarHBondContact O-N 2.8Å; V125-H128 PolarHBondContact O-CD2 3.27Å; V125-H128 PolarHBondContact O-N 3.2Å; V125-L195 HydrophobicContact CG1-CD2 4.14Å; V125-A374 HydrophobicContact CG2-CB 3.69Å; V125-A378 HydrophobicContact CG1-CB 3.61Å
126	P	98.4	Very high	97.9	Very high	69 Å²	69	33 Å²	33	45%	0.448	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.5	-178	-27.6	35.7	0	0	0	113.8	H128 T129 E130	P126-H128 PolarHBondContact O-N 3.16Å; P126-T129 PolarHBondContact O-N 3.24Å; P126-T129 PolarHBondContact O-OG1 2.85Å; P126-E130 PolarHBondContact O-N 3.37Å
127	G	98.5	Very high	98.2	Very high	4 Å²	4	32.5 Å²	32.5	4%	0.041	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-22.1	-179.3	0	0	0	0	0	115.8	V125 L131	V125-G127 PolarHBondContact O-N 2.8Å; G127-L131 WeakPolarHBondContact O-CB 3.3Å; G127-L131 PolarHBondContact O-N 3.39Å
128	H	98.7	Very high	98.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.6	-47.7	173	-72.6	-76.4	0	0	0	112	F120 Q122 V125 P126 A132 L188 A191 D192 Y196	F120-H128 AromaticContact CE2-NE2 3.52Å; Q122-H128 HydrophobicContact CG-CB 4.31Å; Q122-H128 PolarHBondContact O-CD2 2.92Å; V125-H128 PolarHBondContact O-CD2 3.27Å; V125-H128 PolarHBondContact O-N 3.2Å; P126-H128 PolarHBondContact O-N 3.16Å; H128-A132 VanDerWaalsContact O-CB 3.25Å; H128-A132 WeakPolarHBondContact O-CB 3.36Å; H128-A132 PolarHBondContact O-N 3.06Å; H128-L188 HydrophobicContact CB-CD1 4.27Å; H128-A191 VanDerWaalsContact O-CB 3.28Å; H128-A191 WeakPolarHBondContact O-CB 3.37Å; H128-D192 IonicContact CE1-OD1 3.03Å; H128-D192 PolarHBondContact CE1-OD1 3.36Å; H128-D192 IonicContact CG-OD1 2.65Å; H128-D192 WeakPolarHBondContact ND1-CA 3.24Å; H128-D192 IonicContact ND1-OD1 3.96Å; H128-D192 PolarHBondContact ND1-OD1 2.82Å; H128-Y196 AromaticContact CE1-CE2 3.56Å; H128-Y196 AromaticContact CE1-CZ 3.9Å; H128-Y196 PolarHBondContact CE1-OH 3.44Å; H128-Y196 AromaticContact NE2-CE2 3.89Å; H128-Y196 AromaticContact NE2-CZ 3.77Å; H128-Y196 PolarHBondContact NE2-OH 3Å
129	T	98.5	Very high	98.3	Very high	72 Å²	72	33.8 Å²	33.8	44%	0.442	19%	0.189	S	C	.	.	H	α-helix	trans	-76.5	-35.5	-178.5	58.4	0	0	0	0	111.4	L83 P126 A132 W133 L188	L83-T129 HydrophobicContact CD1-CG2 3.74Å; P126-T129 PolarHBondContact O-N 3.24Å; P126-T129 PolarHBondContact O-OG1 2.85Å; T129-A132 PolarHBondContact O-N 2.96Å; T129-W133 PolarHBondContact O-N 2.84Å; T129-L188 HydrophobicContact CG2-CD1 4.35Å
130	E	98.5	Very high	98.2	Very high	69 Å²	69	37 Å²	37	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-60.6	-48.3	174.1	-70	176.7	-123.3	0	0	111.9	P126 W133 I134 L382 Y386	P126-E130 PolarHBondContact O-N 3.37Å; E130-W133 WeakPolarHBondContact O-CB 3.26Å; E130-W133 PolarHBondContact O-N 2.84Å; E130-I134 PolarHBondContact O-N 2.98Å; E130-L382 HydrophobicContact CB-CD1 4.2Å; E130-L382 HydrophobicContact CB-CD2 4.33Å; E130-Y386 WeakPolarHBondContact OE2-CE2 3.27Å; E130-Y386 PolarHBondContact OE2-OH 3.31Å
131	L	98.6	Very high	98	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-68.7	-36.7	176.4	-178.5	56.8	0	0	0	111.5	G127 W133 I134 L135 A191 L194 L195 L382 I385	G127-L131 WeakPolarHBondContact O-CB 3.3Å; G127-L131 PolarHBondContact O-N 3.39Å; L131-W133 VanDerWaalsContact C-N 3.26Å; L131-W133 PolarHBondContact O-N 3.33Å; L131-I134 HydrophobicContact CD1-CB 4.47Å; L131-I134 PolarHBondContact O-N 2.92Å; L131-I134 VanDerWaalsContact O-N 3.17Å; L131-L135 HydrophobicContact CD1-CD1 4.46Å; L131-L135 HydrophobicContact CD1-CD2 4.46Å; L131-L135 HydrophobicContact CD1-CG 4.12Å; L131-L135 HydrophobicContact CG-CD1 4.08Å; L131-L135 HydrophobicContact CG-CG 4.22Å; L131-L135 WeakPolarHBondContact O-CG 3.43Å; L131-L135 PolarHBondContact O-N 3.07Å; L131-A191 HydrophobicContact CB-CB 3.92Å; L131-A191 HydrophobicContact CD2-CB 4.23Å; L131-A191 HydrophobicContact CG-CB 3.92Å; L131-L194 HydrophobicContact CD2-CB 4.07Å; L131-L195 HydrophobicContact CB-CD1 4.46Å; L131-L195 HydrophobicContact CD2-CB 3.93Å; L131-L195 HydrophobicContact CD2-CD1 4.17Å; L131-L382 HydrophobicContact CB-CD2 4.26Å; L131-I385 HydrophobicContact CD1-CD1 3.94Å; L131-I385 HydrophobicContact CD2-CD1 4.44Å
132	A	98.5	Very high	97.7	Very high	9 Å²	9	44.1 Å²	44.1	7%	0.074	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-38.2	175.2	0	0	0	0	0	112.1	H128 T129 L135 S136 L188 A191	H128-A132 VanDerWaalsContact O-CB 3.25Å; H128-A132 WeakPolarHBondContact O-CB 3.36Å; H128-A132 PolarHBondContact O-N 3.06Å; T129-A132 PolarHBondContact O-N 2.96Å; A132-L135 PolarHBondContact O-N 3.38Å; A132-S136 VanDerWaalsContact O-CB 3.28Å; A132-S136 WeakPolarHBondContact O-CB 3.18Å; A132-S136 PolarHBondContact O-N 3.1Å; A132-S136 PolarHBondContact O-OG 3.19Å; A132-L188 HydrophobicContact CB-CB 4.24Å; A132-L188 HydrophobicContact CB-CD1 3.85Å; A132-A191 HydrophobicContact CB-CB 3.87Å
133	W	98.5	Very high	97.5	Very high	206 Å²	206	47.3 Å²	47.3	78%	0.78	26%	0.264	S	S	*	.	H	α-helix	trans	-60.2	-49.1	173.8	177.2	-95.5	0	0	0	111.7	T129 E130 L131 L135 S136 S137	T129-W133 PolarHBondContact O-N 2.84Å; E130-W133 WeakPolarHBondContact O-CB 3.26Å; E130-W133 PolarHBondContact O-N 2.84Å; L131-W133 VanDerWaalsContact C-N 3.26Å; L131-W133 PolarHBondContact O-N 3.33Å; W133-L135 PolarHBondContact O-N 3.04Å; W133-S136 PolarHBondContact O-N 3.02Å; W133-S137 PolarHBondContact O-N 3.16Å
134	I	98.5	Very high	97.3	Very high	8 Å²	8	45.1 Å²	45.1	4%	0.041	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-48.2	179	-62.6	167.4	0	0	0	110.4	E130 L131 S136 S137 W225 I385 Y386 I389	E130-I134 PolarHBondContact O-N 2.98Å; L131-I134 HydrophobicContact CD1-CB 4.47Å; L131-I134 PolarHBondContact O-N 2.92Å; L131-I134 VanDerWaalsContact O-N 3.17Å; I134-S136 VanDerWaalsContact C-N 3.33Å; I134-S136 PolarHBondContact O-N 3.43Å; I134-S137 WeakPolarHBondContact O-CB 3.48Å; I134-S137 PolarHBondContact O-N 3.28Å; I134-S137 PolarHBondContact O-OG 3.01Å; I134-W225 HydrophobicContact CG2-CH2 3.98Å; I134-W225 HydrophobicContact CG2-CZ3 3.74Å; I134-I385 HydrophobicContact CD1-CG2 3.72Å; I134-Y386 HydrophobicContact CD1-CD1 4.36Å; I134-Y386 HydrophobicContact CD1-CE1 3.95Å; I134-I389 HydrophobicContact CD1-CD1 3.88Å; I134-I389 HydrophobicContact CG1-CD1 4.07Å; I134-I389 HydrophobicContact CG2-CD1 4.21Å
135	L	98.6	Very high	96.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-36	179.5	-65.4	178.2	0	0	0	112.4	L131 A132 W133 S137 V138 C139 A190 A191 L194 L217	L131-L135 HydrophobicContact CD1-CD1 4.46Å; L131-L135 HydrophobicContact CD1-CD2 4.46Å; L131-L135 HydrophobicContact CD1-CG 4.12Å; L131-L135 HydrophobicContact CG-CD1 4.08Å; L131-L135 HydrophobicContact CG-CG 4.22Å; L131-L135 WeakPolarHBondContact O-CG 3.43Å; L131-L135 PolarHBondContact O-N 3.07Å; A132-L135 PolarHBondContact O-N 3.38Å; W133-L135 PolarHBondContact O-N 3.04Å; L135-S137 PolarHBondContact O-N 3.5Å; L135-V138 WeakPolarHBondContact O-CG2 3.31Å; L135-V138 PolarHBondContact O-N 3.48Å; L135-V138 VanDerWaalsContact O-N 3.11Å; L135-C139 PolarHBondContact O-N 3.34Å; L135-C139 VanDerWaalsContact O-N 3.09Å; L135-A190 HydrophobicContact CD1-CB 3.93Å; L135-A191 HydrophobicContact CD1-CB 4.05Å; L135-L194 HydrophobicContact CD1-CD1 3.91Å; L135-L194 HydrophobicContact CD2-CD1 4.22Å; L135-L217 HydrophobicContact CB-CD1 4.44Å; L135-L217 HydrophobicContact CD2-CB 4.34Å
136	S	98.4	Very high	96.5	Very high	49 Å²	49	48 Å²	48	34%	0.343	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-30.1	176.3	-60.1	0	0	0	0	111.8	A132 W133 I134 V138 C139 T187	A132-S136 VanDerWaalsContact O-CB 3.28Å; A132-S136 WeakPolarHBondContact O-CB 3.18Å; A132-S136 PolarHBondContact O-N 3.1Å; A132-S136 PolarHBondContact O-OG 3.19Å; W133-S136 PolarHBondContact O-N 3.02Å; I134-S136 VanDerWaalsContact C-N 3.33Å; I134-S136 PolarHBondContact O-N 3.43Å; S136-V138 PolarHBondContact O-N 3.45Å; S136-C139 PolarHBondContact O-N 3.06Å; S136-T187 WeakPolarHBondContact OG-CB 3.32Å; S136-T187 PolarHBondContact OG-OG1 2.74Å
137	S	97.7	Very high	96.2	Very high	56 Å²	56	44.8 Å²	44.8	39%	0.392	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-6.8	176.4	83.9	0	0	0	0	115.1	W133 I134 L135 K224 W225	W133-S137 PolarHBondContact O-N 3.16Å; I134-S137 WeakPolarHBondContact O-CB 3.48Å; I134-S137 PolarHBondContact O-N 3.28Å; I134-S137 PolarHBondContact O-OG 3.01Å; L135-S137 PolarHBondContact O-N 3.5Å; S137-K224 PolarHBondContact O-NZ 2.89Å; S137-K224 VanDerWaalsContact O-NZ 3.15Å; S137-W225 VanDerWaalsContact OG-CH2 3.28Å; S137-W225 WeakPolarHBondContact OG-CH2 3.43Å
138	V	98	Very high	95.7	Very high	25 Å²	25	47.1 Å²	47.1	15%	0.152	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-1.7	175.4	-58.3	0	0	0	0	112.9	L135 S136 L217 A221 K224 W225	L135-V138 WeakPolarHBondContact O-CG2 3.31Å; L135-V138 PolarHBondContact O-N 3.48Å; L135-V138 VanDerWaalsContact O-N 3.11Å; S136-V138 PolarHBondContact O-N 3.45Å; V138-L217 HydrophobicContact CG2-CD2 4.34Å; V138-A221 HydrophobicContact CG2-CB 4.13Å; V138-K224 HydrophobicContact CG1-CB 4.26Å; V138-K224 HydrophobicContact CG1-CD 3.45Å; V138-K224 VanDerWaalsContact CG1-CD 3.45Å; V138-W225 HydrophobicContact CG1-CE3 4.34Å; V138-W225 HydrophobicContact CG1-CH2 4.12Å; V138-W225 HydrophobicContact CG1-CZ3 3.69Å
139	C	98	Very high	95	Very high	20 Å²	20	48.5 Å²	48.5	14%	0.135	26%	0.258	C	S	.	.	S	Bend	trans	-89	124.4	174.1	-165.7	0	0	0	0	109.4	L135 S136 L144 T187 L217	L135-C139 PolarHBondContact O-N 3.34Å; L135-C139 VanDerWaalsContact O-N 3.09Å; S136-C139 PolarHBondContact O-N 3.06Å; C139-L144 VanDerWaalsContact SG-CG 3.59Å; C139-T187 HydrophobicContact CB-CG2 3.89Å; C139-L217 HydrophobicContact CB-CD2 3.47Å; C139-L217 VanDerWaalsContact CB-CD2 3.47Å
140	S	95.4	Very high	94.5	Very high	69 Å²	69	45.9 Å²	45.9	48%	0.483	24%	0.24	S	C	.	.			trans	-77.8	144	173.7	71	0	0	0	0	110.8	L142 R143 L144	S140-L142 PolarHBondContact O-N 3.41Å; S140-R143 WeakPolarHBondContact O-CB 3.25Å; S140-R143 PolarHBondContact O-N 3.21Å; S140-R143 VanDerWaalsContact OG-CB 3.29Å; S140-R143 WeakPolarHBondContact OG-CB 3.23Å; S140-R143 PolarHBondContact OG-N 2.89Å; S140-L144 PolarHBondContact O-N 2.71Å
141	V	93.8	Very high	93.7	Very high	87 Å²	87	46.1 Å²	46.1	53%	0.527	24%	0.238	S	C	.	.	H	α-helix	trans	-54.3	-42.2	173.8	180	0	0	0	0	110.7	R143 L144 A145 I171 F183	V141-R143 VanDerWaalsContact C-N 3.31Å; V141-R143 PolarHBondContact O-N 3.48Å; V141-L144 PolarHBondContact O-N 2.72Å; V141-A145 PolarHBondContact O-N 3.29Å; V141-I171 HydrophobicContact CG1-CD1 3.64Å; V141-F183 HydrophobicContact CG1-CE1 4Å; V141-F183 HydrophobicContact CG1-CZ 3.69Å; V141-F183 WeakPolarHBondContact O-CZ 3.37Å
142	L	92.3	Very high	92.9	Very high	93 Å²	93	52.1 Å²	52.1	49%	0.487	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-37.1	178.8	-173	63	0	0	0	112.4	S140 L144 A145 H146 P170	S140-L142 PolarHBondContact O-N 3.41Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L142-L144 PolarHBondContact O-N 3.49Å; L142-A145 PolarHBondContact O-N 3.1Å; L142-H146 VanDerWaalsContact CD1-NE2 3.31Å; L142-H146 WeakPolarHBondContact CD1-NE2 3.29Å; L142-H146 PolarHBondContact O-CD2 3.16Å; L142-H146 PolarHBondContact O-N 3.09Å; L142-H146 VanDerWaalsContact O-N 3.17Å; L142-P170 HydrophobicContact CD1-CG 4.45Å
143	R	93.8	Very high	92	Very high	66 Å²	66	57.4 Å²	57.4	25%	0.249	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-41.5	177.7	-179.5	63.2	-180	109.1	-7.6	111.6	S140 V141 L213 D216	S140-R143 WeakPolarHBondContact O-CB 3.25Å; S140-R143 PolarHBondContact O-N 3.21Å; S140-R143 VanDerWaalsContact OG-CB 3.29Å; S140-R143 WeakPolarHBondContact OG-CB 3.23Å; S140-R143 PolarHBondContact OG-N 2.89Å; V141-R143 VanDerWaalsContact C-N 3.31Å; V141-R143 PolarHBondContact O-N 3.48Å; R143-L213 HydrophobicContact CG-CD1 3.65Å; R143-D216 IonicContact CZ-OD2 2.67Å; R143-D216 IonicContact NE-OD2 3.4Å; R143-D216 PolarHBondContact NE-OD2 3.24Å; R143-D216 VanDerWaalsContact NE-OD2 3.13Å; R143-D216 IonicContact NH2-OD2 3.81Å; R143-D216 PolarHBondContact NH2-OD2 3.48Å
144	L	93.4	Very high	90.8	Very high	10 Å²	10	47.9 Å²	47.9	5%	0.052	25%	0.252	C	S	.	.	H	α-helix	trans	-69.1	-43.8	176.4	-65.5	-179.8	0	0	0	111.7	C139 S140 V141 L142 H146 L147 F183 P186 T187 L213	C139-L144 VanDerWaalsContact SG-CG 3.59Å; S140-L144 PolarHBondContact O-N 2.71Å; V141-L144 PolarHBondContact O-N 2.72Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L142-L144 PolarHBondContact O-N 3.49Å; L144-H146 PolarHBondContact O-N 3.18Å; L144-H146 VanDerWaalsContact O-N 3.13Å; L144-L147 HydrophobicContact CD2-CD1 3.95Å; L144-L147 WeakPolarHBondContact O-CB 3.24Å; L144-L147 WeakPolarHBondContact O-CG 3.47Å; L144-L147 PolarHBondContact O-N 2.71Å; L144-F183 HydrophobicContact CB-CD2 4.41Å; L144-F183 HydrophobicContact CB-CE1 4.1Å; L144-F183 HydrophobicContact CB-CE2 3.76Å; L144-F183 HydrophobicContact CB-CZ 3.58Å; L144-F183 HydrophobicContact CD1-CD1 4.24Å; L144-F183 HydrophobicContact CD1-CE1 3.89Å; L144-F183 HydrophobicContact CD1-CZ 4.24Å; L144-P186 HydrophobicContact CD2-CB 4.01Å; L144-P186 HydrophobicContact CD2-CG 4.34Å; L144-T187 HydrophobicContact CD1-CG2 4.29Å; L144-T187 HydrophobicContact CD2-CG2 4.21Å; L144-L213 HydrophobicContact CD2-CD2 4.03Å
145	A	90.7	Very high	89.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-21.7	-180	0	0	0	0	0	113.6	V141 L142 P170 I171 F183	V141-A145 PolarHBondContact O-N 3.29Å; L142-A145 PolarHBondContact O-N 3.1Å; A145-P170 HydrophobicContact CB-CB 4.12Å; A145-P170 HydrophobicContact CB-CG 3.84Å; A145-I171 HydrophobicContact CB-CD1 4.15Å; A145-I171 HydrophobicContact CB-CG1 3.83Å; A145-F183 HydrophobicContact CB-CE2 4.11Å; A145-F183 HydrophobicContact CB-CZ 4.48Å
146	H	90.4	Very high	87.1	Confident	94 Å²	94	50.1 Å²	50.1	44%	0.435	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-6.2	175.4	-77.3	-52.9	0	0	0	114.9	L142 L144	L142-H146 VanDerWaalsContact CD1-NE2 3.31Å; L142-H146 WeakPolarHBondContact CD1-NE2 3.29Å; L142-H146 PolarHBondContact O-CD2 3.16Å; L142-H146 PolarHBondContact O-N 3.09Å; L142-H146 VanDerWaalsContact O-N 3.17Å; L144-H146 PolarHBondContact O-N 3.18Å; L144-H146 VanDerWaalsContact O-N 3.13Å
147	L	91.2	Very high	85	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.016	28%	0.278	C	S	.	.			trans	-66.1	132.4	177.6	-65.6	170.7	0	0	0	110.2	L144 Q149 W150 R151 P186 T209 L213	L144-L147 HydrophobicContact CD2-CD1 3.95Å; L144-L147 WeakPolarHBondContact O-CB 3.24Å; L144-L147 WeakPolarHBondContact O-CG 3.47Å; L144-L147 PolarHBondContact O-N 2.71Å; L147-Q149 PolarHBondContact O-N 3.48Å; L147-W150 WeakPolarHBondContact O-CB 3.4Å; L147-W150 PolarHBondContact O-N 2.66Å; L147-W150 VanDerWaalsContact O-N 3.13Å; L147-R151 PolarHBondContact O-N 2.84Å; L147-P186 HydrophobicContact CD1-CB 3.68Å; L147-P186 HydrophobicContact CD1-CG 3.54Å; L147-T209 HydrophobicContact CD2-CG2 3.83Å; L147-L213 HydrophobicContact CD1-CD2 3.96Å
148	P	87.5	Confident	82.8	Confident	53 Å²	53	58.1 Å²	58.1	34%	0.344	29%	0.294	S	S	.	.	H	α-helix	trans	-53.2	-40	179	-27.3	34.8	0	0	0	112.9	W150 R151 E152	P148-W150 VanDerWaalsContact C-N 3.3Å; P148-W150 PolarHBondContact O-N 3.45Å; P148-R151 PolarHBondContact O-N 3.03Å; P148-R151 VanDerWaalsContact O-N 3.12Å; P148-E152 WeakPolarHBondContact O-CG 3.5Å; P148-E152 PolarHBondContact O-N 3.09Å
149	Q	85.6	Confident	80.5	Confident	29 Å²	29	59.1 Å²	59.1	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-34	-177.3	-62.2	82.7	0.8	0	0	112.9	L147 K153 H210	L147-Q149 PolarHBondContact O-N 3.48Å; Q149-K153 WeakPolarHBondContact O-CB 3.2Å; Q149-K153 WeakPolarHBondContact O-CG 3.22Å; Q149-K153 PolarHBondContact O-N 3.22Å; Q149-K153 VanDerWaalsContact O-N 3.11Å; Q149-H210 PolarHBondContact NE2-CE1 3.25Å; Q149-H210 VanDerWaalsContact NE2-CE1 3.29Å
150	W	86.8	Confident	78.1	Confident	16 Å²	16	61.3 Å²	61.3	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-49.7	173.6	170.6	-108.5	0	0	0	110.3	L147 P148 E152 K153 C154 P170 I174 A178 L182 F183	L147-W150 WeakPolarHBondContact O-CB 3.4Å; L147-W150 PolarHBondContact O-N 2.66Å; L147-W150 VanDerWaalsContact O-N 3.13Å; P148-W150 VanDerWaalsContact C-N 3.3Å; P148-W150 PolarHBondContact O-N 3.45Å; W150-E152 VanDerWaalsContact C-N 3.34Å; W150-E152 PolarHBondContact O-N 3.13Å; W150-K153 PolarHBondContact O-N 3.22Å; W150-C154 WeakPolarHBondContact CH2-SG 3.24Å; W150-C154 HydrophobicContact CZ2-CB 4.5Å; W150-C154 WeakPolarHBondContact CZ3-SG 3.38Å; W150-C154 VanDerWaalsContact O-CB 3.25Å; W150-C154 WeakPolarHBondContact O-CB 3.16Å; W150-C154 PolarHBondContact O-N 2.94Å; W150-C154 PolarHBondContact O-SG 3.21Å; W150-P170 PolarHBondContact NE1-O 3.3Å; W150-I174 HydrophobicContact CH2-CD1 4.41Å; W150-I174 HydrophobicContact CH2-CG2 4.13Å; W150-I174 HydrophobicContact CZ2-CD1 3.92Å; W150-I174 HydrophobicContact CZ2-CG1 3.91Å; W150-I174 HydrophobicContact CZ2-CG2 4.3Å; W150-A178 HydrophobicContact CH2-CB 4.25Å; W150-A178 HydrophobicContact CZ3-CB 4.49Å; W150-L182 HydrophobicContact CZ3-CG 4.44Å; W150-F183 AromaticContact CD2-CD2 3.66Å; W150-F183 HydrophobicContact CD2-CD2 3.66Å; W150-F183 HydrophobicContact CD2-CE2 4.28Å; W150-F183 AromaticContact CE2-CD2 3.75Å; W150-F183 HydrophobicContact CE3-CB 4Å; W150-F183 AromaticContact CE3-CD2 3.64Å; W150-F183 HydrophobicContact CE3-CD2 3.64Å; W150-F183 HydrophobicContact CE3-CG 4.33Å; W150-F183 HydrophobicContact CG-CD2 4.33Å; W150-F183 HydrophobicContact CH2-CB 3.97Å; W150-F183 AromaticContact CH2-CD2 3.82Å; W150-F183 HydrophobicContact CH2-CD2 3.82Å; W150-F183 HydrophobicContact CH2-CG 4.24Å; W150-F183 AromaticContact CZ2-CD2 3.83Å; W150-F183 HydrophobicContact CZ2-CD2 3.83Å; W150-F183 HydrophobicContact CZ2-CE2 4.39Å; W150-F183 HydrophobicContact CZ3-CB 3.52Å; W150-F183 AromaticContact CZ3-CD2 3.73Å; W150-F183 HydrophobicContact CZ3-CD2 3.73Å; W150-F183 HydrophobicContact CZ3-CG 4.09Å
151	R	82.3	Confident	75.7	Confident	75 Å²	75	63.1 Å²	63.1	28%	0.283	33%	0.328	S	S	.	.	H	α-helix	trans	-63.2	-40.4	-178.1	-59.6	-179.5	79.7	165.4	6.3	112.1	L147 P148 Y156 F157	L147-R151 PolarHBondContact O-N 2.84Å; P148-R151 PolarHBondContact O-N 3.03Å; P148-R151 VanDerWaalsContact O-N 3.12Å; R151-Y156 HydrophobicContact CB-CG 4.39Å; R151-Y156 VanDerWaalsContact NH2-CZ 3.3Å; R151-Y156 PolarHBondContact NH2-OH 2.88Å; R151-Y156 WeakPolarHBondContact O-CB 3.33Å; R151-Y156 PolarHBondContact O-N 2.95Å; R151-F157 HydrophobicContact CB-CE2 4.5Å
152	E	81.5	Confident	73.4	Confident	127 Å²	127	65.6 Å²	65.6	59%	0.593	34%	0.338	S	S	*	.	H	α-helix	trans	-66.5	-49.2	177.7	-72.5	172	-163.3	0	0	112.1	P148 W150 G155 F157	P148-E152 WeakPolarHBondContact O-CG 3.5Å; P148-E152 PolarHBondContact O-N 3.09Å; W150-E152 VanDerWaalsContact C-N 3.34Å; W150-E152 PolarHBondContact O-N 3.13Å; E152-G155 PolarHBondContact O-N 2.98Å; E152-F157 HydrophobicContact CG-CE2 4.28Å
153	K	79.4	Confident	70.8	Confident	119 Å²	119	65.5 Å²	65.5	52%	0.517	34%	0.341	S	S	.	.	H	α-helix	trans	-78.8	-23.2	-174.4	-69.6	-179.1	173.9	-178.3	0	114.1	Q149 W150 G155 L182	Q149-K153 WeakPolarHBondContact O-CB 3.2Å; Q149-K153 WeakPolarHBondContact O-CG 3.22Å; Q149-K153 PolarHBondContact O-N 3.22Å; Q149-K153 VanDerWaalsContact O-N 3.11Å; W150-K153 PolarHBondContact O-N 3.22Å; K153-G155 VanDerWaalsContact C-N 3.28Å; K153-L182 HydrophobicContact CB-CD1 4.39Å; K153-L182 HydrophobicContact CB-CD2 4.02Å; K153-L182 HydrophobicContact CD-CD1 3.61Å
154	C	73.1	Confident	68.5	Low	6 Å²	6	68.2 Å²	68.2	4%	0.041	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	12.5	174.3	-67.6	0	0	0	0	113.2	W150 Y156 P175	W150-C154 WeakPolarHBondContact CH2-SG 3.24Å; W150-C154 HydrophobicContact CZ2-CB 4.5Å; W150-C154 WeakPolarHBondContact CZ3-SG 3.38Å; W150-C154 VanDerWaalsContact O-CB 3.25Å; W150-C154 WeakPolarHBondContact O-CB 3.16Å; W150-C154 PolarHBondContact O-N 2.94Å; W150-C154 PolarHBondContact O-SG 3.21Å; C154-Y156 PolarHBondContact O-N 2.8Å; C154-Y156 VanDerWaalsContact O-N 3.16Å; C154-P175 HydrophobicContact CB-CG 4.27Å; C154-P175 WeakPolarHBondContact O-CD 3.49Å; C154-P175 WeakPolarHBondContact O-CG 3.2Å
155	G	63.6	Low	66	Low	19 Å²	19	72.3 Å²	72.3	20%	0.196	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	27.8	176.9	0	0	0	0	0	113.3	E152 K153 F157 D158 S159	E152-G155 PolarHBondContact O-N 2.98Å; K153-G155 VanDerWaalsContact C-N 3.28Å; G155-F157 PolarHBondContact O-N 3.06Å; G155-F157 VanDerWaalsContact O-N 3.12Å; G155-D158 PolarHBondContact O-N 3.09Å; G155-S159 PolarHBondContact O-N 3.03Å
156	Y	56.4	Low	63.7	Low	37 Å²	37	79.6 Å²	79.6	15%	0.145	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-35.8	-180	-178.4	-91.5	0	0	0	110.7	R151 C154 S159 V160	R151-Y156 HydrophobicContact CB-CG 4.39Å; R151-Y156 VanDerWaalsContact NH2-CZ 3.3Å; R151-Y156 PolarHBondContact NH2-OH 2.88Å; R151-Y156 WeakPolarHBondContact O-CB 3.33Å; R151-Y156 PolarHBondContact O-N 2.95Å; C154-Y156 PolarHBondContact O-N 2.8Å; C154-Y156 VanDerWaalsContact O-N 3.16Å; Y156-S159 PolarHBondContact O-OG 2.85Å; Y156-S159 VanDerWaalsContact O-OG 3.05Å; Y156-V160 HydrophobicContact CE1-CG2 4.24Å; Y156-V160 WeakPolarHBondContact O-CG2 3.35Å
157	F	53.9	Low	61.6	Low	137 Å²	137	82.9 Å²	82.9	60%	0.601	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-31.5	177	-63.9	-72.8	0	0	0	113.8	R151 E152 G155	R151-F157 HydrophobicContact CB-CE2 4.5Å; E152-F157 HydrophobicContact CG-CE2 4.28Å; G155-F157 PolarHBondContact O-N 3.06Å; G155-F157 VanDerWaalsContact O-N 3.12Å
158	D	51.2	Low	59.8	Low	135 Å²	135	85.7 Å²	85.7	72%	0.722	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-76.1	-27.3	178.4	-63.1	-30.3	0	0	0	111.7	G155 V160	G155-D158 PolarHBondContact O-N 3.09Å; D158-V160 VanDerWaalsContact C-N 3.29Å; D158-V160 PolarHBondContact O-N 2.98Å
159	S	49.8	Very low	58.5	Low	46 Å²	46	85.3 Å²	85.3	32%	0.322	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-79.9	-1.6	177	72.7	0	0	0	0	115.2	G155 Y156 N173	G155-S159 PolarHBondContact O-N 3.03Å; Y156-S159 PolarHBondContact O-OG 2.85Å; Y156-S159 VanDerWaalsContact O-OG 3.05Å; S159-N173 PolarHBondContact OG-ND2 3.13Å
160	V	48.4	Very low	57.4	Low	67 Å²	67	84.9 Å²	84.9	41%	0.406	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-109.1	8	-174.5	-179.3	0	0	0	0	112.4	Y156 D158 D162	Y156-V160 HydrophobicContact CE1-CG2 4.24Å; Y156-V160 WeakPolarHBondContact O-CG2 3.35Å; D158-V160 VanDerWaalsContact C-N 3.29Å; D158-V160 PolarHBondContact O-N 2.98Å; V160-D162 PolarHBondContact O-N 3.49Å
161	S	45	Very low	56.3	Low	107 Å²	107	87 Å²	87	75%	0.748	48%	0.483	S	S	*	.	S	Bend	trans	-65.7	-23.7	170.9	55	0	0	0	0	113.1
162	D	44.2	Very low	55.6	Low	138 Å²	138	88.5 Å²	88.5	74%	0.738	50%	0.496	S	S	*	.	S	Bend	trans	-121.5	102.1	167.9	-78.2	-36.6	0	0	0	108.6	V160	V160-D162 PolarHBondContact O-N 3.49Å
163	V	39.1	Very low	55	Low	91 Å²	91	85.8 Å²	85.8	55%	0.552	49%	0.486	S	S	*	.			trans	156.1	93.3	148.1	167.6	0	0	0	0	108.2	T165	V163-T165 WeakPolarHBondContact CG1-OG1 3.35Å; V163-T165 PolarHBondContact O-N 2.77Å
164	S	45.3	Very low	54.5	Low	123 Å²	123	83.8 Å²	83.8	86%	0.86	48%	0.48	S	S	*	.			trans	-68.2	66.1	159.8	57	0	0	0	0	110.6
165	T	39.8	Very low	54.4	Low	96 Å²	96	85.6 Å²	85.6	59%	0.589	49%	0.492	S	S	*	.			trans	-156.9	111.5	163.7	43.5	0	0	0	0	111.9	V163	V163-T165 WeakPolarHBondContact CG1-OG1 3.35Å; V163-T165 PolarHBondContact O-N 2.77Å
166	N	43.4	Very low	54.9	Low	153 Å²	153	93.3 Å²	93.3	82%	0.818	53%	0.529	S	S	*	.	S	Bend	trans	0.8	133.3	146.7	-56.7	-30.5	0	0	0	117.9
167	N	46.9	Very low	55.9	Low	164 Å²	164	98 Å²	98	88%	0.877	56%	0.556	S	S	*	*			trans	76.9	24.8	158.6	-58.6	-21.2	0	0	0	119.6	S169	N167-S169 PolarHBondContact O-N 3.38Å
168	T	52.3	Low	57.2	Low	61 Å²	61	92.4 Å²	92.4	37%	0.374	54%	0.536	S	S	.	.			trans	-68.9	118	164	37.8	0	0	0	0	110.4
169	S	60.2	Low	59	Low	46 Å²	46	88.6 Å²	88.6	32%	0.322	52%	0.52	S	S	.	.			trans	-51.4	138.7	176.6	179.5	0	0	0	0	110.1	N167 I171 N172	N167-S169 PolarHBondContact O-N 3.38Å; S169-I171 PolarHBondContact O-N 3.21Å; S169-N172 PolarHBondContact O-N 3.27Å
170	P	62.5	Low	61	Low	19 Å²	19	91.9 Å²	91.9	12%	0.123	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-1.3	-179.8	24	-33.7	0	0	0	114.8	L142 A145 W150	L142-P170 HydrophobicContact CD1-CG 4.45Å; A145-P170 HydrophobicContact CB-CB 4.12Å; A145-P170 HydrophobicContact CB-CG 3.84Å; W150-P170 PolarHBondContact NE1-O 3.3Å
171	I	64.8	Low	63.1	Low	62 Å²	62	90 Å²	90	32%	0.318	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-12.7	-179.6	-61.8	170.1	0	0	0	111.9	V141 A145 S169 N173 I174	V141-I171 HydrophobicContact CG1-CD1 3.64Å; A145-I171 HydrophobicContact CB-CD1 4.15Å; A145-I171 HydrophobicContact CB-CG1 3.83Å; S169-I171 PolarHBondContact O-N 3.21Å; I171-N173 PolarHBondContact O-N 2.86Å; I171-I174 HydrophobicContact CG2-CD1 4.07Å; I171-I174 WeakPolarHBondContact O-CD1 3.12Å; I171-I174 WeakPolarHBondContact O-CG1 3.49Å
172	N	67.6	Low	65.3	Low	105 Å²	105	85.8 Å²	85.8	56%	0.561	50%	0.501	S	S	*	.	S	Bend	trans	-79.1	-16.1	-170.3	-71.2	0.9	0	0	0	114.3	S169	S169-N172 PolarHBondContact O-N 3.27Å
173	N	68.1	Low	67.6	Low	71 Å²	71	80.8 Å²	80.8	38%	0.38	47%	0.472	S	S	.	.	S	Bend	trans	-126.2	66.6	-178.2	-67.3	-4.5	0	0	0	110.5	S159 I171	S159-N173 PolarHBondContact OG-ND2 3.13Å; I171-N173 PolarHBondContact O-N 2.86Å
174	I	69.6	Low	70.3	Confident	77 Å²	77	78.9 Å²	78.9	40%	0.395	46%	0.461	S	S	.	.			trans	-91	123.6	177.7	-59.4	177.3	0	0	0	108.5	W150 I171 A178	W150-I174 HydrophobicContact CH2-CD1 4.41Å; W150-I174 HydrophobicContact CH2-CG2 4.13Å; W150-I174 HydrophobicContact CZ2-CD1 3.92Å; W150-I174 HydrophobicContact CZ2-CG1 3.91Å; W150-I174 HydrophobicContact CZ2-CG2 4.3Å; I171-I174 HydrophobicContact CG2-CD1 4.07Å; I171-I174 WeakPolarHBondContact O-CD1 3.12Å; I171-I174 WeakPolarHBondContact O-CG1 3.49Å; I174-A178 HydrophobicContact CG2-CB 3.63Å
175	P	70.8	Confident	72.7	Confident	43 Å²	43	74.2 Å²	74.2	28%	0.279	43%	0.425	S	S	.	.			trans	-60	146.7	173.1	-23.2	32.9	0	0	0	112.2	C154 N177 A178	C154-P175 HydrophobicContact CB-CG 4.27Å; C154-P175 WeakPolarHBondContact O-CD 3.49Å; C154-P175 WeakPolarHBondContact O-CG 3.2Å; P175-N177 VanDerWaalsContact CB-OD1 3.3Å; P175-N177 WeakPolarHBondContact CB-OD1 3.02Å; P175-N177 PolarHBondContact O-N 3.49Å; P175-A178 HydrophobicContact CB-CB 4.5Å; P175-A178 WeakPolarHBondContact O-CB 3.26Å; P175-A178 PolarHBondContact O-N 3.22Å
176	D	74.3	Confident	75.5	Confident	182 Å²	182	69.9 Å²	69.9	97%	0.973	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.4	178.9	-67.5	-22.5	0	0	0	113.8
177	N	75.8	Confident	78.1	Confident	134 Å²	134	62.8 Å²	62.8	72%	0.717	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-1.6	-179.6	68	-2.1	0	0	0	114.3	P175 S179	P175-N177 VanDerWaalsContact CB-OD1 3.3Å; P175-N177 WeakPolarHBondContact CB-OD1 3.02Å; P175-N177 PolarHBondContact O-N 3.49Å; N177-S179 PolarHBondContact O-N 3.21Å
178	A	82.1	Confident	80.5	Confident	21 Å²	21	56.2 Å²	56.2	17%	0.174	33%	0.325	C	S	.	.			trans	-75.7	106.6	178.6	0	0	0	0	0	110.1	W150 I174 P175	W150-A178 HydrophobicContact CH2-CB 4.25Å; W150-A178 HydrophobicContact CZ3-CB 4.49Å; I174-A178 HydrophobicContact CG2-CB 3.63Å; P175-A178 HydrophobicContact CB-CB 4.5Å; P175-A178 WeakPolarHBondContact O-CB 3.26Å; P175-A178 PolarHBondContact O-N 3.22Å
179	S	88.3	Confident	82.7	Confident	55 Å²	55	54.8 Å²	54.8	39%	0.385	31%	0.314	S	S	.	.			trans	-72	150.8	-178.1	69.1	0	0	0	0	112.5	N177 G181 L182 F183	N177-S179 PolarHBondContact O-N 3.21Å; S179-G181 PolarHBondContact O-N 3.24Å; S179-L182 WeakPolarHBondContact O-CB 3.41Å; S179-L182 PolarHBondContact O-N 2.88Å; S179-L182 WeakPolarHBondContact OG-CB 3.44Å; S179-L182 PolarHBondContact OG-N 3.21Å; S179-L182 VanDerWaalsContact OG-N 3.11Å; S179-F183 PolarHBondContact O-N 3.37Å
180	V	92.4	Very high	84.5	Confident	115 Å²	115	52.7 Å²	52.7	70%	0.697	30%	0.299	S	S	*	.	H	α-helix	trans	-57.2	-36.1	170.8	178.3	0	0	0	0	110.8	L182 F183 T184	V180-L182 VanDerWaalsContact C-N 3.33Å; V180-L182 PolarHBondContact O-N 3.44Å; V180-F183 WeakPolarHBondContact O-CB 3.41Å; V180-F183 PolarHBondContact O-N 2.85Å; V180-F183 VanDerWaalsContact O-N 3.09Å; V180-T184 HydrophobicContact CG1-CG2 4.08Å; V180-T184 WeakPolarHBondContact O-CG2 3.39Å; V180-T184 PolarHBondContact O-N 3.15Å; V180-T184 PolarHBondContact O-OG1 2.88Å
181	G	92.8	Very high	86.2	Confident	28 Å²	28	51.8 Å²	51.8	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-40.7	174.8	0	0	0	0	0	112.7	T87 S179 F183 T184 Y185	T87-G181 VanDerWaalsContact CG2-C 3.43Å; S179-G181 PolarHBondContact O-N 3.24Å; G181-F183 PolarHBondContact O-N 3.22Å; G181-T184 PolarHBondContact O-N 3.33Å; G181-Y185 WeakPolarHBondContact O-CB 3.41Å; G181-Y185 PolarHBondContact O-N 3.19Å
182	L	90.8	Very high	87.8	Confident	18 Å²	18	49.3 Å²	49.3	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-31.1	174.9	177.7	63.5	0	0	0	112.3	W150 K153 S179 V180 Y185	W150-L182 HydrophobicContact CZ3-CG 4.44Å; K153-L182 HydrophobicContact CB-CD1 4.39Å; K153-L182 HydrophobicContact CB-CD2 4.02Å; K153-L182 HydrophobicContact CD-CD1 3.61Å; S179-L182 WeakPolarHBondContact O-CB 3.41Å; S179-L182 PolarHBondContact O-N 2.88Å; S179-L182 WeakPolarHBondContact OG-CB 3.44Å; S179-L182 PolarHBondContact OG-N 3.21Å; S179-L182 VanDerWaalsContact OG-N 3.11Å; V180-L182 VanDerWaalsContact C-N 3.33Å; V180-L182 PolarHBondContact O-N 3.44Å; L182-Y185 HydrophobicContact CD1-CD1 4.47Å; L182-Y185 HydrophobicContact CD1-CE1 4.32Å; L182-Y185 WeakPolarHBondContact O-CD1 3.23Å; L182-Y185 WeakPolarHBondContact O-CE1 3.4Å
183	F	93.1	Very high	89.2	Confident	33 Å²	33	44.7 Å²	44.7	15%	0.145	26%	0.256	C	S	.	.	H	α-helix	trans	-75.4	-41.1	175.3	-175.4	-113.6	0	0	0	112.5	V141 L144 A145 W150 S179 V180 G181 P186	V141-F183 HydrophobicContact CG1-CE1 4Å; V141-F183 HydrophobicContact CG1-CZ 3.69Å; V141-F183 WeakPolarHBondContact O-CZ 3.37Å; L144-F183 HydrophobicContact CB-CD2 4.41Å; L144-F183 HydrophobicContact CB-CE1 4.1Å; L144-F183 HydrophobicContact CB-CE2 3.76Å; L144-F183 HydrophobicContact CB-CZ 3.58Å; L144-F183 HydrophobicContact CD1-CD1 4.24Å; L144-F183 HydrophobicContact CD1-CE1 3.89Å; L144-F183 HydrophobicContact CD1-CZ 4.24Å; A145-F183 HydrophobicContact CB-CE2 4.11Å; A145-F183 HydrophobicContact CB-CZ 4.48Å; W150-F183 AromaticContact CD2-CD2 3.66Å; W150-F183 HydrophobicContact CD2-CD2 3.66Å; W150-F183 HydrophobicContact CD2-CE2 4.28Å; W150-F183 AromaticContact CE2-CD2 3.75Å; W150-F183 HydrophobicContact CE3-CB 4Å; W150-F183 AromaticContact CE3-CD2 3.64Å; W150-F183 HydrophobicContact CE3-CD2 3.64Å; W150-F183 HydrophobicContact CE3-CG 4.33Å; W150-F183 HydrophobicContact CG-CD2 4.33Å; W150-F183 HydrophobicContact CH2-CB 3.97Å; W150-F183 AromaticContact CH2-CD2 3.82Å; W150-F183 HydrophobicContact CH2-CD2 3.82Å; W150-F183 HydrophobicContact CH2-CG 4.24Å; W150-F183 AromaticContact CZ2-CD2 3.83Å; W150-F183 HydrophobicContact CZ2-CD2 3.83Å; W150-F183 HydrophobicContact CZ2-CE2 4.39Å; W150-F183 HydrophobicContact CZ3-CB 3.52Å; W150-F183 AromaticContact CZ3-CD2 3.73Å; W150-F183 HydrophobicContact CZ3-CD2 3.73Å; W150-F183 HydrophobicContact CZ3-CG 4.09Å; S179-F183 PolarHBondContact O-N 3.37Å; V180-F183 WeakPolarHBondContact O-CB 3.41Å; V180-F183 PolarHBondContact O-N 2.85Å; V180-F183 VanDerWaalsContact O-N 3.09Å; G181-F183 PolarHBondContact O-N 3.22Å; F183-P186 WeakPolarHBondContact O-CD 3.26Å
184	T	95.7	Very high	90.6	Very high	51 Å²	51	41.5 Å²	41.5	31%	0.313	24%	0.239	S	C	.	.	H	α-helix	trans	-98	-12.4	-169.6	60.7	0	0	0	0	114.9	V180 G181 P186 T187	V180-T184 HydrophobicContact CG1-CG2 4.08Å; V180-T184 WeakPolarHBondContact O-CG2 3.39Å; V180-T184 PolarHBondContact O-N 3.15Å; V180-T184 PolarHBondContact O-OG1 2.88Å; G181-T184 PolarHBondContact O-N 3.33Å; T184-P186 WeakPolarHBondContact O-CD 3.41Å; T184-T187 PolarHBondContact O-N 3.2Å; T184-T187 PolarHBondContact O-OG1 2.65Å
185	Y	95.9	Very high	92	Very high	25 Å²	25	37.9 Å²	37.9	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-51.1	-29.7	178.4	89.4	-92.6	0	0	0	114.9	H84 G181 L182 T187 L188 Q189 H210	H84-Y185 AromaticContact CE1-CD2 3.96Å; H84-Y185 PolarHBondContact CE1-O 3.36Å; H84-Y185 AromaticContact ND1-CD2 3.68Å; G181-Y185 WeakPolarHBondContact O-CB 3.41Å; G181-Y185 PolarHBondContact O-N 3.19Å; L182-Y185 HydrophobicContact CD1-CD1 4.47Å; L182-Y185 HydrophobicContact CD1-CE1 4.32Å; L182-Y185 WeakPolarHBondContact O-CD1 3.23Å; L182-Y185 WeakPolarHBondContact O-CE1 3.4Å; Y185-T187 PolarHBondContact O-N 3.43Å; Y185-L188 CarbonylContact O-C 3.57Å; Y185-L188 WeakPolarHBondContact O-CA 3.38Å; Y185-L188 WeakPolarHBondContact O-CB 3.46Å; Y185-L188 PolarHBondContact O-N 3.01Å; Y185-Q189 PolarHBondContact O-N 3.02Å; Y185-H210 AromaticContact CE2-NE2 3.97Å; Y185-H210 AromaticContact CZ-NE2 3.77Å; Y185-H210 PolarHBondContact OH-CE1 2.84Å; Y185-H210 PolarHBondContact OH-NE2 3.1Å
186	P	97.2	Very high	93.1	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.032	21%	0.207	C	C	.	.	H	α-helix	trans	-62.5	-27.2	177.9	-26.1	38.7	0	0	0	113.5	L144 L147 F183 T184 A190 L213	L144-P186 HydrophobicContact CD2-CB 4.01Å; L144-P186 HydrophobicContact CD2-CG 4.34Å; L147-P186 HydrophobicContact CD1-CB 3.68Å; L147-P186 HydrophobicContact CD1-CG 3.54Å; F183-P186 WeakPolarHBondContact O-CD 3.26Å; T184-P186 WeakPolarHBondContact O-CD 3.41Å; P186-A190 PolarHBondContact O-N 3.48Å; P186-L213 HydrophobicContact CB-CD2 3.33Å
187	T	98.2	Very high	93.8	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.025	16%	0.164	C	C	.	.	H	α-helix	trans	-74.8	-34.6	172.6	65.7	0	0	0	0	111.7	S136 C139 L144 T184 Y185 A190 A191 L217	S136-T187 WeakPolarHBondContact OG-CB 3.32Å; S136-T187 PolarHBondContact OG-OG1 2.74Å; C139-T187 HydrophobicContact CB-CG2 3.89Å; L144-T187 HydrophobicContact CD1-CG2 4.29Å; L144-T187 HydrophobicContact CD2-CG2 4.21Å; T184-T187 PolarHBondContact O-N 3.2Å; T184-T187 PolarHBondContact O-OG1 2.65Å; Y185-T187 PolarHBondContact O-N 3.43Å; T187-A190 PolarHBondContact O-N 2.9Å; T187-A191 PolarHBondContact O-N 3.36Å; T187-L217 HydrophobicContact CG2-CD1 4.44Å
188	L	98.4	Very high	94.4	Very high	25 Å²	25	21.2 Å²	21.2	13%	0.131	13%	0.131	C	C	.	.	H	α-helix	trans	-64.3	-42.8	170.6	-178.9	63.6	0	0	0	111.4	L83 H128 T129 A132 Y185 A190 A191 D192	L83-L188 HydrophobicContact CB-CD2 4.14Å; H128-L188 HydrophobicContact CB-CD1 4.27Å; T129-L188 HydrophobicContact CG2-CD1 4.35Å; A132-L188 HydrophobicContact CB-CB 4.24Å; A132-L188 HydrophobicContact CB-CD1 3.85Å; Y185-L188 CarbonylContact O-C 3.57Å; Y185-L188 WeakPolarHBondContact O-CA 3.38Å; Y185-L188 WeakPolarHBondContact O-CB 3.46Å; Y185-L188 PolarHBondContact O-N 3.01Å; L188-A190 VanDerWaalsContact C-N 3.33Å; L188-A190 PolarHBondContact O-N 3.33Å; L188-A191 WeakPolarHBondContact O-CA 3.31Å; L188-A191 WeakPolarHBondContact O-CB 3.22Å; L188-A191 PolarHBondContact O-N 3.22Å; L188-A191 VanDerWaalsContact O-N 3.09Å; L188-D192 PolarHBondContact O-N 3.48Å
189	Q	97.6	Very high	94.9	Very high	32 Å²	32	23.1 Å²	23.1	15%	0.15	14%	0.136	C	C	.	.	H	α-helix	trans	-63.1	-39.4	175.5	-176.2	174.1	-17.4	0	0	111.8	H84 Y185 A191 D192 I193 H210	H84-Q189 PolarHBondContact CE1-N 2.69Å; Y185-Q189 PolarHBondContact O-N 3.02Å; Q189-A191 VanDerWaalsContact C-N 3.31Å; Q189-A191 PolarHBondContact O-N 3.15Å; Q189-D192 WeakPolarHBondContact O-CB 3.26Å; Q189-D192 PolarHBondContact O-N 3.1Å; Q189-I193 HydrophobicContact CG-CD1 4.42Å; Q189-I193 WeakPolarHBondContact O-CG1 3.49Å; Q189-I193 PolarHBondContact O-N 3.4Å; Q189-H210 VanDerWaalsContact NE2-CB 3.32Å
190	A	98.2	Very high	95.2	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-39.4	172.7	0	0	0	0	0	111.7	L135 P186 T187 L188 I193 L194 A214 L217	L135-A190 HydrophobicContact CD1-CB 3.93Å; P186-A190 PolarHBondContact O-N 3.48Å; T187-A190 PolarHBondContact O-N 2.9Å; L188-A190 VanDerWaalsContact C-N 3.33Å; L188-A190 PolarHBondContact O-N 3.33Å; A190-I193 PolarHBondContact O-N 2.8Å; A190-L194 WeakPolarHBondContact O-CB 3.21Å; A190-L194 WeakPolarHBondContact O-CD1 3.18Å; A190-L194 WeakPolarHBondContact O-CG 3.33Å; A190-L194 PolarHBondContact O-N 3.1Å; A190-A214 HydrophobicContact CB-CB 3.84Å; A190-L217 HydrophobicContact CB-CD1 3.58Å
191	A	98.6	Very high	95.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.3	-43.4	174.2	0	0	0	0	0	112	H128 L131 A132 L135 T187 L188 Q189 I193 L194 L195	H128-A191 VanDerWaalsContact O-CB 3.28Å; H128-A191 WeakPolarHBondContact O-CB 3.37Å; L131-A191 HydrophobicContact CB-CB 3.92Å; L131-A191 HydrophobicContact CD2-CB 4.23Å; L131-A191 HydrophobicContact CG-CB 3.92Å; A132-A191 HydrophobicContact CB-CB 3.87Å; L135-A191 HydrophobicContact CD1-CB 4.05Å; T187-A191 PolarHBondContact O-N 3.36Å; L188-A191 WeakPolarHBondContact O-CA 3.31Å; L188-A191 WeakPolarHBondContact O-CB 3.22Å; L188-A191 PolarHBondContact O-N 3.22Å; L188-A191 VanDerWaalsContact O-N 3.09Å; Q189-A191 VanDerWaalsContact C-N 3.31Å; Q189-A191 PolarHBondContact O-N 3.15Å; A191-I193 PolarHBondContact O-N 3.12Å; A191-L194 PolarHBondContact O-N 3.09Å; A191-L195 WeakPolarHBondContact O-CB 2.96Å; A191-L195 PolarHBondContact O-N 2.71Å
192	D	98.3	Very high	95.5	Very high	11 Å²	11	16.1 Å²	16.1	6%	0.059	8%	0.084	C	C	.	.	H	α-helix	trans	-55.4	-38.4	176.5	-58.8	-31	0	0	0	112.9	L79 H84 Q122 H128 L188 Q189	L79-D192 HydrophobicContact CD2-CB 3.83Å; H84-D192 IonicContact CD2-OD2 2.76Å; H84-D192 PolarHBondContact CD2-OD2 2.86Å; H84-D192 IonicContact CE1-OD2 2.82Å; H84-D192 IonicContact NE2-OD2 3.41Å; H84-D192 PolarHBondContact NE2-OD2 2.95Å; Q122-D192 VanDerWaalsContact NE2-CG 3.32Å; Q122-D192 PolarHBondContact NE2-OD1 3.04Å; Q122-D192 PolarHBondContact NE2-OD2 3.28Å; Q122-D192 VanDerWaalsContact NE2-OD2 3.07Å; H128-D192 IonicContact CE1-OD1 3.03Å; H128-D192 PolarHBondContact CE1-OD1 3.36Å; H128-D192 IonicContact CG-OD1 2.65Å; H128-D192 WeakPolarHBondContact ND1-CA 3.24Å; H128-D192 IonicContact ND1-OD1 3.96Å; H128-D192 PolarHBondContact ND1-OD1 2.82Å; L188-D192 PolarHBondContact O-N 3.48Å; Q189-D192 WeakPolarHBondContact O-CB 3.26Å; Q189-D192 PolarHBondContact O-N 3.1Å
193	I	97.3	Very high	95.5	Very high	8 Å²	8	16.3 Å²	16.3	4%	0.041	9%	0.085	C	C	.	.	H	α-helix	trans	-74.2	-45.7	179.3	-67.3	162.9	0	0	0	111.4	V43 Q189 A190 A191 V201 I211 A214 P235	V43-I193 HydrophobicContact CG1-CB 4.47Å; V43-I193 HydrophobicContact CG1-CG1 4.49Å; V43-I193 HydrophobicContact CG1-CG2 4.46Å; Q189-I193 HydrophobicContact CG-CD1 4.42Å; Q189-I193 WeakPolarHBondContact O-CG1 3.49Å; Q189-I193 PolarHBondContact O-N 3.4Å; A190-I193 PolarHBondContact O-N 2.8Å; A191-I193 PolarHBondContact O-N 3.12Å; I193-V201 HydrophobicContact CD1-CG1 4.26Å; I193-V201 HydrophobicContact CG1-CG1 4.2Å; I193-V201 HydrophobicContact CG1-CG2 4.3Å; I193-V201 HydrophobicContact CG2-CG2 3.6Å; I193-I211 HydrophobicContact CD1-CD1 3.51Å; I193-A214 HydrophobicContact CD1-CB 4.27Å; I193-P235 HydrophobicContact CG2-CB 3.48Å; I193-P235 VanDerWaalsContact CG2-CB 3.48Å; I193-P235 HydrophobicContact CG2-CG 3.74Å
194	L	97.7	Very high	95.1	Very high	4 Å²	4	15.9 Å²	15.9	2%	0.021	9%	0.09	C	C	.	.	H	α-helix	trans	-85	-24.2	-168	-64.7	172.3	0	0	0	113.6	L131 L135 A190 A191 Y196 G197 V218 L232 H233 P235 R381	L131-L194 HydrophobicContact CD2-CB 4.07Å; L135-L194 HydrophobicContact CD1-CD1 3.91Å; L135-L194 HydrophobicContact CD2-CD1 4.22Å; A190-L194 WeakPolarHBondContact O-CB 3.21Å; A190-L194 WeakPolarHBondContact O-CD1 3.18Å; A190-L194 WeakPolarHBondContact O-CG 3.33Å; A190-L194 PolarHBondContact O-N 3.1Å; A191-L194 PolarHBondContact O-N 3.09Å; L194-Y196 PolarHBondContact O-N 3.09Å; L194-G197 PolarHBondContact O-N 3.49Å; L194-G197 VanDerWaalsContact O-N 3.09Å; L194-V218 HydrophobicContact CD1-CG2 3.58Å; L194-V218 HydrophobicContact CD2-CG2 3.42Å; L194-V218 VanDerWaalsContact CD2-CG2 3.42Å; L194-V218 HydrophobicContact CG-CG2 4.16Å; L194-L232 HydrophobicContact CB-CD2 4.41Å; L194-H233 WeakPolarHBondContact CD2-O 3.19Å; L194-P235 HydrophobicContact CD2-CG 4.27Å; L194-R381 PolarHBondContact O-NH2 3.24Å
195	L	97.8	Very high	94.6	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.5	-175.1	-176.6	60.6	0	0	0	112.6	V125 L131 A191 A378 R381 L382	V125-L195 HydrophobicContact CG1-CD2 4.14Å; L131-L195 HydrophobicContact CB-CD1 4.46Å; L131-L195 HydrophobicContact CD2-CB 3.93Å; L131-L195 HydrophobicContact CD2-CD1 4.17Å; A191-L195 WeakPolarHBondContact O-CB 2.96Å; A191-L195 PolarHBondContact O-N 2.71Å; L195-A378 HydrophobicContact CD1-CB 4.04Å; L195-A378 HydrophobicContact CD2-CB 3.78Å; L195-A378 HydrophobicContact CG-CB 3.87Å; L195-R381 WeakPolarHBondContact O-CD 3.4Å; L195-R381 PolarHBondContact O-NE 2.96Å; L195-L382 HydrophobicContact CD1-CD1 3.94Å; L195-L382 HydrophobicContact CD1-CD2 4.41Å; L195-L382 HydrophobicContact CD1-CG 3.84Å
196	Y	94.7	Very high	94	Very high	1 Å²	1	19.5 Å²	19.5	0%	0.004	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-4.5	-178.8	-53.8	-70.8	0	0	0	113.8	F41 V43 F77 F120 H128 L194 A198 A374 L377 A378	F41-Y196 WeakPolarHBondContact CD2-O 3.39Å; V43-Y196 HydrophobicContact CG2-CD2 4.33Å; F77-Y196 HydrophobicContact CD1-CD1 4.32Å; F77-Y196 HydrophobicContact CD1-CG 4.42Å; F77-Y196 HydrophobicContact CD2-CG 4.48Å; F77-Y196 HydrophobicContact CE1-CD1 4.1Å; F77-Y196 HydrophobicContact CE1-CG 4.48Å; F77-Y196 HydrophobicContact CG-CG 4.43Å; F77-Y196 HydrophobicContact CZ-CD1 4.36Å; F120-Y196 HydrophobicContact CE2-CE2 4.36Å; F120-Y196 AromaticContact CE2-CZ 3.89Å; F120-Y196 WeakPolarHBondContact CE2-OH 3.46Å; F120-Y196 HydrophobicContact CZ-CE1 4.4Å; F120-Y196 AromaticContact CZ-CE2 3.7Å; F120-Y196 HydrophobicContact CZ-CE2 3.7Å; F120-Y196 AromaticContact CZ-CZ 3.51Å; F120-Y196 WeakPolarHBondContact CZ-OH 3.49Å; H128-Y196 AromaticContact CE1-CE2 3.56Å; H128-Y196 AromaticContact CE1-CZ 3.9Å; H128-Y196 PolarHBondContact CE1-OH 3.44Å; H128-Y196 AromaticContact NE2-CE2 3.89Å; H128-Y196 AromaticContact NE2-CZ 3.77Å; H128-Y196 PolarHBondContact NE2-OH 3Å; L194-Y196 PolarHBondContact O-N 3.09Å; Y196-A198 VanDerWaalsContact C-N 3.35Å; Y196-A374 HydrophobicContact CE1-CB 4.04Å; Y196-L377 HydrophobicContact CD1-CD2 3.96Å; Y196-L377 HydrophobicContact CD1-CG 4.24Å; Y196-A378 HydrophobicContact CE1-CB 4.26Å
197	G	89.8	Confident	93.7	Very high	6 Å²	6	21.6 Å²	21.6	6%	0.062	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	35.6	-174.5	0	0	0	0	0	112.5	L194 H199	L194-G197 PolarHBondContact O-N 3.49Å; L194-G197 VanDerWaalsContact O-N 3.09Å; G197-H199 PolarHBondContact O-ND1 2.85Å
198	A	88.3	Confident	93.5	Very high	2 Å²	2	24.3 Å²	24.3	2%	0.017	14%	0.142	C	C	.	.			trans	-64.9	135.1	179.4	0	0	0	0	0	111.5	F41 V43 Y196	F41-A198 CarbonylContact O-C 3.22Å; F41-A198 WeakPolarHBondContact O-CA 3.32Å; V43-A198 HydrophobicContact CB-CB 3.9Å; V43-A198 HydrophobicContact CG1-CB 3.28Å; Y196-A198 VanDerWaalsContact C-N 3.35Å
199	H	91.2	Very high	93.3	Very high	61 Å²	61	25 Å²	25	28%	0.282	15%	0.147	S	C	.	.	S	Bend	trans	-89.9	-31.3	176.4	-63	74.7	0	0	0	111.1	F41 G197 N236	F41-H199 PolarHBondContact O-N 3.07Å; G197-H199 PolarHBondContact O-ND1 2.85Å; H199-N236 PolarHBondContact O-N 3.47Å
200	L	95.3	Very high	93.1	Very high	47 Å²	47	23.8 Å²	23.8	25%	0.246	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.6	-174.9	-63.3	172.2	0	0	0	109.9	F41 A42 V43 Y67 N236	F41-L200 PolarHBondContact O-N 3.36Å; A42-L200 WeakPolarHBondContact CA-O 3.22Å; A42-L200 HydrophobicContact CB-CB 4.21Å; V43-L200 PolarHBondContact N-O 3.28Å; V43-L200 VanDerWaalsContact N-O 3.1Å; Y67-L200 WeakPolarHBondContact OH-CD1 3.2Å; L200-N236 CarbonylContact C-O 3.56Å; L200-N236 WeakPolarHBondContact CA-O 3.5Å
201	V	95.9	Very high	93	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.024	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	94.4	-179	-175.9	0	0	0	0	108.1	V43 I193 V203 I211 P235 N236 L238	V43-V201 HydrophobicContact CG1-CG2 4.27Å; V43-V201 WeakPolarHBondContact O-CA 3.43Å; V43-V201 WeakPolarHBondContact O-CG1 3.49Å; I193-V201 HydrophobicContact CD1-CG1 4.26Å; I193-V201 HydrophobicContact CG1-CG1 4.2Å; I193-V201 HydrophobicContact CG1-CG2 4.3Å; I193-V201 HydrophobicContact CG2-CG2 3.6Å; V201-V203 HydrophobicContact CG1-CG1 3.77Å; V201-V203 PolarHBondContact O-N 2.76Å; V201-I211 HydrophobicContact CB-CD1 4.04Å; V201-I211 HydrophobicContact CG1-CD1 3.5Å; V201-I211 VanDerWaalsContact CG1-CD1 3.5Å; V201-I211 HydrophobicContact CG2-CD1 4.49Å; V201-P235 HydrophobicContact CG2-CB 3.85Å; V201-N236 PolarHBondContact N-O 2.84Å; V201-L238 PolarHBondContact O-N 2.87Å
202	P	94.5	Very high	92.9	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	112.2	177.5	-12.9	24.2	0	0	0	111.1	A42 V43 T44 F76 L238 F240	A42-P202 HydrophobicContact CB-CG 4.4Å; V43-P202 VanDerWaalsContact O-CD 3.24Å; V43-P202 WeakPolarHBondContact O-CD 3.31Å; T44-P202 WeakPolarHBondContact CB-O 3.45Å; T44-P202 PolarHBondContact OG1-O 3.48Å; F76-P202 HydrophobicContact CE2-CG 3.76Å; F76-P202 HydrophobicContact CZ-CG 4.34Å; P202-L238 WeakPolarHBondContact CA-O 3.48Å; P202-L238 HydrophobicContact CB-CD2 4.38Å; P202-L238 HydrophobicContact CG-CD2 4.16Å; P202-F240 HydrophobicContact CB-CE2 3.6Å; P202-F240 HydrophobicContact CB-CZ 3.68Å; P202-F240 HydrophobicContact CG-CZ 4.43Å
203	V	91.3	Very high	92.9	Very high	21 Å²	21	28.1 Å²	28.1	13%	0.127	16%	0.161	C	C	.	.			trans	-148.7	163.5	-176.8	-69	0	0	0	0	112.1	V201 Q207 I211 L238 I239	V201-V203 HydrophobicContact CG1-CG1 3.77Å; V201-V203 PolarHBondContact O-N 2.76Å; V203-Q207 HydrophobicContact CB-CB 3.82Å; V203-Q207 HydrophobicContact CB-CG 4.24Å; V203-Q207 HydrophobicContact CG1-CB 4.18Å; V203-Q207 HydrophobicContact CG2-CB 4Å; V203-I211 HydrophobicContact CG2-CG1 4.23Å; V203-L238 PolarHBondContact N-O 2.94Å; V203-L238 VanDerWaalsContact N-O 3.15Å; V203-I239 HydrophobicContact CG2-CD1 3.95Å; V203-I239 VanDerWaalsContact O-CD1 3.22Å; V203-I239 WeakPolarHBondContact O-CD1 3.24Å
204	G	85.3	Confident	92.9	Very high	24 Å²	24	27.7 Å²	27.7	25%	0.247	16%	0.159	C	C	.	.			trans	-72.6	160	166.3	0	0	0	0	0	112.5	D206 Q207	G204-D206 PolarHBondContact O-N 3.22Å; G204-D206 VanDerWaalsContact O-N 3.15Å; G204-Q207 PolarHBondContact O-N 2.93Å
205	A	84.9	Confident	92.9	Very high	67 Å²	67	30.4 Å²	30.4	55%	0.554	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-58.8	-26.5	179.2	0	0	0	0	0	113.4	Q207 I208	A205-Q207 PolarHBondContact O-N 3.34Å; A205-I208 HydrophobicContact CB-CD1 4.25Å; A205-I208 WeakPolarHBondContact O-CD1 3.39Å; A205-I208 VanDerWaalsContact O-CG1 3.31Å; A205-I208 WeakPolarHBondContact O-CG1 3.3Å; A205-I208 PolarHBondContact O-N 2.73Å
206	D	84.4	Confident	92.9	Very high	85 Å²	85	32.7 Å²	32.7	46%	0.455	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-66.9	-13.7	176.3	57.1	-69	0	0	0	114.2	G204 K254	G204-D206 PolarHBondContact O-N 3.22Å; G204-D206 VanDerWaalsContact O-N 3.15Å; D206-K254 IonicContact OD1-NZ 3Å
207	Q	90.7	Very high	93.1	Very high	49 Å²	49	32.9 Å²	32.9	23%	0.229	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-99	-1.6	-180	-60.1	-58	-40	0	0	113.6	V203 G204 A205 T209 H210 I211	V203-Q207 HydrophobicContact CB-CB 3.82Å; V203-Q207 HydrophobicContact CB-CG 4.24Å; V203-Q207 HydrophobicContact CG1-CB 4.18Å; V203-Q207 HydrophobicContact CG2-CB 4Å; G204-Q207 PolarHBondContact O-N 2.93Å; A205-Q207 PolarHBondContact O-N 3.34Å; Q207-T209 VanDerWaalsContact C-N 3.28Å; Q207-T209 PolarHBondContact O-N 3.21Å; Q207-H210 WeakPolarHBondContact O-CB 3.4Å; Q207-H210 PolarHBondContact O-N 2.88Å; Q207-H210 PolarHBondContact OE1-ND1 3.33Å; Q207-I211 PolarHBondContact O-N 2.72Å
208	I	92.6	Very high	93.5	Very high	61 Å²	61	32.9 Å²	32.9	31%	0.313	18%	0.181	S	C	.	.	H	α-helix	trans	-55.5	-43.6	-176.7	-70.5	171.1	0	0	0	111.4	A205 H210 I211 E212 I239	A205-I208 HydrophobicContact CB-CD1 4.25Å; A205-I208 WeakPolarHBondContact O-CD1 3.39Å; A205-I208 VanDerWaalsContact O-CG1 3.31Å; A205-I208 WeakPolarHBondContact O-CG1 3.3Å; A205-I208 PolarHBondContact O-N 2.73Å; I208-H210 VanDerWaalsContact C-N 3.26Å; I208-H210 PolarHBondContact O-N 3.32Å; I208-I211 WeakPolarHBondContact O-CB 3.4Å; I208-I211 PolarHBondContact O-N 3.02Å; I208-E212 HydrophobicContact CG2-CG 4.39Å; I208-E212 WeakPolarHBondContact O-CG 3.38Å; I208-E212 PolarHBondContact O-N 3.09Å; I208-I239 HydrophobicContact CD1-CD1 4.43Å; I208-I239 HydrophobicContact CG1-CD1 4.21Å
209	T	94.4	Very high	94	Very high	40 Å²	40	38.4 Å²	38.4	25%	0.245	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-34.4	178.8	-47.9	0	0	0	0	112.8	L147 Q207 E212 L213	L147-T209 HydrophobicContact CD2-CG2 3.83Å; Q207-T209 VanDerWaalsContact C-N 3.28Å; Q207-T209 PolarHBondContact O-N 3.21Å; T209-E212 PolarHBondContact O-N 2.78Å; T209-L213 PolarHBondContact O-N 2.95Å
210	H	94.6	Very high	94.3	Very high	6 Å²	6	38 Å²	38	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-72.4	-34.2	175.6	-64.9	120.6	0	0	0	112.3	Q149 Y185 Q189 Q207 I208 L213 A214	Q149-H210 PolarHBondContact NE2-CE1 3.25Å; Q149-H210 VanDerWaalsContact NE2-CE1 3.29Å; Y185-H210 AromaticContact CE2-NE2 3.97Å; Y185-H210 AromaticContact CZ-NE2 3.77Å; Y185-H210 PolarHBondContact OH-CE1 2.84Å; Y185-H210 PolarHBondContact OH-NE2 3.1Å; Q189-H210 VanDerWaalsContact NE2-CB 3.32Å; Q207-H210 WeakPolarHBondContact O-CB 3.4Å; Q207-H210 PolarHBondContact O-N 2.88Å; Q207-H210 PolarHBondContact OE1-ND1 3.33Å; I208-H210 VanDerWaalsContact C-N 3.26Å; I208-H210 PolarHBondContact O-N 3.32Å; H210-L213 WeakPolarHBondContact O-CB 3.45Å; H210-L213 PolarHBondContact O-N 2.82Å; H210-A214 PolarHBondContact O-N 3.32Å
211	I	96.2	Very high	94.5	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-40.3	173.7	-53.9	-51.5	0	0	0	110.6	I193 V201 V203 Q207 I208 L213 A214 R215 P235	I193-I211 HydrophobicContact CD1-CD1 3.51Å; V201-I211 HydrophobicContact CB-CD1 4.04Å; V201-I211 HydrophobicContact CG1-CD1 3.5Å; V201-I211 VanDerWaalsContact CG1-CD1 3.5Å; V201-I211 HydrophobicContact CG2-CD1 4.49Å; V203-I211 HydrophobicContact CG2-CG1 4.23Å; Q207-I211 PolarHBondContact O-N 2.72Å; I208-I211 WeakPolarHBondContact O-CB 3.4Å; I208-I211 PolarHBondContact O-N 3.02Å; I211-L213 VanDerWaalsContact C-N 3.32Å; I211-L213 PolarHBondContact O-N 3.19Å; I211-A214 PolarHBondContact O-N 3.22Å; I211-R215 WeakPolarHBondContact O-CG 3.4Å; I211-R215 PolarHBondContact O-N 2.98Å; I211-P235 HydrophobicContact CG2-CG 4.46Å
212	E	96.5	Very high	94.6	Very high	98 Å²	98	37.3 Å²	37.3	46%	0.458	20%	0.203	S	C	.	.	H	α-helix	trans	-59.9	-42.7	172.8	-70	175.9	164.4	0	0	111.7	I208 T209 A214 R215 D216	I208-E212 HydrophobicContact CG2-CG 4.39Å; I208-E212 WeakPolarHBondContact O-CG 3.38Å; I208-E212 PolarHBondContact O-N 3.09Å; T209-E212 PolarHBondContact O-N 2.78Å; E212-A214 PolarHBondContact O-N 3.03Å; E212-R215 WeakPolarHBondContact O-CB 3.31Å; E212-R215 PolarHBondContact O-N 3.2Å; E212-D216 VanDerWaalsContact O-CG 3.32Å; E212-D216 PolarHBondContact O-N 2.89Å
213	L	97.5	Very high	94.8	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-59.4	-46.6	173.7	178.5	67.9	0	0	0	111.7	R143 L144 L147 P186 T209 H210 I211 R215 D216 L217	R143-L213 HydrophobicContact CG-CD1 3.65Å; L144-L213 HydrophobicContact CD2-CD2 4.03Å; L147-L213 HydrophobicContact CD1-CD2 3.96Å; P186-L213 HydrophobicContact CB-CD2 3.33Å; T209-L213 PolarHBondContact O-N 2.95Å; H210-L213 WeakPolarHBondContact O-CB 3.45Å; H210-L213 PolarHBondContact O-N 2.82Å; I211-L213 VanDerWaalsContact C-N 3.32Å; I211-L213 PolarHBondContact O-N 3.19Å; L213-R215 PolarHBondContact O-N 3.01Å; L213-D216 WeakPolarHBondContact O-CB 3.34Å; L213-D216 PolarHBondContact O-N 3.21Å; L213-D216 VanDerWaalsContact O-N 3.13Å; L213-L217 HydrophobicContact CD1-CD1 4.38Å; L213-L217 HydrophobicContact CD1-CG 4.26Å; L213-L217 HydrophobicContact CG-CD1 4.04Å; L213-L217 HydrophobicContact CG-CG 4.33Å; L213-L217 VanDerWaalsContact O-CG 3.31Å; L213-L217 WeakPolarHBondContact O-CG 3.36Å; L213-L217 PolarHBondContact O-N 3.5Å
214	A	97.7	Very high	95.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.7	-40.1	177.5	0	0	0	0	0	111.6	A190 I193 H210 I211 E212 L217 V218 P235	A190-A214 HydrophobicContact CB-CB 3.84Å; I193-A214 HydrophobicContact CD1-CB 4.27Å; H210-A214 PolarHBondContact O-N 3.32Å; I211-A214 PolarHBondContact O-N 3.22Å; E212-A214 PolarHBondContact O-N 3.03Å; A214-L217 PolarHBondContact O-N 2.92Å; A214-V218 WeakPolarHBondContact O-CG2 3.35Å; A214-V218 PolarHBondContact O-N 3.26Å; A214-P235 HydrophobicContact CB-CG 4.1Å
215	R	98	Very high	95.7	Very high	60 Å²	60	50.7 Å²	50.7	23%	0.226	25%	0.254	C	S	.	.	H	α-helix	trans	-65.6	-42.7	175.1	-66.1	167.9	69	83.8	-1.5	112.3	I211 E212 L213 L217 V218 R219 L234 P235 N236	I211-R215 WeakPolarHBondContact O-CG 3.4Å; I211-R215 PolarHBondContact O-N 2.98Å; E212-R215 WeakPolarHBondContact O-CB 3.31Å; E212-R215 PolarHBondContact O-N 3.2Å; L213-R215 PolarHBondContact O-N 3.01Å; R215-L217 VanDerWaalsContact C-N 3.31Å; R215-L217 PolarHBondContact O-N 3.26Å; R215-V218 PolarHBondContact O-N 2.77Å; R215-R219 WeakPolarHBondContact O-CG 3.21Å; R215-R219 PolarHBondContact O-N 3.01Å; R215-R219 VanDerWaalsContact O-N 3.15Å; R215-L234 HydrophobicContact CB-CD2 4.03Å; R215-L234 HydrophobicContact CG-CD2 4.32Å; R215-P235 WeakPolarHBondContact CD-O 3.24Å; R215-P235 HydrophobicContact CG-CG 4.03Å; R215-P235 PolarHBondContact NH1-O 2.89Å; R215-N236 PolarHBondContact NH1-OD1 2.84Å
216	D	97.9	Very high	96.4	Very high	49 Å²	49	51.7 Å²	51.7	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-42.7	175	-68.3	-19	0	0	0	111.1	R143 E212 L213 V218 R219 S220	R143-D216 IonicContact CZ-OD2 2.67Å; R143-D216 IonicContact NE-OD2 3.4Å; R143-D216 PolarHBondContact NE-OD2 3.24Å; R143-D216 VanDerWaalsContact NE-OD2 3.13Å; R143-D216 IonicContact NH2-OD2 3.81Å; R143-D216 PolarHBondContact NH2-OD2 3.48Å; E212-D216 VanDerWaalsContact O-CG 3.32Å; E212-D216 PolarHBondContact O-N 2.89Å; L213-D216 WeakPolarHBondContact O-CB 3.34Å; L213-D216 PolarHBondContact O-N 3.21Å; L213-D216 VanDerWaalsContact O-N 3.13Å; D216-V218 PolarHBondContact O-N 3.25Å; D216-R219 WeakPolarHBondContact O-CB 3.45Å; D216-R219 PolarHBondContact O-N 3.22Å; D216-R219 VanDerWaalsContact O-N 3.13Å; D216-R219 IonicContact OD1-NH1 2.71Å; D216-R219 PolarHBondContact OD1-NH1 3.5Å; D216-S220 PolarHBondContact O-N 3.49Å; D216-S220 PolarHBondContact O-OG 3.04Å
217	L	98.4	Very high	97	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-37.8	178.4	-69	175.1	0	0	0	112.7	L135 V138 C139 T187 A190 L213 A214 R215 R219 S220 A221	L135-L217 HydrophobicContact CB-CD1 4.44Å; L135-L217 HydrophobicContact CD2-CB 4.34Å; V138-L217 HydrophobicContact CG2-CD2 4.34Å; C139-L217 HydrophobicContact CB-CD2 3.47Å; C139-L217 VanDerWaalsContact CB-CD2 3.47Å; T187-L217 HydrophobicContact CG2-CD1 4.44Å; A190-L217 HydrophobicContact CB-CD1 3.58Å; L213-L217 HydrophobicContact CD1-CD1 4.38Å; L213-L217 HydrophobicContact CD1-CG 4.26Å; L213-L217 HydrophobicContact CG-CD1 4.04Å; L213-L217 HydrophobicContact CG-CG 4.33Å; L213-L217 VanDerWaalsContact O-CG 3.31Å; L213-L217 WeakPolarHBondContact O-CG 3.36Å; L213-L217 PolarHBondContact O-N 3.5Å; A214-L217 PolarHBondContact O-N 2.92Å; R215-L217 VanDerWaalsContact C-N 3.31Å; R215-L217 PolarHBondContact O-N 3.26Å; L217-R219 VanDerWaalsContact C-N 3.34Å; L217-S220 PolarHBondContact O-N 3.02Å; L217-A221 WeakPolarHBondContact O-CB 3.42Å; L217-A221 PolarHBondContact O-N 3.23Å
218	V	98.3	Very high	97.3	Very high	6 Å²	6	48.9 Å²	48.9	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-59	-46.6	170.5	171.8	0	0	0	0	110.6	L194 A214 R215 D216 A221 V222 L232 L234	L194-V218 HydrophobicContact CD1-CG2 3.58Å; L194-V218 HydrophobicContact CD2-CG2 3.42Å; L194-V218 VanDerWaalsContact CD2-CG2 3.42Å; L194-V218 HydrophobicContact CG-CG2 4.16Å; A214-V218 WeakPolarHBondContact O-CG2 3.35Å; A214-V218 PolarHBondContact O-N 3.26Å; R215-V218 PolarHBondContact O-N 2.77Å; D216-V218 PolarHBondContact O-N 3.25Å; V218-A221 PolarHBondContact O-N 3.1Å; V218-V222 HydrophobicContact CG1-CG2 4.3Å; V218-V222 WeakPolarHBondContact O-CB 3.35Å; V218-V222 VanDerWaalsContact O-CG2 3.27Å; V218-V222 WeakPolarHBondContact O-CG2 3.46Å; V218-V222 PolarHBondContact O-N 2.99Å; V218-L232 HydrophobicContact CG1-CB 4.05Å; V218-L232 HydrophobicContact CG2-CB 4.33Å; V218-L234 HydrophobicContact CB-CD2 3.81Å; V218-L234 HydrophobicContact CG1-CD2 3.75Å; V218-L234 HydrophobicContact CG1-CG 4.45Å; V218-L234 HydrophobicContact CG2-CD2 4.5Å
219	R	98.2	Very high	97.5	Very high	119 Å²	119	49.5 Å²	49.5	45%	0.449	26%	0.257	S	S	.	.	H	α-helix	trans	-62.8	-45.1	179.2	-64.7	177.7	-165.9	116.8	-5.9	111.8	R215 D216 L217 V222 H223 L234	R215-R219 WeakPolarHBondContact O-CG 3.21Å; R215-R219 PolarHBondContact O-N 3.01Å; R215-R219 VanDerWaalsContact O-N 3.15Å; D216-R219 WeakPolarHBondContact O-CB 3.45Å; D216-R219 PolarHBondContact O-N 3.22Å; D216-R219 VanDerWaalsContact O-N 3.13Å; D216-R219 IonicContact OD1-NH1 2.71Å; D216-R219 PolarHBondContact OD1-NH1 3.5Å; L217-R219 VanDerWaalsContact C-N 3.34Å; R219-V222 PolarHBondContact O-N 3.42Å; R219-H223 VanDerWaalsContact O-CB 3.29Å; R219-H223 WeakPolarHBondContact O-CB 3.33Å; R219-H223 PolarHBondContact O-N 3.47Å; R219-L234 HydrophobicContact CG-CD2 4.41Å
220	S	98.4	Very high	97.5	Very high	51 Å²	51	52 Å²	52	36%	0.357	28%	0.276	S	S	.	.	H	α-helix	trans	-63.5	-42.5	177.2	-62.7	0	0	0	0	112	D216 L217 H223 K224	D216-S220 PolarHBondContact O-N 3.49Å; D216-S220 PolarHBondContact O-OG 3.04Å; L217-S220 PolarHBondContact O-N 3.02Å; S220-H223 PolarHBondContact O-N 3.45Å; S220-K224 PolarHBondContact O-N 2.68Å
221	A	98.5	Very high	97.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-45.5	176.9	0	0	0	0	0	111.6	V138 L217 V218 K224 W225 L228 L232	V138-A221 HydrophobicContact CG2-CB 4.13Å; L217-A221 WeakPolarHBondContact O-CB 3.42Å; L217-A221 PolarHBondContact O-N 3.23Å; V218-A221 PolarHBondContact O-N 3.1Å; A221-K224 PolarHBondContact O-N 3.16Å; A221-W225 HydrophobicContact CB-CE3 4.42Å; A221-W225 WeakPolarHBondContact O-CA 3.21Å; A221-W225 PolarHBondContact O-N 3.19Å; A221-L228 HydrophobicContact CB-CD1 3.96Å; A221-L232 HydrophobicContact CB-CD1 4.18Å
222	V	98.4	Very high	97.6	Very high	38 Å²	38	52.7 Å²	52.7	23%	0.23	28%	0.28	C	S	.	.	H	α-helix	trans	-67.5	-36.1	177.4	171.6	0	0	0	0	111.6	V218 R219 K224 W225 P226 L228	V218-V222 HydrophobicContact CG1-CG2 4.3Å; V218-V222 WeakPolarHBondContact O-CB 3.35Å; V218-V222 VanDerWaalsContact O-CG2 3.27Å; V218-V222 WeakPolarHBondContact O-CG2 3.46Å; V218-V222 PolarHBondContact O-N 2.99Å; R219-V222 PolarHBondContact O-N 3.42Å; V222-K224 VanDerWaalsContact C-N 3.35Å; V222-W225 CarbonylContact O-C 3.22Å; V222-W225 VanDerWaalsContact O-C 3.22Å; V222-P226 VanDerWaalsContact O-CA 3.23Å; V222-P226 WeakPolarHBondContact O-CA 3.41Å; V222-P226 VanDerWaalsContact O-N 3.13Å; V222-L228 HydrophobicContact CG2-CB 4.19Å
223	H	98.2	Very high	97.4	Very high	169 Å²	169	51.6 Å²	51.6	78%	0.782	27%	0.274	S	S	*	.	H	α-helix	trans	-61.9	-43.3	174.1	-180	71.4	0	0	0	111.8	R219 S220	R219-H223 VanDerWaalsContact O-CB 3.29Å; R219-H223 WeakPolarHBondContact O-CB 3.33Å; R219-H223 PolarHBondContact O-N 3.47Å; S220-H223 PolarHBondContact O-N 3.45Å
224	K	98.3	Very high	97.3	Very high	105 Å²	105	54.8 Å²	54.8	46%	0.457	29%	0.291	S	S	.	.	H	α-helix	trans	-74	-38.9	177.5	-171.7	176.9	-178.8	-176.5	0	112.8	S137 V138 S220 A221 V222	S137-K224 PolarHBondContact O-NZ 2.89Å; S137-K224 VanDerWaalsContact O-NZ 3.15Å; V138-K224 HydrophobicContact CG1-CB 4.26Å; V138-K224 HydrophobicContact CG1-CD 3.45Å; V138-K224 VanDerWaalsContact CG1-CD 3.45Å; S220-K224 PolarHBondContact O-N 2.68Å; A221-K224 PolarHBondContact O-N 3.16Å; V222-K224 VanDerWaalsContact C-N 3.35Å
225	W	98.3	Very high	97.2	Very high	53 Å²	53	54.8 Å²	54.8	20%	0.201	29%	0.291	C	S	.	.			trans	-131.1	86	-177.8	-57	-66.3	0	0	0	110.7	I134 S137 V138 A221 V222 S227 L228 I389	I134-W225 HydrophobicContact CG2-CH2 3.98Å; I134-W225 HydrophobicContact CG2-CZ3 3.74Å; S137-W225 VanDerWaalsContact OG-CH2 3.28Å; S137-W225 WeakPolarHBondContact OG-CH2 3.43Å; V138-W225 HydrophobicContact CG1-CE3 4.34Å; V138-W225 HydrophobicContact CG1-CH2 4.12Å; V138-W225 HydrophobicContact CG1-CZ3 3.69Å; A221-W225 HydrophobicContact CB-CE3 4.42Å; A221-W225 WeakPolarHBondContact O-CA 3.21Å; A221-W225 PolarHBondContact O-N 3.19Å; V222-W225 CarbonylContact O-C 3.22Å; V222-W225 VanDerWaalsContact O-C 3.22Å; W225-S227 PolarHBondContact O-N 3.3Å; W225-L228 HydrophobicContact CB-CD1 3.87Å; W225-L228 HydrophobicContact CB-CG 4.04Å; W225-L228 HydrophobicContact CD2-CD1 4.35Å; W225-L228 HydrophobicContact CE3-CD1 3.71Å; W225-L228 HydrophobicContact CG-CD1 4.48Å; W225-L228 WeakPolarHBondContact O-CB 3.35Å; W225-L228 PolarHBondContact O-N 2.88Å; W225-I389 HydrophobicContact CB-CG2 4.1Å; W225-I389 HydrophobicContact CD2-CB 4.07Å; W225-I389 HydrophobicContact CD2-CG2 3.53Å; W225-I389 HydrophobicContact CE3-CG2 3.77Å; W225-I389 HydrophobicContact CG-CB 4.15Å; W225-I389 HydrophobicContact CG-CG2 3.71Å; W225-I389 HydrophobicContact CZ2-CB 4.4Å; W225-I389 HydrophobicContact CZ2-CG2 4.42Å; W225-I389 HydrophobicContact CZ3-CG2 4.28Å
226	P	98.3	Very high	97.1	Very high	88 Å²	88	55.7 Å²	55.7	57%	0.571	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-54.6	-30.6	-175.4	-30.6	37.1	0	0	0	115.2	V222 L228 S229	V222-P226 VanDerWaalsContact O-CA 3.23Å; V222-P226 WeakPolarHBondContact O-CA 3.41Å; V222-P226 VanDerWaalsContact O-N 3.13Å; P226-L228 PolarHBondContact O-N 3.11Å; P226-L228 VanDerWaalsContact O-N 3.17Å; P226-S229 VanDerWaalsContact O-CB 3.3Å; P226-S229 WeakPolarHBondContact O-CB 3.46Å; P226-S229 PolarHBondContact O-N 3.28Å; P226-S229 VanDerWaalsContact O-N 3.1Å; P226-S229 PolarHBondContact O-OG 2.8Å
227	S	97.6	Very high	96.9	Very high	74 Å²	74	55.8 Å²	55.8	52%	0.517	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-59.9	-23.1	177.2	-56.1	0	0	0	0	113.9	W225 S229 S230	W225-S227 PolarHBondContact O-N 3.3Å; S227-S229 PolarHBondContact O-N 3.5Å; S227-S230 PolarHBondContact O-OG 3.02Å
228	L	98	Very high	96.7	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-69.7	-15.4	176.5	-70	177.4	0	0	0	113.8	A221 V222 W225 P226 S230 I231 L232 I385 A388 I389	A221-L228 HydrophobicContact CB-CD1 3.96Å; V222-L228 HydrophobicContact CG2-CB 4.19Å; W225-L228 HydrophobicContact CB-CD1 3.87Å; W225-L228 HydrophobicContact CB-CG 4.04Å; W225-L228 HydrophobicContact CD2-CD1 4.35Å; W225-L228 HydrophobicContact CE3-CD1 3.71Å; W225-L228 HydrophobicContact CG-CD1 4.48Å; W225-L228 WeakPolarHBondContact O-CB 3.35Å; W225-L228 PolarHBondContact O-N 2.88Å; P226-L228 PolarHBondContact O-N 3.11Å; P226-L228 VanDerWaalsContact O-N 3.17Å; L228-S230 PolarHBondContact O-N 3.41Å; L228-S230 VanDerWaalsContact O-N 3.13Å; L228-I231 HydrophobicContact CD2-CD1 4.31Å; L228-I231 PolarHBondContact O-N 3.45Å; L228-L232 HydrophobicContact CB-CD1 4.25Å; L228-L232 HydrophobicContact CB-CG 4.41Å; L228-L232 HydrophobicContact CD1-CD1 4.04Å; L228-L232 PolarHBondContact O-N 2.99Å; L228-I385 HydrophobicContact CD2-CB 4.34Å; L228-I385 HydrophobicContact CD2-CG1 4.28Å; L228-I385 HydrophobicContact CD2-CG2 4.04Å; L228-A388 HydrophobicContact CD2-CB 3.67Å; L228-A388 HydrophobicContact CG-CB 4.23Å; L228-I389 HydrophobicContact CD1-CG2 3.85Å; L228-I389 HydrophobicContact CD2-CG2 4.08Å; L228-I389 HydrophobicContact CG-CG2 4.1Å
229	S	96.9	Very high	96.3	Very high	74 Å²	74	60.8 Å²	60.8	52%	0.517	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-56.4	-29.2	-178.5	55.3	0	0	0	0	113.9	P226 S227	P226-S229 VanDerWaalsContact O-CB 3.3Å; P226-S229 WeakPolarHBondContact O-CB 3.46Å; P226-S229 PolarHBondContact O-N 3.28Å; P226-S229 VanDerWaalsContact O-N 3.1Å; P226-S229 PolarHBondContact O-OG 2.8Å; S227-S229 PolarHBondContact O-N 3.5Å
230	S	94.3	Very high	95.9	Very high	93 Å²	93	57.1 Å²	57.1	65%	0.65	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-85.5	-8.3	177.3	63.6	0	0	0	0	114.2	S227 L228	S227-S230 PolarHBondContact O-OG 3.02Å; L228-S230 PolarHBondContact O-N 3.41Å; L228-S230 VanDerWaalsContact O-N 3.13Å
231	I	95.4	Very high	95.3	Very high	16 Å²	16	62.6 Å²	62.6	8%	0.082	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-40.4	-170.3	-57.6	161.8	0	0	0	111.8	L228 R381 L384 I385 A388	L228-I231 HydrophobicContact CD2-CD1 4.31Å; L228-I231 PolarHBondContact O-N 3.45Å; I231-R381 PolarHBondContact O-NH1 3.11Å; I231-R381 PolarHBondContact O-NH2 3.4Å; I231-L384 HydrophobicContact CD1-CB 3.88Å; I231-L384 WeakPolarHBondContact CD1-O 3.34Å; I231-L384 HydrophobicContact CG1-CB 4.26Å; I231-L384 HydrophobicContact CG2-CB 4.37Å; I231-I385 HydrophobicContact CG2-CD1 4.41Å; I231-I385 HydrophobicContact CG2-CG1 3.7Å; I231-A388 HydrophobicContact CD1-CB 3.64Å
232	L	96.2	Very high	94.6	Very high	8 Å²	8	64.1 Å²	64.1	4%	0.042	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-99	118.4	-179.5	-62.2	-176	0	0	0	110.4	L194 V218 A221 L228 I385	L194-L232 HydrophobicContact CB-CD2 4.41Å; V218-L232 HydrophobicContact CG1-CB 4.05Å; V218-L232 HydrophobicContact CG2-CB 4.33Å; A221-L232 HydrophobicContact CB-CD1 4.18Å; L228-L232 HydrophobicContact CB-CD1 4.25Å; L228-L232 HydrophobicContact CB-CG 4.41Å; L228-L232 HydrophobicContact CD1-CD1 4.04Å; L228-L232 PolarHBondContact O-N 2.99Å; L232-I385 HydrophobicContact CD2-CD1 4.13Å
233	H	92.4	Very high	94	Very high	74 Å²	74	64 Å²	64	34%	0.343	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-100.5	151.5	177	-53.6	-68	0	0	0	110.5	L194 P235	L194-H233 WeakPolarHBondContact CD2-O 3.19Å; H233-P235 VanDerWaalsContact O-CD 3.3Å; H233-P235 WeakPolarHBondContact O-CD 3.36Å
234	L	95.7	Very high	93.6	Very high	68 Å²	68	61.7 Å²	61.7	36%	0.356	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-75.1	117.6	174.1	-67	176.7	0	0	0	109.8	R215 V218 R219	R215-L234 HydrophobicContact CB-CD2 4.03Å; R215-L234 HydrophobicContact CG-CD2 4.32Å; V218-L234 HydrophobicContact CB-CD2 3.81Å; V218-L234 HydrophobicContact CG1-CD2 3.75Å; V218-L234 HydrophobicContact CG1-CG 4.45Å; V218-L234 HydrophobicContact CG2-CD2 4.5Å; R219-L234 HydrophobicContact CG-CD2 4.41Å
235	P	95.4	Very high	93.4	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-72.7	147.1	178.3	29.9	-35.3	0	0	0	110.7	I193 L194 V201 I211 A214 R215 H233	I193-P235 HydrophobicContact CG2-CB 3.48Å; I193-P235 VanDerWaalsContact CG2-CB 3.48Å; I193-P235 HydrophobicContact CG2-CG 3.74Å; L194-P235 HydrophobicContact CD2-CG 4.27Å; V201-P235 HydrophobicContact CG2-CB 3.85Å; I211-P235 HydrophobicContact CG2-CG 4.46Å; A214-P235 HydrophobicContact CB-CG 4.1Å; R215-P235 WeakPolarHBondContact CD-O 3.24Å; R215-P235 HydrophobicContact CG-CG 4.03Å; R215-P235 PolarHBondContact NH1-O 2.89Å; H233-P235 VanDerWaalsContact O-CD 3.3Å; H233-P235 WeakPolarHBondContact O-CD 3.36Å
236	N	95.4	Very high	93.3	Very high	80 Å²	80	55 Å²	55	43%	0.428	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.9	171.3	-58.3	-60.5	0	0	0	109.9	H199 L200 V201 R215	H199-N236 PolarHBondContact O-N 3.47Å; L200-N236 CarbonylContact C-O 3.56Å; L200-N236 WeakPolarHBondContact CA-O 3.5Å; V201-N236 PolarHBondContact N-O 2.84Å; R215-N236 PolarHBondContact NH1-OD1 2.84Å
237	S	94.5	Very high	93.2	Very high	50 Å²	50	51 Å²	51	35%	0.35	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	138.8	172.4	48.5	0	0	0	0	110.2
238	L	93.7	Very high	93.2	Very high	40 Å²	40	47.6 Å²	47.6	21%	0.209	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	101.5	166.2	176.1	64.6	0	0	0	107.2	Y67 V201 P202 V203 F240	Y67-L238 HydrophobicContact CD1-CD2 4.41Å; Y67-L238 HydrophobicContact CD2-CD2 3.72Å; Y67-L238 HydrophobicContact CE1-CD2 4.16Å; Y67-L238 HydrophobicContact CE2-CD2 3.41Å; Y67-L238 VanDerWaalsContact CE2-CD2 3.41Å; Y67-L238 HydrophobicContact CG-CD2 4.21Å; V201-L238 PolarHBondContact O-N 2.87Å; P202-L238 WeakPolarHBondContact CA-O 3.48Å; P202-L238 HydrophobicContact CB-CD2 4.38Å; P202-L238 HydrophobicContact CG-CD2 4.16Å; V203-L238 PolarHBondContact N-O 2.94Å; V203-L238 VanDerWaalsContact N-O 3.15Å; L238-F240 HydrophobicContact CD2-CE1 3.78Å; L238-F240 HydrophobicContact CD2-CZ 4.02Å; L238-F240 HydrophobicContact CG-CE1 4.04Å; L238-F240 HydrophobicContact CG-CZ 4.42Å
239	I	91.4	Very high	93.1	Very high	75 Å²	75	49.8 Å²	49.8	39%	0.385	28%	0.279	S	S	.	.			trans	-93.7	116.8	178	-52.4	-56.8	0	0	0	107.9	V203 I208	V203-I239 HydrophobicContact CG2-CD1 3.95Å; V203-I239 VanDerWaalsContact O-CD1 3.22Å; V203-I239 WeakPolarHBondContact O-CD1 3.24Å; I208-I239 HydrophobicContact CD1-CD1 4.43Å; I208-I239 HydrophobicContact CG1-CD1 4.21Å
240	F	88.5	Confident	93	Very high	43 Å²	43	49.7 Å²	49.7	19%	0.189	27%	0.273	C	S	.	.			trans	-73.2	145.7	172.5	-58.7	-59.7	0	0	0	110.3	P63 Y67 P202 L238 A242	P63-F240 HydrophobicContact CB-CB 3.96Å; P63-F240 HydrophobicContact CB-CD1 4.11Å; P63-F240 HydrophobicContact CB-CD2 3.4Å; P63-F240 VanDerWaalsContact CB-CD2 3.4Å; P63-F240 HydrophobicContact CB-CE1 4.47Å; P63-F240 HydrophobicContact CB-CE2 3.81Å; P63-F240 HydrophobicContact CB-CG 3.55Å; P63-F240 HydrophobicContact CB-CZ 4.32Å; P63-F240 HydrophobicContact CG-CD2 4.39Å; Y67-F240 HydrophobicContact CD2-CE1 4.16Å; Y67-F240 HydrophobicContact CG-CE1 4.07Å; Y67-F240 HydrophobicContact CG-CZ 4.19Å; P202-F240 HydrophobicContact CB-CE2 3.6Å; P202-F240 HydrophobicContact CB-CZ 3.68Å; P202-F240 HydrophobicContact CG-CZ 4.43Å; L238-F240 HydrophobicContact CD2-CE1 3.78Å; L238-F240 HydrophobicContact CD2-CZ 4.02Å; L238-F240 HydrophobicContact CG-CE1 4.04Å; L238-F240 HydrophobicContact CG-CZ 4.42Å; F240-A242 HydrophobicContact CB-CB 4.17Å; F240-A242 PolarHBondContact O-N 2.82Å
241	N	85.6	Confident	93	Very high	166 Å²	166	45.5 Å²	45.5	89%	0.888	24%	0.244	S	C	*	.			trans	-74.5	57.5	167.1	-168.9	30	0	0	0	110.2
242	A	84.8	Confident	92.9	Very high	31 Å²	31	50.3 Å²	50.3	26%	0.256	27%	0.27	S	S	.	.			trans	-94.3	138.7	-178.3	0	0	0	0	0	110	P63 F240	P63-A242 HydrophobicContact CG-CB 4.05Å; F240-A242 HydrophobicContact CB-CB 4.17Å; F240-A242 PolarHBondContact O-N 2.82Å
243	P	85	Confident	92.8	Very high	36 Å²	36	54.3 Å²	54.3	23%	0.234	29%	0.287	C	S	.	.			trans	-70	138.6	-177.6	18.9	-20.8	0	0	0	111.7	I245 R305 A309	P243-I245 HydrophobicContact CB-CD1 4.08Å; P243-I245 HydrophobicContact CG-CD1 4.11Å; P243-I245 PolarHBondContact O-N 3.34Å; P243-I245 VanDerWaalsContact O-N 3.16Å; P243-R305 HydrophobicContact CB-CB 3.94Å; P243-R305 HydrophobicContact CB-CG 4.18Å; P243-A309 HydrophobicContact CG-CB 3.58Å
244	K	89.5	Confident	92.8	Very high	120 Å²	120	56 Å²	56	52%	0.522	29%	0.293	S	S	.	.			trans	-71.1	109.3	167.8	-173.2	-177.3	175.5	-179.5	0	109.2
245	I	94.5	Very high	92.7	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.031	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-86.9	120.3	175.7	-49.3	-52.2	0	0	0	109.7	L54 L58 P243 M255 I306	L54-I245 HydrophobicContact CD2-CG2 4.33Å; L54-I245 HydrophobicContact CG-CG2 4.46Å; L58-I245 HydrophobicContact CB-CD1 4.49Å; L58-I245 HydrophobicContact CB-CG1 4.16Å; L58-I245 HydrophobicContact CD1-CD1 3.79Å; L58-I245 HydrophobicContact CD1-CG1 3.98Å; P243-I245 HydrophobicContact CB-CD1 4.08Å; P243-I245 HydrophobicContact CG-CD1 4.11Å; P243-I245 PolarHBondContact O-N 3.34Å; P243-I245 VanDerWaalsContact O-N 3.16Å; I245-M255 HydrophobicContact CG2-CE 3.93Å; I245-M255 PolarHBondContact O-N 2.9Å; I245-I306 HydrophobicContact CD1-CG1 3.9Å; I245-I306 HydrophobicContact CG2-CD1 4.19Å; I245-I306 HydrophobicContact CG2-CG1 4.12Å
246	N	95.9	Very high	92.4	Very high	13 Å²	13	54.3 Å²	54.3	7%	0.07	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	162	-179.4	-68.1	-8.9	0	0	0	111.1	P251 K253 N302	N246-P251 WeakPolarHBondContact CB-O 3.23Å; N246-P251 PolarHBondContact ND2-O 3.23Å; N246-K253 CarbonylContact C-O 3.46Å; N246-K253 VanDerWaalsContact CA-O 3.24Å; N246-K253 WeakPolarHBondContact CA-O 3.39Å; N246-K253 WeakPolarHBondContact CB-O 3.49Å; N246-N302 PolarHBondContact N-OD1 3.5Å; N246-N302 PolarHBondContact O-ND2 2.96Å
247	N	97.2	Very high	91.8	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	134.6	176.8	179.3	-56.6	0	0	0	109.8	T249 N250 P251 K253 D259 G264	N247-T249 VanDerWaalsContact C-N 3.3Å; N247-T249 PolarHBondContact O-N 2.79Å; N247-T249 PolarHBondContact OD1-N 3.17Å; N247-T249 PolarHBondContact OD1-OG1 2.83Å; N247-N250 CarbonylContact O-C 3.54Å; N247-N250 VanDerWaalsContact O-C 3.22Å; N247-N250 PolarHBondContact O-N 2.89Å; N247-N250 PolarHBondContact OD1-N 3.09Å; N247-N250 VanDerWaalsContact OD1-N 3.07Å; N247-P251 WeakPolarHBondContact O-CA 3.43Å; N247-K253 PolarHBondContact N-O 3.23Å; N247-D259 PolarHBondContact ND2-OD2 3.32Å; N247-G264 WeakPolarHBondContact CA-O 3.39Å; N247-G264 WeakPolarHBondContact OD1-CA 3.49Å
248	L	97.6	Very high	91.1	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-30.1	-175.3	-63.8	179.7	0	0	0	113.5	M255 G264 I266 K278 I279 A282 E283 L303 I306	L248-M255 HydrophobicContact CG-CE 4.48Å; L248-G264 PolarHBondContact N-O 3.38Å; L248-I266 HydrophobicContact CD1-CD1 3.72Å; L248-I266 HydrophobicContact CD1-CG1 3.78Å; L248-K278 HydrophobicContact CD1-CB 4.05Å; L248-I279 HydrophobicContact CD1-CD1 3.93Å; L248-I279 HydrophobicContact CD2-CD1 4.05Å; L248-A282 HydrophobicContact CB-CB 3.94Å; L248-A282 HydrophobicContact CD2-CB 4.14Å; L248-A282 HydrophobicContact CG-CB 4.47Å; L248-A282 CarbonylContact O-C 3.56Å; L248-A282 VanDerWaalsContact O-CA 3.27Å; L248-A282 WeakPolarHBondContact O-CA 3.4Å; L248-E283 PolarHBondContact O-N 2.95Å; L248-L303 HydrophobicContact CD2-CD2 4.4Å; L248-I306 HydrophobicContact CD2-CD1 4.18Å
249	T	96	Very high	90.5	Very high	46 Å²	46	54.3 Å²	54.3	28%	0.282	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	1	-179	56.6	0	0	0	0	113.2	N247 L263 E283	N247-T249 VanDerWaalsContact C-N 3.3Å; N247-T249 PolarHBondContact O-N 2.79Å; N247-T249 PolarHBondContact OD1-N 3.17Å; N247-T249 PolarHBondContact OD1-OG1 2.83Å; T249-L263 HydrophobicContact CG2-CB 4.04Å; T249-E283 VanDerWaalsContact O-OE2 3.04Å
250	N	94.9	Very high	89.9	Confident	72 Å²	72	58.2 Å²	58.2	39%	0.385	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	82.8	169.3	-177.6	-13.4	0	0	0	107.9	N247 N252 K253	N247-N250 CarbonylContact O-C 3.54Å; N247-N250 VanDerWaalsContact O-C 3.22Å; N247-N250 PolarHBondContact O-N 2.89Å; N247-N250 PolarHBondContact OD1-N 3.09Å; N247-N250 VanDerWaalsContact OD1-N 3.07Å; N250-N252 PolarHBondContact O-N 3.21Å; N250-N252 PolarHBondContact OD1-N 3.33Å; N250-K253 HydrophobicContact CB-CB 4.44Å; N250-K253 PolarHBondContact O-N 3.02Å
251	P	94.3	Very high	89.9	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.032	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	-3	-168.6	30.2	-37.2	0	0	0	113.8	N246 N247 E283 P298	N246-P251 WeakPolarHBondContact CB-O 3.23Å; N246-P251 PolarHBondContact ND2-O 3.23Å; N247-P251 WeakPolarHBondContact O-CA 3.43Å; P251-E283 WeakPolarHBondContact CD-OE2 3.3Å; P251-E283 HydrophobicContact CG-CB 4.5Å; P251-P298 HydrophobicContact CB-CB 3.98Å; P251-P298 HydrophobicContact CB-CG 4.3Å; P251-P298 HydrophobicContact CG-CB 4.26Å; P251-P298 HydrophobicContact CG-CG 4.02Å
252	N	93.3	Very high	90.1	Very high	118 Å²	118	56.3 Å²	56.3	63%	0.631	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	-16.5	171.6	-66.3	-51.2	0	0	0	112.9	N250	N250-N252 PolarHBondContact O-N 3.21Å; N250-N252 PolarHBondContact OD1-N 3.33Å
253	K	93	Very high	90.6	Very high	91 Å²	91	57.4 Å²	57.4	40%	0.396	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.8	-178.3	-166.7	-179.8	-179.7	-176.2	0	111	N246 N247 N250 D259	N246-K253 CarbonylContact C-O 3.46Å; N246-K253 VanDerWaalsContact CA-O 3.24Å; N246-K253 WeakPolarHBondContact CA-O 3.39Å; N246-K253 WeakPolarHBondContact CB-O 3.49Å; N247-K253 PolarHBondContact N-O 3.23Å; N250-K253 HydrophobicContact CB-CB 4.44Å; N250-K253 PolarHBondContact O-N 3.02Å; K253-D259 WeakPolarHBondContact CD-OD1 3.32Å; K253-D259 WeakPolarHBondContact CE-OD1 3.44Å; K253-D259 IonicContact NZ-OD1 3.39Å; K253-D259 PolarHBondContact NZ-OD1 3.29Å
254	K	92.2	Very high	91.1	Very high	109 Å²	109	55.7 Å²	55.7	47%	0.474	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	136.7	171.5	-174.5	178.8	178.7	179.1	0	108.8	D206 S256	D206-K254 IonicContact OD1-NZ 3Å; K254-S256 PolarHBondContact O-N 3.31Å
255	M	93.8	Very high	91.4	Very high	3 Å²	3	50 Å²	50	2%	0.015	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-59.4	122	173.8	-176.3	-175.7	-72.1	0	0	109.2	H53 L54 I245 L248 I265	H53-M255 HydrophobicContact CB-SD 4.14Å; H53-M255 PolarHBondContact CE1-O 3.33Å; H53-M255 PolarHBondContact ND1-SD 2.71Å; L54-M255 HydrophobicContact CB-SD 4.22Å; I245-M255 HydrophobicContact CG2-CE 3.93Å; I245-M255 PolarHBondContact O-N 2.9Å; L248-M255 HydrophobicContact CG-CE 4.48Å; M255-I265 HydrophobicContact CG-CB 4.31Å; M255-I265 HydrophobicContact CG-CG1 4.2Å; M255-I265 HydrophobicContact CG-CG2 4.01Å; M255-I265 HydrophobicContact SD-CG2 3.99Å
256	S	89.4	Confident	91.6	Very high	30 Å²	30	49.7 Å²	49.7	21%	0.21	27%	0.269	C	S	.	.			trans	-136.3	149.6	179.7	72.9	0	0	0	0	112.3	K254 S258 D259 I265	K254-S256 PolarHBondContact O-N 3.31Å; S256-S258 PolarHBondContact O-N 3.27Å; S256-S258 PolarHBondContact OG-OG 3.06Å; S256-S258 VanDerWaalsContact OG-OG 3.09Å; S256-D259 PolarHBondContact N-OD2 3.49Å; S256-D259 PolarHBondContact O-N 3.01Å; S256-I265 WeakPolarHBondContact O-CD1 3.46Å
257	K	84	Confident	91.6	Very high	62 Å²	62	50.2 Å²	50.2	27%	0.27	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.6	177	-57.8	179.7	-169.6	177.4	0	113.6	S49 G50 K51 D259	S49-K257 VanDerWaalsContact O-CD 3.23Å; S49-K257 WeakPolarHBondContact O-CD 3.48Å; S49-K257 PolarHBondContact O-NZ 3.36Å; G50-K257 PolarHBondContact O-NZ 3.34Å; K51-K257 WeakPolarHBondContact O-CE 3.42Å; K257-D259 VanDerWaalsContact C-N 3.34Å
258	S	79.4	Confident	91.6	Very high	87 Å²	87	50.1 Å²	50.1	61%	0.608	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	2.2	-178.3	63.5	0	0	0	0	113.9	S256	S256-S258 PolarHBondContact O-N 3.27Å; S256-S258 PolarHBondContact OG-OG 3.06Å; S256-S258 VanDerWaalsContact OG-OG 3.09Å
259	D	81.5	Confident	91.5	Very high	21 Å²	21	53 Å²	53	11%	0.112	29%	0.288	C	S	.	.			trans	-67.7	141.7	174.9	-76.7	-39.4	0	0	0	110.6	N247 K253 S256 K257 S261 I265	N247-D259 PolarHBondContact ND2-OD2 3.32Å; K253-D259 WeakPolarHBondContact CD-OD1 3.32Å; K253-D259 WeakPolarHBondContact CE-OD1 3.44Å; K253-D259 IonicContact NZ-OD1 3.39Å; K253-D259 PolarHBondContact NZ-OD1 3.29Å; S256-D259 PolarHBondContact N-OD2 3.49Å; S256-D259 PolarHBondContact O-N 3.01Å; K257-D259 VanDerWaalsContact C-N 3.34Å; D259-S261 VanDerWaalsContact C-N 3.26Å; D259-S261 PolarHBondContact O-N 3.15Å; D259-I265 HydrophobicContact CB-CD1 4.14Å
260	T	78.1	Confident	91.5	Very high	157 Å²	157	51.3 Å²	51.3	96%	0.963	28%	0.277	S	S	*	.	S	Bend	trans	-70.2	-22.9	-177.3	52.4	0	0	0	0	113.4
261	S	88.2	Confident	91.7	Very high	44 Å²	44	51 Å²	51	31%	0.308	28%	0.277	S	S	.	.			trans	-112.6	117.2	-178.7	-170.2	0	0	0	0	111.5	D259 L263 G264	D259-S261 VanDerWaalsContact C-N 3.26Å; D259-S261 PolarHBondContact O-N 3.15Å; S261-L263 PolarHBondContact O-N 3.13Å; S261-L263 PolarHBondContact OG-N 3.05Å; S261-G264 PolarHBondContact O-N 3.49Å
262	E	90.7	Very high	91.8	Very high	125 Å²	125	53.5 Å²	53.5	58%	0.584	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-65.4	-16.5	172.3	-64	-167.7	165.8	0	0	113.3	G264 I265 K278	E262-G264 PolarHBondContact O-N 3.37Å; E262-I265 PolarHBondContact O-N 3.48Å; E262-K278 VanDerWaalsContact O-CE 3.22Å; E262-K278 WeakPolarHBondContact O-CE 3.48Å; E262-K278 PolarHBondContact O-NZ 3.06Å
263	L	93.9	Very high	92.1	Very high	54 Å²	54	54 Å²	54	28%	0.283	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-64.6	-25.4	177.3	-65.5	176.3	0	0	0	112.3	T249 S261	T249-L263 HydrophobicContact CG2-CB 4.04Å; S261-L263 PolarHBondContact O-N 3.13Å; S261-L263 PolarHBondContact OG-N 3.05Å
264	G	95.3	Very high	92.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-81	-10.7	178.6	0	0	0	0	0	115	N247 L248 S261 E262	N247-G264 WeakPolarHBondContact CA-O 3.39Å; N247-G264 WeakPolarHBondContact OD1-CA 3.49Å; L248-G264 PolarHBondContact N-O 3.38Å; S261-G264 PolarHBondContact O-N 3.49Å; E262-G264 PolarHBondContact O-N 3.37Å
265	I	96.6	Very high	92.6	Very high	1 Å²	1	49 Å²	49	1%	0.005	28%	0.276	C	S	.	.			trans	-123.8	127.4	-169	-51.8	165.5	0	0	0	109.5	H53 M255 S256 D259 E262 Y267 K278	H53-I265 HydrophobicContact CB-CG2 3.58Å; M255-I265 HydrophobicContact CG-CB 4.31Å; M255-I265 HydrophobicContact CG-CG1 4.2Å; M255-I265 HydrophobicContact CG-CG2 4.01Å; M255-I265 HydrophobicContact SD-CG2 3.99Å; S256-I265 WeakPolarHBondContact O-CD1 3.46Å; D259-I265 HydrophobicContact CB-CD1 4.14Å; E262-I265 PolarHBondContact O-N 3.48Å; I265-Y267 HydrophobicContact CB-CE2 4.44Å; I265-Y267 HydrophobicContact CG2-CD1 4.15Å; I265-Y267 HydrophobicContact CG2-CE1 3.76Å; I265-Y267 HydrophobicContact CG2-CE2 4.2Å; I265-K278 VanDerWaalsContact O-CD 3.25Å; I265-K278 WeakPolarHBondContact O-CD 3.43Å; I265-K278 WeakPolarHBondContact O-CE 3.41Å; I265-K278 PolarHBondContact O-NZ 3.07Å
266	I	97.6	Very high	92.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.295	C	S	.	.			trans	-97.5	118.7	168.9	-62.6	165.6	0	0	0	108.5	H53 L54 L248 D270 I275 K278 I279 L339 F343	H53-I266 CarbonylContact C-O 3.58Å; H53-I266 VanDerWaalsContact CA-O 3.26Å; H53-I266 WeakPolarHBondContact CA-O 3.44Å; H53-I266 VanDerWaalsContact CB-O 3.31Å; H53-I266 WeakPolarHBondContact CB-O 3.31Å; L54-I266 HydrophobicContact CB-CB 4.04Å; L54-I266 HydrophobicContact CB-CG2 4.44Å; L54-I266 HydrophobicContact CD2-CB 4.37Å; L54-I266 HydrophobicContact CD2-CD1 3.87Å; L54-I266 PolarHBondContact N-O 3.16Å; L248-I266 HydrophobicContact CD1-CD1 3.72Å; L248-I266 HydrophobicContact CD1-CG1 3.78Å; I266-D270 WeakPolarHBondContact CA-OD2 3.44Å; I266-I275 HydrophobicContact CG2-CG1 4.22Å; I266-K278 HydrophobicContact CG1-CB 4.45Å; I266-K278 HydrophobicContact CG1-CD 4.4Å; I266-I279 HydrophobicContact CD1-CD1 3.54Å; I266-I279 HydrophobicContact CD1-CG1 3.99Å; I266-L339 HydrophobicContact CD1-CD1 3.68Å; I266-F343 HydrophobicContact CG2-CE2 3.85Å
267	Y	96.8	Very high	93.2	Very high	24 Å²	24	57.1 Å²	57.1	9%	0.094	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-87.4	150.9	172.9	-63.9	-69.1	0	0	0	110.6	K51 H53 I265 T269 D270	K51-Y267 HydrophobicContact CB-CD1 3.71Å; K51-Y267 HydrophobicContact CB-CE1 3.9Å; H53-Y267 HydrophobicContact CB-CD1 4.06Å; H53-Y267 HydrophobicContact CB-CE1 4.34Å; I265-Y267 HydrophobicContact CB-CE2 4.44Å; I265-Y267 HydrophobicContact CG2-CD1 4.15Å; I265-Y267 HydrophobicContact CG2-CE1 3.76Å; I265-Y267 HydrophobicContact CG2-CE2 4.2Å; Y267-T269 PolarHBondContact O-N 3.13Å; Y267-D270 PolarHBondContact N-OD2 3.2Å; Y267-D270 WeakPolarHBondContact O-CB 3.5Å; Y267-D270 PolarHBondContact O-N 3.32Å; Y267-D270 VanDerWaalsContact O-N 3.09Å
268	L	96.6	Very high	93.9	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-20.6	176.5	-87.1	64.2	0	0	0	111.9	P52 H53 Y57 T104 F343 I346 Q347	P52-L268 PolarHBondContact O-N 2.88Å; P52-L268 VanDerWaalsContact O-N 3.16Å; H53-L268 VanDerWaalsContact C-CD1 3.42Å; Y57-L268 HydrophobicContact CD2-CD2 4.13Å; Y57-L268 HydrophobicContact CG-CD2 4.33Å; T104-L268 HydrophobicContact CG2-CD2 3.67Å; L268-F343 HydrophobicContact CD1-CE2 4.49Å; L268-F343 HydrophobicContact CD1-CZ 4.08Å; L268-F343 HydrophobicContact CG-CE1 4.47Å; L268-F343 HydrophobicContact CG-CE2 4.41Å; L268-F343 HydrophobicContact CG-CZ 4.12Å; L268-I346 HydrophobicContact CD2-CG2 4.44Å; L268-Q347 WeakPolarHBondContact O-CG 3.38Å; L268-Q347 PolarHBondContact O-NE2 2.97Å
269	T	95.4	Very high	94.8	Very high	62 Å²	62	50.6 Å²	50.6	38%	0.38	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	2	177	47.2	0	0	0	0	114.1	Y267 T271 L350	Y267-T269 PolarHBondContact O-N 3.13Å; T269-T271 PolarHBondContact O-N 3.3Å; T269-L350 HydrophobicContact CG2-CD2 3.42Å; T269-L350 VanDerWaalsContact CG2-CD2 3.42Å
270	D	97.5	Very high	95.5	Very high	12 Å²	12	55 Å²	55	6%	0.064	29%	0.285	C	S	.	.			trans	-65.6	132.6	177.1	-80.6	-28.6	0	0	0	111.1	I266 Y267 H274 I275 K278 Q347	I266-D270 WeakPolarHBondContact CA-OD2 3.44Å; Y267-D270 PolarHBondContact N-OD2 3.2Å; Y267-D270 WeakPolarHBondContact O-CB 3.5Å; Y267-D270 PolarHBondContact O-N 3.32Å; Y267-D270 VanDerWaalsContact O-N 3.09Å; D270-H274 HydrophobicContact CB-CB 4Å; D270-I275 HydrophobicContact CB-CD1 4.49Å; D270-I275 HydrophobicContact CB-CG1 3.78Å; D270-K278 VanDerWaalsContact CG-NZ 3.25Å; D270-K278 IonicContact OD1-NZ 3.13Å; D270-K278 PolarHBondContact OD1-NZ 3.13Å; D270-K278 IonicContact OD2-NZ 2.82Å; D270-K278 PolarHBondContact OD2-NZ 3.11Å; D270-Q347 PolarHBondContact O-NE2 3.38Å
271	T	97.5	Very high	96.4	Very high	64 Å²	64	54 Å²	54	39%	0.393	26%	0.263	S	S	.	.			trans	-62.6	159.2	173	62.7	0	0	0	0	111.3	T269 D273 H274 I275	T269-T271 PolarHBondContact O-N 3.3Å; T271-D273 PolarHBondContact O-N 3.13Å; T271-D273 VanDerWaalsContact O-N 3.16Å; T271-H274 WeakPolarHBondContact O-CB 3.26Å; T271-H274 PolarHBondContact O-N 3.21Å; T271-H274 PolarHBondContact OG1-N 2.88Å; T271-I275 WeakPolarHBondContact O-CG1 3.42Å; T271-I275 PolarHBondContact O-N 3.41Å
272	P	98	Very high	96.8	Very high	58 Å²	58	52.2 Å²	52.2	38%	0.377	25%	0.25	S	S	.	.	H	α-helix	trans	-50.1	-41.3	174.8	-30.1	36.6	0	0	0	113.6	H274 I275 Y276 I340	P272-H274 PolarHBondContact O-N 3Å; P272-I275 PolarHBondContact O-N 3.43Å; P272-Y276 WeakPolarHBondContact O-CB 3.41Å; P272-Y276 PolarHBondContact O-N 2.82Å; P272-I340 HydrophobicContact CB-CD1 3.96Å; P272-I340 HydrophobicContact CB-CG1 4.05Å; P272-I340 HydrophobicContact CB-CG2 4.08Å; P272-I340 HydrophobicContact CG-CG2 4.17Å
273	D	98	Very high	97.1	Very high	128 Å²	128	51.2 Å²	51.2	68%	0.684	25%	0.246	S	C	*	.	H	α-helix	trans	-63.8	-40.3	177.1	-66.4	-26.6	0	0	0	112.8	T271 K277	T271-D273 PolarHBondContact O-N 3.13Å; T271-D273 VanDerWaalsContact O-N 3.16Å; D273-K277 VanDerWaalsContact O-CB 3.24Å; D273-K277 WeakPolarHBondContact O-CB 3.35Å; D273-K277 PolarHBondContact O-N 3.48Å
274	H	97.9	Very high	97.2	Very high	96 Å²	96	50.4 Å²	50.4	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-67	-42.9	176	-74.3	172.9	0	0	0	111.6	D270 T271 P272 K277 K278	D270-H274 HydrophobicContact CB-CB 4Å; T271-H274 WeakPolarHBondContact O-CB 3.26Å; T271-H274 PolarHBondContact O-N 3.21Å; T271-H274 PolarHBondContact OG1-N 2.88Å; P272-H274 PolarHBondContact O-N 3Å; H274-K277 PolarHBondContact O-N 3.16Å; H274-K278 WeakPolarHBondContact O-CB 3.31Å; H274-K278 WeakPolarHBondContact O-CG 3.33Å; H274-K278 PolarHBondContact O-N 3.13Å
275	I	98.3	Very high	97.1	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-50.7	175.5	-64.1	171.6	0	0	0	109.8	I266 D270 T271 P272 K277 K278 I279 L339 I340 F343	I266-I275 HydrophobicContact CG2-CG1 4.22Å; D270-I275 HydrophobicContact CB-CD1 4.49Å; D270-I275 HydrophobicContact CB-CG1 3.78Å; T271-I275 WeakPolarHBondContact O-CG1 3.42Å; T271-I275 PolarHBondContact O-N 3.41Å; P272-I275 PolarHBondContact O-N 3.43Å; I275-K277 PolarHBondContact O-N 3.17Å; I275-K278 PolarHBondContact O-N 2.92Å; I275-I279 HydrophobicContact CG2-CG1 4.43Å; I275-I279 WeakPolarHBondContact O-CG1 3.22Å; I275-I279 PolarHBondContact O-N 3.12Å; I275-L339 HydrophobicContact CG2-CB 3.91Å; I275-L339 HydrophobicContact CG2-CD1 4.06Å; I275-I340 HydrophobicContact CB-CG1 4.28Å; I275-I340 HydrophobicContact CD1-CG1 4.18Å; I275-I340 HydrophobicContact CG2-CG1 4.17Å; I275-F343 HydrophobicContact CD1-CD2 3.8Å
276	Y	97.9	Very high	96.9	Very high	103 Å²	103	57.7 Å²	57.7	40%	0.404	29%	0.291	S	S	.	.	H	α-helix	trans	-58.3	-48.7	178.1	178	-98.5	0	0	0	111.7	P272 K278 I279 K280	P272-Y276 WeakPolarHBondContact O-CB 3.41Å; P272-Y276 PolarHBondContact O-N 2.82Å; Y276-K278 PolarHBondContact O-N 3.42Å; Y276-I279 PolarHBondContact O-N 3.4Å; Y276-K280 HydrophobicContact CE1-CD 3.93Å; Y276-K280 WeakPolarHBondContact O-CB 3.37Å; Y276-K280 PolarHBondContact O-N 3Å
277	K	97.9	Very high	96.6	Very high	100 Å²	100	62.1 Å²	62.1	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-41.5	179.5	-176.9	178.6	178.8	-179.3	0	112.5	D273 H274 I275 R281	D273-K277 VanDerWaalsContact O-CB 3.24Å; D273-K277 WeakPolarHBondContact O-CB 3.35Å; D273-K277 PolarHBondContact O-N 3.48Å; H274-K277 PolarHBondContact O-N 3.16Å; I275-K277 PolarHBondContact O-N 3.17Å; K277-R281 WeakPolarHBondContact O-CB 3.27Å; K277-R281 WeakPolarHBondContact O-CG 3.45Å; K277-R281 PolarHBondContact O-N 3.33Å
278	K	98.3	Very high	96.1	Very high	11 Å²	11	71.7 Å²	71.7	5%	0.048	35%	0.35	C	S	.	.	H	α-helix	trans	-68.7	-47.4	179.6	-72.2	175.8	177	-174.2	0	111.5	L248 E262 I265 I266 D270 H274 I275 Y276 R281 A282	L248-K278 HydrophobicContact CD1-CB 4.05Å; E262-K278 VanDerWaalsContact O-CE 3.22Å; E262-K278 WeakPolarHBondContact O-CE 3.48Å; E262-K278 PolarHBondContact O-NZ 3.06Å; I265-K278 VanDerWaalsContact O-CD 3.25Å; I265-K278 WeakPolarHBondContact O-CD 3.43Å; I265-K278 WeakPolarHBondContact O-CE 3.41Å; I265-K278 PolarHBondContact O-NZ 3.07Å; I266-K278 HydrophobicContact CG1-CB 4.45Å; I266-K278 HydrophobicContact CG1-CD 4.4Å; D270-K278 VanDerWaalsContact CG-NZ 3.25Å; D270-K278 IonicContact OD1-NZ 3.13Å; D270-K278 PolarHBondContact OD1-NZ 3.13Å; D270-K278 IonicContact OD2-NZ 2.82Å; D270-K278 PolarHBondContact OD2-NZ 3.11Å; H274-K278 WeakPolarHBondContact O-CB 3.31Å; H274-K278 WeakPolarHBondContact O-CG 3.33Å; H274-K278 PolarHBondContact O-N 3.13Å; I275-K278 PolarHBondContact O-N 2.92Å; Y276-K278 PolarHBondContact O-N 3.42Å; K278-R281 CarbonylContact O-C 3.06Å; K278-R281 PolarHBondContact O-N 2.93Å; K278-A282 PolarHBondContact O-N 3.12Å; K278-A282 VanDerWaalsContact O-N 3.09Å
279	I	98.3	Very high	95.8	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-64.4	-41.6	176.4	-67.2	-64.5	0	0	0	111.7	L248 I266 I275 Y276 R281 A282 L303 K332 V335 S336 L339	L248-I279 HydrophobicContact CD1-CD1 3.93Å; L248-I279 HydrophobicContact CD2-CD1 4.05Å; I266-I279 HydrophobicContact CD1-CD1 3.54Å; I266-I279 HydrophobicContact CD1-CG1 3.99Å; I275-I279 HydrophobicContact CG2-CG1 4.43Å; I275-I279 WeakPolarHBondContact O-CG1 3.22Å; I275-I279 PolarHBondContact O-N 3.12Å; Y276-I279 PolarHBondContact O-N 3.4Å; I279-R281 PolarHBondContact O-N 3.37Å; I279-A282 WeakPolarHBondContact O-CB 3.22Å; I279-A282 PolarHBondContact O-N 3.42Å; I279-L303 HydrophobicContact CD1-CD2 4.05Å; I279-L303 HydrophobicContact CG2-CD2 4.43Å; I279-K332 HydrophobicContact CG2-CB 3.85Å; I279-K332 HydrophobicContact CG2-CG 4.04Å; I279-K332 WeakPolarHBondContact CG2-O 3.4Å; I279-K332 WeakPolarHBondContact O-CD 3.4Å; I279-K332 WeakPolarHBondContact O-CE 3.45Å; I279-V335 HydrophobicContact CD1-CG1 3.65Å; I279-V335 HydrophobicContact CG1-CG1 4.21Å; I279-V335 HydrophobicContact CG2-CB 4.33Å; I279-V335 HydrophobicContact CG2-CG1 4.28Å; I279-S336 VanDerWaalsContact CB-OG 3.31Å; I279-S336 WeakPolarHBondContact CB-OG 3.19Å; I279-S336 WeakPolarHBondContact CG2-OG 3.38Å; I279-L339 HydrophobicContact CD1-CD1 4.01Å; I279-L339 HydrophobicContact CG1-CD1 4.16Å
280	K	97.2	Very high	95.6	Very high	115 Å²	115	74.6 Å²	74.6	50%	0.5	36%	0.357	S	S	.	.	H	α-helix	trans	-55.5	-38.9	175.1	-174.5	169.2	-174.6	164.5	0	111.6	Y276 K332	Y276-K280 HydrophobicContact CE1-CD 3.93Å; Y276-K280 WeakPolarHBondContact O-CB 3.37Å; Y276-K280 PolarHBondContact O-N 3Å; K280-K332 PolarHBondContact O-NZ 3.05Å
281	R	96.5	Very high	95.4	Very high	136 Å²	136	77 Å²	77	51%	0.513	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.5	178.4	-70.8	-179.1	175.7	-172.5	-4	114.9	K277 K278 I279 E283	K277-R281 WeakPolarHBondContact O-CB 3.27Å; K277-R281 WeakPolarHBondContact O-CG 3.45Å; K277-R281 PolarHBondContact O-N 3.33Å; K278-R281 CarbonylContact O-C 3.06Å; K278-R281 PolarHBondContact O-N 2.93Å; I279-R281 PolarHBondContact O-N 3.37Å; R281-E283 PolarHBondContact O-N 2.94Å
282	A	97.3	Very high	95.2	Very high	5 Å²	5	77.9 Å²	77.9	4%	0.041	37%	0.367	C	S	.	.			trans	-58.4	134.8	177.9	0	0	0	0	0	110.8	L248 K278 I279 L303 K332	L248-A282 HydrophobicContact CB-CB 3.94Å; L248-A282 HydrophobicContact CD2-CB 4.14Å; L248-A282 HydrophobicContact CG-CB 4.47Å; L248-A282 CarbonylContact O-C 3.56Å; L248-A282 VanDerWaalsContact O-CA 3.27Å; L248-A282 WeakPolarHBondContact O-CA 3.4Å; K278-A282 PolarHBondContact O-N 3.12Å; K278-A282 VanDerWaalsContact O-N 3.09Å; I279-A282 WeakPolarHBondContact O-CB 3.22Å; I279-A282 PolarHBondContact O-N 3.42Å; A282-L303 HydrophobicContact CB-CD2 4.28Å; A282-K332 VanDerWaalsContact O-CE 3.29Å; A282-K332 WeakPolarHBondContact O-CE 3.06Å; A282-K332 PolarHBondContact O-NZ 3.29Å
283	E	96	Very high	95	Very high	105 Å²	105	77.2 Å²	77.2	49%	0.491	36%	0.36	S	S	.	.			trans	-69.4	131.3	179.5	-170.6	-178.8	161	0	0	110.1	L248 T249 P251 R281 G299	L248-E283 PolarHBondContact O-N 2.95Å; T249-E283 VanDerWaalsContact O-OE2 3.04Å; P251-E283 WeakPolarHBondContact CD-OE2 3.3Å; P251-E283 HydrophobicContact CG-CB 4.5Å; R281-E283 PolarHBondContact O-N 2.94Å; E283-G299 VanDerWaalsContact O-CA 3.3Å; E283-G299 WeakPolarHBondContact O-CA 3.44Å
284	T	95.8	Very high	94.8	Very high	37 Å²	37	75.6 Å²	75.6	23%	0.227	35%	0.348	C	S	.	.			trans	-141.5	152.1	177.2	58.1	0	0	0	0	108.4	V300 L303	T284-V300 HydrophobicContact CG2-CG2 4.21Å; T284-L303 HydrophobicContact CG2-CD1 4.04Å
285	D	94	Very high	94.6	Very high	37 Å²	37	78 Å²	78	20%	0.198	36%	0.36	C	S	.	.			trans	-66.6	175.2	173.2	58.9	64.8	0	0	0	113.2	I287 R297 K328	D285-I287 VanDerWaalsContact OD1-CB 3.32Å; D285-I287 WeakPolarHBondContact OD1-CB 3.42Å; D285-I287 PolarHBondContact OD1-N 3.38Å; D285-R297 VanDerWaalsContact CG-NE 3.3Å; D285-R297 IonicContact OD1-CZ 3.47Å; D285-R297 IonicContact OD1-NE 2.71Å; D285-R297 PolarHBondContact OD1-NE 3.43Å; D285-R297 IonicContact OD1-NH2 3.42Å; D285-R297 PolarHBondContact OD1-NH2 2.92Å; D285-R297 WeakPolarHBondContact OD2-CB 3.45Å; D285-R297 WeakPolarHBondContact OD2-CG 3.46Å; D285-R297 IonicContact OD2-CZ 3.89Å; D285-R297 IonicContact OD2-NE 2.77Å; D285-R297 PolarHBondContact OD2-NE 2.85Å; D285-R297 IonicContact OD2-NH2 3.42Å; D285-R297 PolarHBondContact OD2-NH2 2.97Å; D285-K328 PolarHBondContact O-NZ 2.92Å
286	S	91.8	Very high	94.4	Very high	116 Å²	116	85.7 Å²	85.7	81%	0.811	39%	0.393	S	S	*	.	S	Bend	trans	-84.2	-2.2	179.7	-59.7	0	0	0	0	114.6
287	I	91.3	Very high	94.3	Very high	93 Å²	93	81.1 Å²	81.1	48%	0.477	38%	0.375	S	S	.	.			trans	-76.4	129.4	-175.9	-58.1	167.7	0	0	0	109.1	D285 R297	D285-I287 VanDerWaalsContact OD1-CB 3.32Å; D285-I287 WeakPolarHBondContact OD1-CB 3.42Å; D285-I287 PolarHBondContact OD1-N 3.38Å; I287-R297 PolarHBondContact O-NH2 2.89Å; I287-R297 VanDerWaalsContact O-NH2 3.09Å
288	R	87.5	Confident	94.3	Very high	225 Å²	225	77.4 Å²	77.4	85%	0.849	36%	0.362	S	S	*	.			trans	-69.1	-44.6	-174.8	-69.8	-174.5	-178.8	179.7	0.3	113.4
289	K	88.7	Confident	94.2	Very high	119 Å²	119	77.2 Å²	77.2	52%	0.517	36%	0.362	S	S	.	.	S	Bend	trans	-63.9	141.2	-177.2	-173.9	171.6	-175.8	173.7	0	110.3	R297	K289-R297 VanDerWaalsContact O-CZ 3.28Å; K289-R297 PolarHBondContact O-NH1 3.31Å; K289-R297 PolarHBondContact O-NH2 2.87Å
290	I	92.2	Very high	94.1	Very high	5 Å²	5	77.2 Å²	77.2	3%	0.026	36%	0.362	C	S	.	.			trans	-87.9	121	169.3	-55.2	-55.8	0	0	0	108.7	V300 L304 L319 W326 K328 L331	I290-V300 HydrophobicContact CD1-CG1 4.35Å; I290-V300 HydrophobicContact CG2-CG1 4.09Å; I290-L304 HydrophobicContact CG2-CD1 4.15Å; I290-L304 HydrophobicContact CG2-CD2 4.12Å; I290-L304 HydrophobicContact CG2-CG 4.47Å; I290-L319 HydrophobicContact CG2-CD2 4Å; I290-W326 HydrophobicContact CG1-CB 4.39Å; I290-W326 WeakPolarHBondContact CG1-O 3.19Å; I290-K328 HydrophobicContact CD1-CB 4.46Å; I290-K328 HydrophobicContact CD1-CG 3.73Å; I290-L331 HydrophobicContact CD1-CB 4.41Å; I290-L331 HydrophobicContact CD1-CD2 4.11Å; I290-L331 HydrophobicContact CG2-CD2 4.16Å
291	N	92.3	Very high	94.1	Very high	62 Å²	62	71.7 Å²	71.7	33%	0.332	34%	0.338	S	S	.	.			trans	-145.5	163.5	169.4	70.1	8.3	0	0	0	109.2	R297	N291-R297 VanDerWaalsContact CG-NH1 3.31Å; N291-R297 WeakPolarHBondContact OD1-CD 3.47Å; N291-R297 PolarHBondContact OD1-NH1 3.06Å
292	Y	94.1	Very high	94.2	Very high	84 Å²	84	65.4 Å²	65.4	33%	0.329	32%	0.315	S	S	.	.			trans	-97.5	117.5	176.4	-177.8	-104.1	0	0	0	109.9	L304 R305 I315	Y292-L304 HydrophobicContact CD2-CB 4.43Å; Y292-L304 HydrophobicContact CD2-CD1 4.32Å; Y292-R305 HydrophobicContact CE2-CG 4.02Å; Y292-R305 PolarHBondContact OH-NE 3.44Å; Y292-R305 PolarHBondContact OH-NH2 2.86Å; Y292-I315 HydrophobicContact CD2-CD1 3.8Å; Y292-I315 HydrophobicContact CD2-CG2 3.97Å; Y292-I315 HydrophobicContact CE1-CD1 4.49Å; Y292-I315 HydrophobicContact CE2-CD1 3.51Å; Y292-I315 HydrophobicContact CG-CD1 4.41Å; Y292-I315 HydrophobicContact CG-CG2 3.87Å
293	D	94.8	Very high	94.2	Very high	44 Å²	44	65.2 Å²	65.2	24%	0.235	31%	0.313	C	S	.	.			trans	-151.9	99.7	171.7	-174.9	-30.7	0	0	0	107.2	E295 K296 R297 S301	D293-E295 VanDerWaalsContact C-N 3.26Å; D293-E295 PolarHBondContact O-N 3.43Å; D293-E295 PolarHBondContact OD1-N 3.32Å; D293-E295 VanDerWaalsContact OD1-N 3.16Å; D293-K296 HydrophobicContact CB-CB 4.49Å; D293-K296 PolarHBondContact OD1-N 3.13Å; D293-K296 WeakPolarHBondContact OD2-CB 3.18Å; D293-K296 VanDerWaalsContact OD2-CD 3.31Å; D293-K296 WeakPolarHBondContact OD2-CD 3.41Å; D293-K296 WeakPolarHBondContact OD2-CG 3.4Å; D293-R297 HydrophobicContact CB-CB 4.3Å; D293-R297 HydrophobicContact CB-CG 4.35Å; D293-R297 CarbonylContact O-C 3.52Å; D293-R297 WeakPolarHBondContact O-CA 3.48Å; D293-R297 WeakPolarHBondContact O-CB 3.31Å; D293-R297 PolarHBondContact O-N 3.25Å; D293-R297 VanDerWaalsContact O-O 3.12Å; D293-S301 PolarHBondContact N-OG 3.43Å; D293-S301 PolarHBondContact O-OG 3.42Å
294	H	93	Very high	94.2	Very high	93 Å²	93	60.3 Å²	60.3	43%	0.431	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-18.7	-171.5	75.2	-77.1	0	0	0	114	S301	H294-S301 PolarHBondContact N-OG 3.09Å
295	E	93.2	Very high	94.3	Very high	146 Å²	146	60.3 Å²	60.3	68%	0.682	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-48	178.5	-62.9	-174	162.4	0	0	110.4	D293	D293-E295 VanDerWaalsContact C-N 3.26Å; D293-E295 PolarHBondContact O-N 3.43Å; D293-E295 PolarHBondContact OD1-N 3.32Å; D293-E295 VanDerWaalsContact OD1-N 3.16Å
296	K	95.4	Very high	94.5	Very high	163 Å²	163	58.5 Å²	58.5	71%	0.709	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-25.6	-175.6	-55.3	-177.4	-170.5	163.5	0	113.3	D293 P298	D293-K296 HydrophobicContact CB-CB 4.49Å; D293-K296 PolarHBondContact OD1-N 3.13Å; D293-K296 WeakPolarHBondContact OD2-CB 3.18Å; D293-K296 VanDerWaalsContact OD2-CD 3.31Å; D293-K296 WeakPolarHBondContact OD2-CD 3.41Å; D293-K296 WeakPolarHBondContact OD2-CG 3.4Å; K296-P298 VanDerWaalsContact C-CD 3.45Å
297	R	95.6	Very high	94.7	Very high	7 Å²	7	53 Å²	53	3%	0.026	24%	0.238	C	C	.	.			trans	-133.6	58.2	-175.7	-56.3	-173.3	73.2	-172.8	2.4	111.3	D285 I287 K289 N291 D293 G299 V300 S301	D285-R297 VanDerWaalsContact CG-NE 3.3Å; D285-R297 IonicContact OD1-CZ 3.47Å; D285-R297 IonicContact OD1-NE 2.71Å; D285-R297 PolarHBondContact OD1-NE 3.43Å; D285-R297 IonicContact OD1-NH2 3.42Å; D285-R297 PolarHBondContact OD1-NH2 2.92Å; D285-R297 WeakPolarHBondContact OD2-CB 3.45Å; D285-R297 WeakPolarHBondContact OD2-CG 3.46Å; D285-R297 IonicContact OD2-CZ 3.89Å; D285-R297 IonicContact OD2-NE 2.77Å; D285-R297 PolarHBondContact OD2-NE 2.85Å; D285-R297 IonicContact OD2-NH2 3.42Å; D285-R297 PolarHBondContact OD2-NH2 2.97Å; I287-R297 PolarHBondContact O-NH2 2.89Å; I287-R297 VanDerWaalsContact O-NH2 3.09Å; K289-R297 VanDerWaalsContact O-CZ 3.28Å; K289-R297 PolarHBondContact O-NH1 3.31Å; K289-R297 PolarHBondContact O-NH2 2.87Å; N291-R297 VanDerWaalsContact CG-NH1 3.31Å; N291-R297 WeakPolarHBondContact OD1-CD 3.47Å; N291-R297 PolarHBondContact OD1-NH1 3.06Å; D293-R297 HydrophobicContact CB-CB 4.3Å; D293-R297 HydrophobicContact CB-CG 4.35Å; D293-R297 CarbonylContact O-C 3.52Å; D293-R297 WeakPolarHBondContact O-CA 3.48Å; D293-R297 WeakPolarHBondContact O-CB 3.31Å; D293-R297 PolarHBondContact O-N 3.25Å; D293-R297 VanDerWaalsContact O-O 3.12Å; R297-G299 VanDerWaalsContact C-N 3.27Å; R297-G299 PolarHBondContact O-N 3.34Å; R297-V300 PolarHBondContact O-N 3.42Å; R297-S301 VanDerWaalsContact O-CB 3.3Å; R297-S301 WeakPolarHBondContact O-CB 3.38Å; R297-S301 PolarHBondContact O-N 2.89Å; R297-S301 PolarHBondContact O-OG 2.93Å
298	P	96.7	Very high	94.9	Very high	23 Å²	23	49.5 Å²	49.5	15%	0.149	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-35.3	-172.1	25.8	-36.4	0	0	0	112.5	P251 K296 N302	P251-P298 HydrophobicContact CB-CB 3.98Å; P251-P298 HydrophobicContact CB-CG 4.3Å; P251-P298 HydrophobicContact CG-CB 4.26Å; P251-P298 HydrophobicContact CG-CG 4.02Å; K296-P298 VanDerWaalsContact C-CD 3.45Å; P298-N302 VanDerWaalsContact O-CB 3.24Å; P298-N302 WeakPolarHBondContact O-CB 3.49Å; P298-N302 PolarHBondContact O-N 3.32Å
299	G	97	Very high	95.3	Very high	6 Å²	6	39.7 Å²	39.7	6%	0.062	19%	0.189	C	C	.	.	H	α-helix	trans	-65.4	-51.9	-179.8	0	0	0	0	0	113.9	E283 R297 S301 N302 L303	E283-G299 VanDerWaalsContact O-CA 3.3Å; E283-G299 WeakPolarHBondContact O-CA 3.44Å; R297-G299 VanDerWaalsContact C-N 3.27Å; R297-G299 PolarHBondContact O-N 3.34Å; G299-S301 VanDerWaalsContact C-N 3.33Å; G299-S301 PolarHBondContact O-N 3.36Å; G299-N302 PolarHBondContact O-N 2.83Å; G299-L303 PolarHBondContact O-N 2.8Å
300	V	96.3	Very high	95.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.8	-41.8	176.7	177.4	0	0	0	0	110.4	T284 I290 R297 N302 L303 L304 L331	T284-V300 HydrophobicContact CG2-CG2 4.21Å; I290-V300 HydrophobicContact CD1-CG1 4.35Å; I290-V300 HydrophobicContact CG2-CG1 4.09Å; R297-V300 PolarHBondContact O-N 3.42Å; V300-N302 VanDerWaalsContact C-N 3.32Å; V300-N302 PolarHBondContact O-N 3.34Å; V300-L303 PolarHBondContact O-N 3.26Å; V300-L304 HydrophobicContact CG1-CD1 4.1Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 3.41Å; V300-L331 HydrophobicContact CG1-CD2 3.95Å
301	S	97	Very high	95.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-35.9	177.5	-61.4	0	0	0	0	112.9	D293 H294 R297 G299 L304 R305	D293-S301 PolarHBondContact N-OG 3.43Å; D293-S301 PolarHBondContact O-OG 3.42Å; H294-S301 PolarHBondContact N-OG 3.09Å; R297-S301 VanDerWaalsContact O-CB 3.3Å; R297-S301 WeakPolarHBondContact O-CB 3.38Å; R297-S301 PolarHBondContact O-N 2.89Å; R297-S301 PolarHBondContact O-OG 2.93Å; G299-S301 VanDerWaalsContact C-N 3.33Å; G299-S301 PolarHBondContact O-N 3.36Å; S301-L304 PolarHBondContact O-N 2.84Å; S301-R305 WeakPolarHBondContact O-CB 3.47Å; S301-R305 VanDerWaalsContact O-CG 3.29Å; S301-R305 WeakPolarHBondContact O-CG 3.36Å; S301-R305 PolarHBondContact O-N 3.3Å
302	N	97.8	Very high	95.8	Very high	3 Å²	3	38 Å²	38	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-44.6	175	-169.8	42.4	0	0	0	111.5	N246 P298 G299 V300 R305 I306	N246-N302 PolarHBondContact N-OD1 3.5Å; N246-N302 PolarHBondContact O-ND2 2.96Å; P298-N302 VanDerWaalsContact O-CB 3.24Å; P298-N302 WeakPolarHBondContact O-CB 3.49Å; P298-N302 PolarHBondContact O-N 3.32Å; G299-N302 PolarHBondContact O-N 2.83Å; V300-N302 VanDerWaalsContact C-N 3.32Å; V300-N302 PolarHBondContact O-N 3.34Å; N302-R305 PolarHBondContact O-N 3.48Å; N302-I306 WeakPolarHBondContact O-CG1 3.47Å; N302-I306 PolarHBondContact O-N 2.86Å
303	L	97.7	Very high	95.7	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-42.1	175.8	-68.3	177.7	0	0	0	112.1	L248 I279 A282 T284 G299 V300 I306 L307 L331 K332 V335	L248-L303 HydrophobicContact CD2-CD2 4.4Å; I279-L303 HydrophobicContact CD1-CD2 4.05Å; I279-L303 HydrophobicContact CG2-CD2 4.43Å; A282-L303 HydrophobicContact CB-CD2 4.28Å; T284-L303 HydrophobicContact CG2-CD1 4.04Å; G299-L303 PolarHBondContact O-N 2.8Å; V300-L303 PolarHBondContact O-N 3.26Å; L303-I306 PolarHBondContact O-N 3.17Å; L303-L307 PolarHBondContact O-N 3.15Å; L303-L331 HydrophobicContact CB-CD2 3.99Å; L303-L331 HydrophobicContact CB-CG 4.21Å; L303-L331 HydrophobicContact CD1-CD2 4.22Å; L303-L331 HydrophobicContact CD1-CG 4.42Å; L303-K332 HydrophobicContact CD1-CG 3.84Å; L303-V335 HydrophobicContact CB-CG2 4.2Å; L303-V335 HydrophobicContact CD2-CG1 4.22Å; L303-V335 HydrophobicContact CD2-CG2 4.47Å
304	L	96.5	Very high	95.7	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-41.6	175.5	-72.9	170	0	0	0	112.2	I290 Y292 V300 S301 L307 S308 I315 I318 L319 L331	I290-L304 HydrophobicContact CG2-CD1 4.15Å; I290-L304 HydrophobicContact CG2-CD2 4.12Å; I290-L304 HydrophobicContact CG2-CG 4.47Å; Y292-L304 HydrophobicContact CD2-CB 4.43Å; Y292-L304 HydrophobicContact CD2-CD1 4.32Å; V300-L304 HydrophobicContact CG1-CD1 4.1Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 3.41Å; S301-L304 PolarHBondContact O-N 2.84Å; L304-L307 PolarHBondContact O-N 2.83Å; L304-S308 WeakPolarHBondContact O-CB 3.19Å; L304-S308 PolarHBondContact O-N 3.2Å; L304-I315 HydrophobicContact CB-CG2 4.37Å; L304-I318 HydrophobicContact CD2-CG2 4.27Å; L304-L319 HydrophobicContact CD1-CD2 4.1Å; L304-L319 HydrophobicContact CD2-CD2 4.28Å; L304-L331 HydrophobicContact CD2-CD1 3.92Å; L304-L331 HydrophobicContact CG-CD1 4.49Å; L304-L331 HydrophobicContact CG-CD2 4.39Å
305	R	96.9	Very high	95.7	Very high	37 Å²	37	37.5 Å²	37.5	14%	0.14	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-43	174.2	-78	170	-177.6	174.2	1.2	112.4	P243 Y292 S301 N302 A309 I315	P243-R305 HydrophobicContact CB-CB 3.94Å; P243-R305 HydrophobicContact CB-CG 4.18Å; Y292-R305 HydrophobicContact CE2-CG 4.02Å; Y292-R305 PolarHBondContact OH-NE 3.44Å; Y292-R305 PolarHBondContact OH-NH2 2.86Å; S301-R305 WeakPolarHBondContact O-CB 3.47Å; S301-R305 VanDerWaalsContact O-CG 3.29Å; S301-R305 WeakPolarHBondContact O-CG 3.36Å; S301-R305 PolarHBondContact O-N 3.3Å; N302-R305 PolarHBondContact O-N 3.48Å; R305-A309 VanDerWaalsContact O-CB 3.3Å; R305-A309 WeakPolarHBondContact O-CB 3.25Å; R305-A309 PolarHBondContact O-N 3.34Å; R305-I315 HydrophobicContact CG-CD1 3.9Å
306	I	97.8	Very high	95.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-51	175.9	-67.9	164.8	0	0	0	109.6	L54 I245 L248 N302 L303 S308 A309 I310 V335 L339	L54-I306 HydrophobicContact CD2-CD1 3.93Å; L54-I306 HydrophobicContact CD2-CG1 4.04Å; L54-I306 HydrophobicContact CD2-CG2 4.02Å; I245-I306 HydrophobicContact CD1-CG1 3.9Å; I245-I306 HydrophobicContact CG2-CD1 4.19Å; I245-I306 HydrophobicContact CG2-CG1 4.12Å; L248-I306 HydrophobicContact CD2-CD1 4.18Å; N302-I306 WeakPolarHBondContact O-CG1 3.47Å; N302-I306 PolarHBondContact O-N 2.86Å; L303-I306 PolarHBondContact O-N 3.17Å; I306-S308 PolarHBondContact O-N 3.39Å; I306-A309 PolarHBondContact O-N 3.45Å; I306-I310 HydrophobicContact CG2-CG1 4.37Å; I306-I310 VanDerWaalsContact O-CG1 3.28Å; I306-I310 WeakPolarHBondContact O-CG1 3.31Å; I306-I310 PolarHBondContact O-N 2.9Å; I306-V335 HydrophobicContact CB-CG1 4.45Å; I306-V335 HydrophobicContact CG2-CG1 3.87Å; I306-L339 HydrophobicContact CG2-CD1 4.12Å; I306-L339 HydrophobicContact CG2-CD2 4.01Å; I306-L339 HydrophobicContact CG2-CG 4.14Å
307	L	96.7	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60	-46.1	-178.7	-170.5	59	0	0	0	112	L303 L304 I310 Q311 I318 W326 L331 K334 V335 A338	L303-L307 PolarHBondContact O-N 3.15Å; L304-L307 PolarHBondContact O-N 2.83Å; L307-I310 PolarHBondContact O-N 3.14Å; L307-Q311 HydrophobicContact CD1-CG 4.14Å; L307-Q311 WeakPolarHBondContact O-CB 3.19Å; L307-Q311 WeakPolarHBondContact O-CG 3.04Å; L307-Q311 PolarHBondContact O-N 3.22Å; L307-I318 HydrophobicContact CB-CD1 4.4Å; L307-I318 HydrophobicContact CD2-CD1 4.44Å; L307-I318 HydrophobicContact CD2-CG2 4.08Å; L307-I318 HydrophobicContact CG-CD1 4.16Å; L307-W326 HydrophobicContact CD2-CH2 4.38Å; L307-W326 HydrophobicContact CD2-CZ3 4Å; L307-L331 HydrophobicContact CD2-CD1 4.23Å; L307-K334 HydrophobicContact CD1-CG 4.27Å; L307-K334 HydrophobicContact CD2-CG 4.38Å; L307-V335 HydrophobicContact CB-CG2 3.99Å; L307-V335 HydrophobicContact CD1-CG2 4.47Å; L307-A338 HydrophobicContact CD1-CB 3.78Å
308	S	95.8	Very high	95.5	Very high	19 Å²	19	33.6 Å²	33.6	13%	0.133	18%	0.182	C	C	.	.	H	α-helix	trans	-55.7	-49.8	175.1	168.5	0	0	0	0	112.1	L304 I306 I310 Q311 G312 R313	L304-S308 WeakPolarHBondContact O-CB 3.19Å; L304-S308 PolarHBondContact O-N 3.2Å; I306-S308 PolarHBondContact O-N 3.39Å; S308-I310 PolarHBondContact O-N 2.97Å; S308-Q311 PolarHBondContact O-N 3.31Å; S308-G312 WeakPolarHBondContact O-CA 3.3Å; S308-G312 PolarHBondContact O-N 3.33Å; S308-R313 WeakPolarHBondContact CA-O 3.28Å; S308-R313 VanDerWaalsContact CB-O 3.27Å; S308-R313 WeakPolarHBondContact CB-O 3.44Å; S308-R313 PolarHBondContact O-N 3.33Å; S308-R313 PolarHBondContact OG-O 2.84Å
309	A	95.5	Very high	95.4	Very high	20 Å²	20	33.9 Å²	33.9	17%	0.165	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-35.8	-179.1	0	0	0	0	0	114	L58 K62 P243 R305 I306	L58-A309 HydrophobicContact CB-CB 4.5Å; L58-A309 HydrophobicContact CD1-CB 3.82Å; L58-A309 HydrophobicContact CD2-CB 3.71Å; L58-A309 HydrophobicContact CG-CB 4.21Å; K62-A309 PolarHBondContact NZ-O 3.44Å; P243-A309 HydrophobicContact CG-CB 3.58Å; R305-A309 VanDerWaalsContact O-CB 3.3Å; R305-A309 WeakPolarHBondContact O-CB 3.25Å; R305-A309 PolarHBondContact O-N 3.34Å; I306-A309 PolarHBondContact O-N 3.45Å
310	I	96.3	Very high	95	Very high	16 Å²	16	38 Å²	38	8%	0.082	21%	0.21	C	C	.	.	H	α-helix	trans	-73.1	-46.3	179.5	-66	-70	0	0	0	109.8	Y57 L58 K62 I306 L307 S308 A338 L339 E342	Y57-I310 HydrophobicContact CE1-CD1 4.39Å; L58-I310 HydrophobicContact CD2-CD1 3.71Å; L58-I310 HydrophobicContact CD2-CG1 4.29Å; K62-I310 PolarHBondContact NZ-O 3.46Å; I306-I310 HydrophobicContact CG2-CG1 4.37Å; I306-I310 VanDerWaalsContact O-CG1 3.28Å; I306-I310 WeakPolarHBondContact O-CG1 3.31Å; I306-I310 PolarHBondContact O-N 2.9Å; L307-I310 PolarHBondContact O-N 3.14Å; S308-I310 PolarHBondContact O-N 2.97Å; I310-A338 HydrophobicContact CG2-CB 3.94Å; I310-L339 HydrophobicContact CD1-CD2 3.83Å; I310-L339 HydrophobicContact CG1-CD2 3.97Å; I310-E342 HydrophobicContact CD1-CB 4.09Å; I310-E342 HydrophobicContact CD1-CG 3.77Å; I310-E342 HydrophobicContact CG2-CB 3.99Å; I310-E342 HydrophobicContact CG2-CG 4.41Å
311	Q	94.6	Very high	94.4	Very high	63 Å²	63	41.6 Å²	41.6	29%	0.294	23%	0.232	S	C	.	.	H	α-helix	trans	-80.9	-14.4	-176.2	-65.5	-178.3	-23.2	0	0	114.2	L307 S308 R313	L307-Q311 HydrophobicContact CD1-CG 4.14Å; L307-Q311 WeakPolarHBondContact O-CB 3.19Å; L307-Q311 WeakPolarHBondContact O-CG 3.04Å; L307-Q311 PolarHBondContact O-N 3.22Å; S308-Q311 PolarHBondContact O-N 3.31Å; Q311-R313 VanDerWaalsContact C-N 3.3Å; Q311-R313 HydrophobicContact CB-CG 4.18Å; Q311-R313 VanDerWaalsContact OE1-NE 3.13Å
312	G	92.4	Very high	93.5	Very high	72 Å²	72	42 Å²	42	74%	0.742	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	31.4	-174.8	0	0	0	0	0	113	S308	S308-G312 WeakPolarHBondContact O-CA 3.3Å; S308-G312 PolarHBondContact O-N 3.33Å
313	R	93.2	Very high	91.9	Very high	68 Å²	68	43.6 Å²	43.6	26%	0.257	25%	0.248	S	C	.	.			trans	-117.7	145.8	-179.4	-62.7	-166.4	-64	162.3	1.9	110.7	S308 Q311 E317 I318	S308-R313 WeakPolarHBondContact CA-O 3.28Å; S308-R313 VanDerWaalsContact CB-O 3.27Å; S308-R313 WeakPolarHBondContact CB-O 3.44Å; S308-R313 PolarHBondContact O-N 3.33Å; S308-R313 PolarHBondContact OG-O 2.84Å; Q311-R313 VanDerWaalsContact C-N 3.3Å; Q311-R313 HydrophobicContact CB-CG 4.18Å; Q311-R313 VanDerWaalsContact OE1-NE 3.13Å; R313-E317 VanDerWaalsContact CD-OE1 3.32Å; R313-E317 WeakPolarHBondContact CD-OE1 3.23Å; R313-E317 IonicContact NH1-OE1 3.42Å; R313-I318 HydrophobicContact CB-CD1 4.37Å; R313-I318 HydrophobicContact CB-CG1 4.13Å
314	E	93.9	Very high	90.6	Very high	121 Å²	121	50.1 Å²	50.1	57%	0.565	28%	0.283	S	S	*	.			trans	-67.3	149.5	176	-67.8	-58.4	149.8	0	0	111.2	E316 E317 I318	E314-E316 VanDerWaalsContact C-N 3.26Å; E314-E316 PolarHBondContact O-N 3.47Å; E314-E317 HydrophobicContact CB-CB 4.42Å; E314-E317 WeakPolarHBondContact O-CB 3.38Å; E314-E317 PolarHBondContact O-N 2.91Å; E314-E317 VanDerWaalsContact O-N 3.12Å; E314-I318 PolarHBondContact O-N 3.49Å
315	I	94	Very high	89.8	Confident	21 Å²	21	57.8 Å²	57.8	11%	0.108	32%	0.319	C	S	.	.	H	α-helix	trans	-62.3	-37.5	-179.1	-65.1	177.6	0	0	0	110.7	Y292 L304 R305 E317 I318 L319	Y292-I315 HydrophobicContact CD2-CD1 3.8Å; Y292-I315 HydrophobicContact CD2-CG2 3.97Å; Y292-I315 HydrophobicContact CE1-CD1 4.49Å; Y292-I315 HydrophobicContact CE2-CD1 3.51Å; Y292-I315 HydrophobicContact CG-CD1 4.41Å; Y292-I315 HydrophobicContact CG-CG2 3.87Å; L304-I315 HydrophobicContact CB-CG2 4.37Å; R305-I315 HydrophobicContact CG-CD1 3.9Å; I315-E317 VanDerWaalsContact C-N 3.31Å; I315-E317 PolarHBondContact O-N 3.48Å; I315-I318 PolarHBondContact O-N 2.72Å; I315-L319 HydrophobicContact CG2-CD1 3.97Å; I315-L319 HydrophobicContact CG2-CG 4.29Å; I315-L319 WeakPolarHBondContact O-CB 3.31Å; I315-L319 WeakPolarHBondContact O-CG 3.12Å; I315-L319 PolarHBondContact O-N 3.02Å
316	E	93.9	Very high	89.5	Confident	145 Å²	145	58.8 Å²	58.8	68%	0.678	32%	0.323	S	S	*	.	H	α-helix	trans	-63.3	-38.3	176	-64.3	104	-166.2	0	0	112.1	E314 L319 S320	E314-E316 VanDerWaalsContact C-N 3.26Å; E314-E316 PolarHBondContact O-N 3.47Å; E316-L319 PolarHBondContact O-N 3.4Å; E316-S320 WeakPolarHBondContact O-CB 3.47Å; E316-S320 PolarHBondContact O-N 3.19Å
317	E	93.5	Very high	89.3	Confident	89 Å²	89	61.1 Å²	61.1	42%	0.416	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-48.9	176.2	-170.1	-164	152.7	0	0	110.3	R313 E314 I315 L319 S320 T321	R313-E317 VanDerWaalsContact CD-OE1 3.32Å; R313-E317 WeakPolarHBondContact CD-OE1 3.23Å; R313-E317 IonicContact NH1-OE1 3.42Å; E314-E317 HydrophobicContact CB-CB 4.42Å; E314-E317 WeakPolarHBondContact O-CB 3.38Å; E314-E317 PolarHBondContact O-N 2.91Å; E314-E317 VanDerWaalsContact O-N 3.12Å; I315-E317 VanDerWaalsContact C-N 3.31Å; I315-E317 PolarHBondContact O-N 3.48Å; E317-L319 VanDerWaalsContact C-N 3.33Å; E317-L319 PolarHBondContact O-N 2.95Å; E317-S320 PolarHBondContact O-N 2.84Å; E317-S320 VanDerWaalsContact O-N 3.14Å; E317-S320 PolarHBondContact O-OG 3.39Å; E317-T321 PolarHBondContact O-N 2.9Å; E317-T321 VanDerWaalsContact O-N 3.13Å; E317-T321 PolarHBondContact O-OG1 3.44Å
318	I	92.5	Very high	89.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-56.3	-50.7	176.7	-66.1	172.5	0	0	0	109.9	L304 L307 R313 E314 I315 S320 T321 V322	L304-I318 HydrophobicContact CD2-CG2 4.27Å; L307-I318 HydrophobicContact CB-CD1 4.4Å; L307-I318 HydrophobicContact CD2-CD1 4.44Å; L307-I318 HydrophobicContact CD2-CG2 4.08Å; L307-I318 HydrophobicContact CG-CD1 4.16Å; R313-I318 HydrophobicContact CB-CD1 4.37Å; R313-I318 HydrophobicContact CB-CG1 4.13Å; E314-I318 PolarHBondContact O-N 3.49Å; I315-I318 PolarHBondContact O-N 2.72Å; I318-S320 VanDerWaalsContact C-N 3.32Å; I318-S320 PolarHBondContact O-N 3.4Å; I318-T321 PolarHBondContact O-N 2.67Å; I318-T321 PolarHBondContact O-OG1 3Å; I318-V322 VanDerWaalsContact O-CG2 3.23Å; I318-V322 WeakPolarHBondContact O-CG2 3.27Å; I318-V322 PolarHBondContact O-N 3.29Å
319	L	93.1	Very high	89	Confident	29 Å²	29	69.2 Å²	69.2	15%	0.152	37%	0.373	C	S	.	.	H	α-helix	trans	-60.4	-39.8	178.6	-71.9	174.1	0	0	0	112	I290 L304 I315 E316 E317 T321 V322 A323	I290-L319 HydrophobicContact CG2-CD2 4Å; L304-L319 HydrophobicContact CD1-CD2 4.1Å; L304-L319 HydrophobicContact CD2-CD2 4.28Å; I315-L319 HydrophobicContact CG2-CD1 3.97Å; I315-L319 HydrophobicContact CG2-CG 4.29Å; I315-L319 WeakPolarHBondContact O-CB 3.31Å; I315-L319 WeakPolarHBondContact O-CG 3.12Å; I315-L319 PolarHBondContact O-N 3.02Å; E316-L319 PolarHBondContact O-N 3.4Å; E317-L319 VanDerWaalsContact C-N 3.33Å; E317-L319 PolarHBondContact O-N 2.95Å; L319-T321 VanDerWaalsContact C-N 3.25Å; L319-T321 PolarHBondContact O-N 3.33Å; L319-V322 PolarHBondContact O-N 3.34Å; L319-A323 WeakPolarHBondContact O-CA 3.26Å; L319-A323 WeakPolarHBondContact O-CB 3.42Å; L319-A323 PolarHBondContact O-N 2.88Å
320	S	89.7	Confident	89	Confident	93 Å²	93	71.6 Å²	71.6	65%	0.65	38%	0.384	S	S	*	.	H	α-helix	trans	-63	-33.2	178.7	75	0	0	0	0	112.9	E316 E317 I318	E316-S320 WeakPolarHBondContact O-CB 3.47Å; E316-S320 PolarHBondContact O-N 3.19Å; E317-S320 PolarHBondContact O-N 2.84Å; E317-S320 VanDerWaalsContact O-N 3.14Å; E317-S320 PolarHBondContact O-OG 3.39Å; I318-S320 VanDerWaalsContact C-N 3.32Å; I318-S320 PolarHBondContact O-N 3.4Å
321	T	83.1	Confident	89	Confident	75 Å²	75	70.9 Å²	70.9	46%	0.46	38%	0.38	S	S	.	.	H	α-helix	trans	-80.4	-14.6	-180	57.4	0	0	0	0	114.1	E317 I318 L319	E317-T321 PolarHBondContact O-N 2.9Å; E317-T321 VanDerWaalsContact O-N 3.13Å; E317-T321 PolarHBondContact O-OG1 3.44Å; I318-T321 PolarHBondContact O-N 2.67Å; I318-T321 PolarHBondContact O-OG1 3Å; L319-T321 VanDerWaalsContact C-N 3.25Å; L319-T321 PolarHBondContact O-N 3.33Å
322	V	78	Confident	89.1	Confident	7 Å²	7	69.4 Å²	69.4	4%	0.042	37%	0.373	C	S	.	.	H	α-helix	trans	-137.1	-15.5	-167.8	-49.1	0	0	0	0	114.9	I318 L319 N324 E325 W326	I318-V322 VanDerWaalsContact O-CG2 3.23Å; I318-V322 WeakPolarHBondContact O-CG2 3.27Å; I318-V322 PolarHBondContact O-N 3.29Å; L319-V322 PolarHBondContact O-N 3.34Å; V322-N324 PolarHBondContact O-N 3.04Å; V322-E325 PolarHBondContact O-N 2.9Å; V322-W326 HydrophobicContact CB-CD2 3.57Å; V322-W326 HydrophobicContact CB-CE3 3.91Å; V322-W326 HydrophobicContact CB-CG 3.85Å; V322-W326 HydrophobicContact CB-CH2 4.4Å; V322-W326 HydrophobicContact CB-CZ2 4.14Å; V322-W326 HydrophobicContact CB-CZ3 4.31Å; V322-W326 HydrophobicContact CG1-CD2 3.72Å; V322-W326 HydrophobicContact CG1-CE3 3.95Å; V322-W326 HydrophobicContact CG1-CG 4.42Å; V322-W326 HydrophobicContact CG1-CH2 3.54Å; V322-W326 HydrophobicContact CG1-CZ2 3.31Å; V322-W326 HydrophobicContact CG1-CZ3 3.87Å; V322-W326 HydrophobicContact CG2-CD2 4.02Å; V322-W326 HydrophobicContact CG2-CE3 3.86Å; V322-W326 HydrophobicContact CG2-CG 4.41Å; V322-W326 HydrophobicContact CG2-CZ3 4.24Å; V322-W326 PolarHBondContact O-N 3.07Å
323	A	65.1	Low	89.3	Confident	37 Å²	37	68.2 Å²	68.2	31%	0.306	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	114.8	-177.1	0	0	0	0	0	108	L319	L319-A323 WeakPolarHBondContact O-CA 3.26Å; L319-A323 WeakPolarHBondContact O-CB 3.42Å; L319-A323 PolarHBondContact O-N 2.88Å
324	N	69.8	Low	89.4	Confident	140 Å²	140	69.2 Å²	69.2	75%	0.749	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.5	-16.8	179.3	-50.7	-32.3	0	0	0	115.3	V322	V322-N324 PolarHBondContact O-N 3.04Å
325	E	80.5	Confident	89.6	Confident	161 Å²	161	63.5 Å²	63.5	75%	0.752	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-38	179.1	-66.1	-175.4	177.4	0	0	112.7	V322	V322-E325 PolarHBondContact O-N 2.9Å
326	W	89.7	Confident	89.9	Confident	59 Å²	59	62.6 Å²	62.6	22%	0.223	33%	0.328	C	S	.	.			trans	-82	131.7	-173.5	-71.5	10	0	0	0	112.7	I290 L307 V322 D330 L331 K334	I290-W326 HydrophobicContact CG1-CB 4.39Å; I290-W326 WeakPolarHBondContact CG1-O 3.19Å; L307-W326 HydrophobicContact CD2-CH2 4.38Å; L307-W326 HydrophobicContact CD2-CZ3 4Å; V322-W326 HydrophobicContact CB-CD2 3.57Å; V322-W326 HydrophobicContact CB-CE3 3.91Å; V322-W326 HydrophobicContact CB-CG 3.85Å; V322-W326 HydrophobicContact CB-CH2 4.4Å; V322-W326 HydrophobicContact CB-CZ2 4.14Å; V322-W326 HydrophobicContact CB-CZ3 4.31Å; V322-W326 HydrophobicContact CG1-CD2 3.72Å; V322-W326 HydrophobicContact CG1-CE3 3.95Å; V322-W326 HydrophobicContact CG1-CG 4.42Å; V322-W326 HydrophobicContact CG1-CH2 3.54Å; V322-W326 HydrophobicContact CG1-CZ2 3.31Å; V322-W326 HydrophobicContact CG1-CZ3 3.87Å; V322-W326 HydrophobicContact CG2-CD2 4.02Å; V322-W326 HydrophobicContact CG2-CE3 3.86Å; V322-W326 HydrophobicContact CG2-CG 4.41Å; V322-W326 HydrophobicContact CG2-CZ3 4.24Å; V322-W326 PolarHBondContact O-N 3.07Å; W326-D330 HydrophobicContact CB-CB 3.95Å; W326-D330 HydrophobicContact CD2-CB 4.38Å; W326-D330 HydrophobicContact CG-CB 3.92Å; W326-L331 HydrophobicContact CE3-CB 4.49Å; W326-L331 HydrophobicContact CE3-CD1 4.42Å; W326-L331 HydrophobicContact CZ3-CD1 4.35Å; W326-K334 HydrophobicContact CH2-CB 4Å; W326-K334 HydrophobicContact CH2-CD 4.46Å; W326-K334 HydrophobicContact CH2-CG 3.64Å; W326-K334 HydrophobicContact CZ2-CG 4.3Å; W326-K334 HydrophobicContact CZ3-CB 4.11Å; W326-K334 HydrophobicContact CZ3-CG 4.2Å
327	S	92.8	Very high	90.1	Very high	48 Å²	48	59.5 Å²	59.5	34%	0.336	32%	0.316	S	S	.	.			trans	-78.2	171.8	158.5	75.1	0	0	0	0	111.1	E329 D330 L331	S327-E329 PolarHBondContact O-N 3.09Å; S327-E329 PolarHBondContact OG-N 2.67Å; S327-D330 WeakPolarHBondContact CA-OD2 3.34Å; S327-D330 VanDerWaalsContact CB-OD2 3.25Å; S327-D330 WeakPolarHBondContact CB-OD2 3.19Å; S327-D330 PolarHBondContact N-OD2 3.06Å; S327-D330 PolarHBondContact O-N 3.46Å; S327-D330 VanDerWaalsContact OG-CG 3.31Å; S327-D330 PolarHBondContact OG-N 3.4Å; S327-D330 PolarHBondContact OG-OD2 2.84Å; S327-L331 PolarHBondContact O-N 3.12Å
328	K	93.1	Very high	90.3	Very high	54 Å²	54	55.7 Å²	55.7	24%	0.235	30%	0.3	C	S	.	.	H	α-helix	trans	-63.6	-26.3	170.7	-69.9	175.1	-74.3	168.6	0	112.5	D285 I290 K332	D285-K328 PolarHBondContact O-NZ 2.92Å; I290-K328 HydrophobicContact CD1-CB 4.46Å; I290-K328 HydrophobicContact CD1-CG 3.73Å; K328-K332 WeakPolarHBondContact O-CB 3.22Å; K328-K332 VanDerWaalsContact O-CG 3.3Å; K328-K332 WeakPolarHBondContact O-CG 3.09Å; K328-K332 PolarHBondContact O-N 2.85Å
329	E	94.7	Very high	90.6	Very high	135 Å²	135	55.7 Å²	55.7	63%	0.631	30%	0.3	S	S	*	.	H	α-helix	trans	-71.7	-41.8	175.7	-173.9	163.9	-162.9	0	0	110.7	S327 L331 K332 S333	S327-E329 PolarHBondContact O-N 3.09Å; S327-E329 PolarHBondContact OG-N 2.67Å; E329-L331 PolarHBondContact O-N 3.43Å; E329-K332 PolarHBondContact O-N 3.31Å; E329-S333 WeakPolarHBondContact O-CB 3.39Å; E329-S333 PolarHBondContact O-N 3.24Å
330	D	94.6	Very high	90.8	Very high	71 Å²	71	56.4 Å²	56.4	38%	0.38	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-44.5	174.4	-56.5	-54.9	0	0	0	111.4	W326 S327 K332 S333 K334	W326-D330 HydrophobicContact CB-CB 3.95Å; W326-D330 HydrophobicContact CD2-CB 4.38Å; W326-D330 HydrophobicContact CG-CB 3.92Å; S327-D330 WeakPolarHBondContact CA-OD2 3.34Å; S327-D330 VanDerWaalsContact CB-OD2 3.25Å; S327-D330 WeakPolarHBondContact CB-OD2 3.19Å; S327-D330 PolarHBondContact N-OD2 3.06Å; S327-D330 PolarHBondContact O-N 3.46Å; S327-D330 VanDerWaalsContact OG-CG 3.31Å; S327-D330 PolarHBondContact OG-N 3.4Å; S327-D330 PolarHBondContact OG-OD2 2.84Å; D330-K332 VanDerWaalsContact C-N 3.35Å; D330-K332 PolarHBondContact O-N 3.49Å; D330-S333 PolarHBondContact O-N 3.28Å; D330-K334 WeakPolarHBondContact O-CB 3.34Å; D330-K334 PolarHBondContact O-N 3.44Å
331	L	95.7	Very high	91.3	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-46.6	174.8	176.4	61.8	0	0	0	111.4	I290 V300 L303 L304 L307 W326 S327 E329 K334 V335	I290-L331 HydrophobicContact CD1-CB 4.41Å; I290-L331 HydrophobicContact CD1-CD2 4.11Å; I290-L331 HydrophobicContact CG2-CD2 4.16Å; V300-L331 HydrophobicContact CG1-CD2 3.95Å; L303-L331 HydrophobicContact CB-CD2 3.99Å; L303-L331 HydrophobicContact CB-CG 4.21Å; L303-L331 HydrophobicContact CD1-CD2 4.22Å; L303-L331 HydrophobicContact CD1-CG 4.42Å; L304-L331 HydrophobicContact CD2-CD1 3.92Å; L304-L331 HydrophobicContact CG-CD1 4.49Å; L304-L331 HydrophobicContact CG-CD2 4.39Å; L307-L331 HydrophobicContact CD2-CD1 4.23Å; W326-L331 HydrophobicContact CE3-CB 4.49Å; W326-L331 HydrophobicContact CE3-CD1 4.42Å; W326-L331 HydrophobicContact CZ3-CD1 4.35Å; S327-L331 PolarHBondContact O-N 3.12Å; E329-L331 PolarHBondContact O-N 3.43Å; L331-K334 PolarHBondContact O-N 3.36Å; L331-V335 HydrophobicContact CD1-CG2 4.18Å; L331-V335 WeakPolarHBondContact O-CB 3.24Å; L331-V335 VanDerWaalsContact O-CG2 3.25Å; L331-V335 WeakPolarHBondContact O-CG2 3.31Å; L331-V335 PolarHBondContact O-N 3.31Å
332	K	97.2	Very high	92	Very high	32 Å²	32	58 Å²	58	14%	0.139	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-46.3	177.8	-80.2	175.8	170.4	-174	0	111.3	I279 K280 A282 L303 K328 E329 D330 K334 V335 S336	I279-K332 HydrophobicContact CG2-CB 3.85Å; I279-K332 HydrophobicContact CG2-CG 4.04Å; I279-K332 WeakPolarHBondContact CG2-O 3.4Å; I279-K332 WeakPolarHBondContact O-CD 3.4Å; I279-K332 WeakPolarHBondContact O-CE 3.45Å; K280-K332 PolarHBondContact O-NZ 3.05Å; A282-K332 VanDerWaalsContact O-CE 3.29Å; A282-K332 WeakPolarHBondContact O-CE 3.06Å; A282-K332 PolarHBondContact O-NZ 3.29Å; L303-K332 HydrophobicContact CD1-CG 3.84Å; K328-K332 WeakPolarHBondContact O-CB 3.22Å; K328-K332 VanDerWaalsContact O-CG 3.3Å; K328-K332 WeakPolarHBondContact O-CG 3.09Å; K328-K332 PolarHBondContact O-N 2.85Å; E329-K332 PolarHBondContact O-N 3.31Å; D330-K332 VanDerWaalsContact C-N 3.35Å; D330-K332 PolarHBondContact O-N 3.49Å; K332-K334 VanDerWaalsContact C-N 3.33Å; K332-K334 PolarHBondContact O-N 3.13Å; K332-V335 PolarHBondContact O-N 2.92Å; K332-S336 PolarHBondContact O-N 3Å; K332-S336 PolarHBondContact O-OG 3.11Å
333	S	97	Very high	92.9	Very high	47 Å²	47	57.8 Å²	57.8	33%	0.329	29%	0.294	S	S	.	.	H	α-helix	trans	-57.9	-47.2	176.3	-164.9	0	0	0	0	110.8	E329 D330 V335 S336 D337	E329-S333 WeakPolarHBondContact O-CB 3.39Å; E329-S333 PolarHBondContact O-N 3.24Å; D330-S333 PolarHBondContact O-N 3.28Å; S333-V335 PolarHBondContact O-N 2.91Å; S333-S336 WeakPolarHBondContact O-CB 3.45Å; S333-S336 PolarHBondContact O-N 3.4Å; S333-S336 VanDerWaalsContact O-N 3.15Å; S333-D337 PolarHBondContact O-N 3.04Å
334	K	96.4	Very high	94.5	Very high	89 Å²	89	59.1 Å²	59.1	39%	0.387	30%	0.296	S	S	.	.	H	α-helix	trans	-67	-36.6	-177.7	-161.2	65	173.6	174.3	0	113.3	L307 W326 D330 L331 K332 A338	L307-K334 HydrophobicContact CD1-CG 4.27Å; L307-K334 HydrophobicContact CD2-CG 4.38Å; W326-K334 HydrophobicContact CH2-CB 4Å; W326-K334 HydrophobicContact CH2-CD 4.46Å; W326-K334 HydrophobicContact CH2-CG 3.64Å; W326-K334 HydrophobicContact CZ2-CG 4.3Å; W326-K334 HydrophobicContact CZ3-CB 4.11Å; W326-K334 HydrophobicContact CZ3-CG 4.2Å; D330-K334 WeakPolarHBondContact O-CB 3.34Å; D330-K334 PolarHBondContact O-N 3.44Å; L331-K334 PolarHBondContact O-N 3.36Å; K332-K334 VanDerWaalsContact C-N 3.33Å; K332-K334 PolarHBondContact O-N 3.13Å; K334-A338 VanDerWaalsContact O-CB 3.28Å; K334-A338 WeakPolarHBondContact O-CB 3.48Å; K334-A338 PolarHBondContact O-N 3.03Å
335	V	98.1	Very high	95.8	Very high	1 Å²	1	56 Å²	56	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-44.1	172.4	171	0	0	0	0	110.7	I279 L303 I306 L307 L331 K332 S333 A338 L339	I279-V335 HydrophobicContact CD1-CG1 3.65Å; I279-V335 HydrophobicContact CG1-CG1 4.21Å; I279-V335 HydrophobicContact CG2-CB 4.33Å; I279-V335 HydrophobicContact CG2-CG1 4.28Å; L303-V335 HydrophobicContact CB-CG2 4.2Å; L303-V335 HydrophobicContact CD2-CG1 4.22Å; L303-V335 HydrophobicContact CD2-CG2 4.47Å; I306-V335 HydrophobicContact CB-CG1 4.45Å; I306-V335 HydrophobicContact CG2-CG1 3.87Å; L307-V335 HydrophobicContact CB-CG2 3.99Å; L307-V335 HydrophobicContact CD1-CG2 4.47Å; L331-V335 HydrophobicContact CD1-CG2 4.18Å; L331-V335 WeakPolarHBondContact O-CB 3.24Å; L331-V335 VanDerWaalsContact O-CG2 3.25Å; L331-V335 WeakPolarHBondContact O-CG2 3.31Å; L331-V335 PolarHBondContact O-N 3.31Å; K332-V335 PolarHBondContact O-N 2.92Å; S333-V335 PolarHBondContact O-N 2.91Å; V335-A338 PolarHBondContact O-N 2.97Å; V335-L339 HydrophobicContact CG1-CD1 3.88Å; V335-L339 HydrophobicContact CG1-CG 4.44Å; V335-L339 WeakPolarHBondContact O-CB 3.32Å; V335-L339 WeakPolarHBondContact O-CG 3.39Å; V335-L339 PolarHBondContact O-N 2.84Å
336	S	98.4	Very high	96.7	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.014	25%	0.25	C	C	.	.	H	α-helix	trans	-58.8	-51.1	175.6	-67.9	0	0	0	0	111.7	I279 K332 S333 A338 L339 I340	I279-S336 VanDerWaalsContact CB-OG 3.31Å; I279-S336 WeakPolarHBondContact CB-OG 3.19Å; I279-S336 WeakPolarHBondContact CG2-OG 3.38Å; K332-S336 PolarHBondContact O-N 3Å; K332-S336 PolarHBondContact O-OG 3.11Å; S333-S336 WeakPolarHBondContact O-CB 3.45Å; S333-S336 PolarHBondContact O-N 3.4Å; S333-S336 VanDerWaalsContact O-N 3.15Å; S336-A338 VanDerWaalsContact C-N 3.35Å; S336-A338 PolarHBondContact O-N 3.23Å; S336-L339 PolarHBondContact O-N 2.74Å; S336-I340 WeakPolarHBondContact O-CB 3.5Å; S336-I340 WeakPolarHBondContact O-CD1 3.44Å; S336-I340 VanDerWaalsContact O-CG1 3.23Å; S336-I340 WeakPolarHBondContact O-CG1 3.34Å; S336-I340 PolarHBondContact O-N 3.1Å
337	D	98.3	Very high	97.1	Very high	79 Å²	79	47.7 Å²	47.7	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-45.5	-179.1	-62.4	-22.4	0	0	0	111.4	S333 L339 I340 Q341	S333-D337 PolarHBondContact O-N 3.04Å; D337-L339 PolarHBondContact O-N 2.83Å; D337-I340 PolarHBondContact O-N 3.17Å; D337-Q341 WeakPolarHBondContact O-CB 3.36Å; D337-Q341 PolarHBondContact O-N 2.99Å
338	A	98.2	Very high	97.4	Very high	9 Å²	9	51.6 Å²	51.6	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-42.3	179	0	0	0	0	0	112	L307 I310 K334 V335 S336 E342	L307-A338 HydrophobicContact CD1-CB 3.78Å; I310-A338 HydrophobicContact CG2-CB 3.94Å; K334-A338 VanDerWaalsContact O-CB 3.28Å; K334-A338 WeakPolarHBondContact O-CB 3.48Å; K334-A338 PolarHBondContact O-N 3.03Å; V335-A338 PolarHBondContact O-N 2.97Å; S336-A338 VanDerWaalsContact C-N 3.35Å; S336-A338 PolarHBondContact O-N 3.23Å; A338-E342 WeakPolarHBondContact O-CB 3.38Å; A338-E342 PolarHBondContact O-N 3.45Å
339	L	98.5	Very high	97.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-43.7	176.9	-77.5	171.4	0	0	0	112.3	L54 I266 I275 I279 I306 I310 V335 S336 D337 Q341 E342 F343	L54-L339 HydrophobicContact CD1-CD2 3.56Å; L54-L339 HydrophobicContact CD2-CD1 4.32Å; L54-L339 HydrophobicContact CD2-CD2 3.99Å; L54-L339 HydrophobicContact CG-CD2 4.44Å; I266-L339 HydrophobicContact CD1-CD1 3.68Å; I275-L339 HydrophobicContact CG2-CB 3.91Å; I275-L339 HydrophobicContact CG2-CD1 4.06Å; I279-L339 HydrophobicContact CD1-CD1 4.01Å; I279-L339 HydrophobicContact CG1-CD1 4.16Å; I306-L339 HydrophobicContact CG2-CD1 4.12Å; I306-L339 HydrophobicContact CG2-CD2 4.01Å; I306-L339 HydrophobicContact CG2-CG 4.14Å; I310-L339 HydrophobicContact CD1-CD2 3.83Å; I310-L339 HydrophobicContact CG1-CD2 3.97Å; V335-L339 HydrophobicContact CG1-CD1 3.88Å; V335-L339 HydrophobicContact CG1-CG 4.44Å; V335-L339 WeakPolarHBondContact O-CB 3.32Å; V335-L339 WeakPolarHBondContact O-CG 3.39Å; V335-L339 PolarHBondContact O-N 2.84Å; S336-L339 PolarHBondContact O-N 2.74Å; D337-L339 PolarHBondContact O-N 2.83Å; L339-Q341 VanDerWaalsContact C-N 3.32Å; L339-Q341 PolarHBondContact O-N 2.88Å; L339-E342 PolarHBondContact O-N 3.37Å; L339-F343 HydrophobicContact CD2-CE1 4.41Å; L339-F343 HydrophobicContact CD2-CZ 4.28Å; L339-F343 VanDerWaalsContact O-CB 3.25Å; L339-F343 WeakPolarHBondContact O-CB 3.45Å; L339-F343 WeakPolarHBondContact O-CG 3.28Å; L339-F343 PolarHBondContact O-N 3.43Å
340	I	98.6	Very high	97.7	Very high	45 Å²	45	48.3 Å²	48.3	23%	0.231	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-45	178.4	-69.7	164.3	0	0	0	109.8	P272 I275 S336 D337 F343 D344	P272-I340 HydrophobicContact CB-CD1 3.96Å; P272-I340 HydrophobicContact CB-CG1 4.05Å; P272-I340 HydrophobicContact CB-CG2 4.08Å; P272-I340 HydrophobicContact CG-CG2 4.17Å; I275-I340 HydrophobicContact CB-CG1 4.28Å; I275-I340 HydrophobicContact CD1-CG1 4.18Å; I275-I340 HydrophobicContact CG2-CG1 4.17Å; S336-I340 WeakPolarHBondContact O-CB 3.5Å; S336-I340 WeakPolarHBondContact O-CD1 3.44Å; S336-I340 VanDerWaalsContact O-CG1 3.23Å; S336-I340 WeakPolarHBondContact O-CG1 3.34Å; S336-I340 PolarHBondContact O-N 3.1Å; D337-I340 PolarHBondContact O-N 3.17Å; I340-F343 PolarHBondContact O-N 2.96Å; I340-D344 WeakPolarHBondContact O-CB 3.4Å; I340-D344 PolarHBondContact O-N 3.04Å
341	Q	98.4	Very high	97.9	Very high	155 Å²	155	50.7 Å²	50.7	72%	0.724	25%	0.247	S	C	*	.	H	α-helix	trans	-63.3	-42.9	177.7	-174.9	179.4	-1	0	0	112.4	D337 L339 P345	D337-Q341 WeakPolarHBondContact O-CB 3.36Å; D337-Q341 PolarHBondContact O-N 2.99Å; L339-Q341 VanDerWaalsContact C-N 3.32Å; L339-Q341 PolarHBondContact O-N 2.88Å; Q341-P345 WeakPolarHBondContact O-CD 3.19Å
342	E	97.9	Very high	98	Very high	47 Å²	47	53 Å²	53	22%	0.22	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-42.8	176.6	-176.7	84	149.6	0	0	111.6	Y57 K62 I310 A338 L339 P345	Y57-E342 HydrophobicContact CE1-CG 4.05Å; Y57-E342 PolarHBondContact OH-OE1 2.83Å; K62-E342 WeakPolarHBondContact CE-OE1 3.31Å; K62-E342 IonicContact NZ-OE1 3.33Å; K62-E342 PolarHBondContact NZ-OE1 3.18Å; I310-E342 HydrophobicContact CD1-CB 4.09Å; I310-E342 HydrophobicContact CD1-CG 3.77Å; I310-E342 HydrophobicContact CG2-CB 3.99Å; I310-E342 HydrophobicContact CG2-CG 4.41Å; A338-E342 WeakPolarHBondContact O-CB 3.38Å; A338-E342 PolarHBondContact O-N 3.45Å; L339-E342 PolarHBondContact O-N 3.37Å; E342-P345 WeakPolarHBondContact O-CD 3.42Å
343	F	98.3	Very high	98.1	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-82.1	-26.4	-171.7	-75.4	7.2	0	0	0	113.3	L54 Y57 I266 L268 I275 L339 I340 I346 Q347	L54-F343 HydrophobicContact CD1-CE1 4.17Å; L54-F343 HydrophobicContact CD1-CZ 3.65Å; Y57-F343 AromaticContact CD1-CE1 3.92Å; Y57-F343 HydrophobicContact CD1-CE1 3.92Å; Y57-F343 HydrophobicContact CE1-CE1 4.08Å; I266-F343 HydrophobicContact CG2-CE2 3.85Å; L268-F343 HydrophobicContact CD1-CE2 4.49Å; L268-F343 HydrophobicContact CD1-CZ 4.08Å; L268-F343 HydrophobicContact CG-CE1 4.47Å; L268-F343 HydrophobicContact CG-CE2 4.41Å; L268-F343 HydrophobicContact CG-CZ 4.12Å; I275-F343 HydrophobicContact CD1-CD2 3.8Å; L339-F343 HydrophobicContact CD2-CE1 4.41Å; L339-F343 HydrophobicContact CD2-CZ 4.28Å; L339-F343 VanDerWaalsContact O-CB 3.25Å; L339-F343 WeakPolarHBondContact O-CB 3.45Å; L339-F343 WeakPolarHBondContact O-CG 3.28Å; L339-F343 PolarHBondContact O-N 3.43Å; I340-F343 PolarHBondContact O-N 2.96Å; F343-I346 HydrophobicContact CD1-CD1 4.34Å; F343-I346 CarbonylContact O-C 3.53Å; F343-I346 WeakPolarHBondContact O-CA 3.17Å; F343-I346 WeakPolarHBondContact O-CB 3.3Å; F343-I346 PolarHBondContact O-N 3.41Å; F343-Q347 HydrophobicContact CB-CG 4.28Å; F343-Q347 WeakPolarHBondContact O-CB 3.23Å; F343-Q347 VanDerWaalsContact O-CG 3.27Å; F343-Q347 WeakPolarHBondContact O-CG 3.27Å; F343-Q347 PolarHBondContact O-N 2.86Å
344	D	98.4	Very high	98	Very high	66 Å²	66	50.7 Å²	50.7	35%	0.353	24%	0.243	S	C	.	.	H	α-helix	trans	-48.8	-52.9	-179.9	177.3	72.3	0	0	0	114.1	I340 I346 Q347 K348	I340-D344 WeakPolarHBondContact O-CB 3.4Å; I340-D344 PolarHBondContact O-N 3.04Å; D344-I346 VanDerWaalsContact C-N 3.35Å; D344-I346 PolarHBondContact O-N 3.05Å; D344-Q347 PolarHBondContact O-N 3.27Å; D344-K348 WeakPolarHBondContact O-CB 3.29Å; D344-K348 WeakPolarHBondContact O-CG 3.42Å; D344-K348 PolarHBondContact O-N 3.23Å; D344-K348 WeakPolarHBondContact OD1-CE 3.29Å; D344-K348 IonicContact OD1-NZ 2.69Å; D344-K348 PolarHBondContact OD1-NZ 3.46Å; D344-K348 WeakPolarHBondContact OD2-CE 3.49Å; D344-K348 IonicContact OD2-NZ 2.69Å; D344-K348 PolarHBondContact OD2-NZ 3.36Å
345	P	98	Very high	98.1	Very high	75 Å²	75	51.3 Å²	51.3	49%	0.487	25%	0.251	S	S	.	.	H	α-helix	trans	-65.9	-36.4	177.1	25	-34.4	0	0	0	112.8	Q341 E342 R349	Q341-P345 WeakPolarHBondContact O-CD 3.19Å; E342-P345 WeakPolarHBondContact O-CD 3.42Å; P345-R349 WeakPolarHBondContact O-CB 3.38Å; P345-R349 PolarHBondContact O-N 3.36Å
346	I	98.2	Very high	98.1	Very high	8 Å²	8	53.6 Å²	53.6	4%	0.041	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-46	178.4	-60	174.3	0	0	0	109.8	Y57 A107 L268 F343 D344 R349 L350	Y57-I346 HydrophobicContact CE2-CD1 3.75Å; A107-I346 HydrophobicContact CB-CG2 3.99Å; A107-I346 WeakPolarHBondContact CB-O 3.39Å; L268-I346 HydrophobicContact CD2-CG2 4.44Å; F343-I346 HydrophobicContact CD1-CD1 4.34Å; F343-I346 CarbonylContact O-C 3.53Å; F343-I346 WeakPolarHBondContact O-CA 3.17Å; F343-I346 WeakPolarHBondContact O-CB 3.3Å; F343-I346 PolarHBondContact O-N 3.41Å; D344-I346 VanDerWaalsContact C-N 3.35Å; D344-I346 PolarHBondContact O-N 3.05Å; I346-R349 PolarHBondContact O-N 3.5Å; I346-L350 WeakPolarHBondContact O-CB 3.17Å; I346-L350 PolarHBondContact O-N 3.23Å
347	Q	98.3	Very high	98.1	Very high	37 Å²	37	61.7 Å²	61.7	17%	0.173	30%	0.302	C	S	.	.	H	α-helix	trans	-66.1	-43.9	-178.9	-73.9	176.1	-3.9	0	0	111.8	L268 D270 F343 D344 R349 L350 H351	L268-Q347 WeakPolarHBondContact O-CG 3.38Å; L268-Q347 PolarHBondContact O-NE2 2.97Å; D270-Q347 PolarHBondContact O-NE2 3.38Å; F343-Q347 HydrophobicContact CB-CG 4.28Å; F343-Q347 WeakPolarHBondContact O-CB 3.23Å; F343-Q347 VanDerWaalsContact O-CG 3.27Å; F343-Q347 WeakPolarHBondContact O-CG 3.27Å; F343-Q347 PolarHBondContact O-N 2.86Å; D344-Q347 PolarHBondContact O-N 3.27Å; Q347-R349 VanDerWaalsContact C-N 3.34Å; Q347-R349 PolarHBondContact O-N 3.18Å; Q347-L350 PolarHBondContact O-N 3.46Å; Q347-H351 VanDerWaalsContact O-CB 3.3Å; Q347-H351 WeakPolarHBondContact O-CB 3.24Å; Q347-H351 PolarHBondContact O-N 2.9Å
348	K	98.3	Very high	98.1	Very high	130 Å²	130	64.4 Å²	64.4	57%	0.565	31%	0.312	S	S	*	.	H	α-helix	trans	-59.1	-46.3	173.8	-75	169.7	178.7	162.5	0	111.3	D344 H352	D344-K348 WeakPolarHBondContact O-CB 3.29Å; D344-K348 WeakPolarHBondContact O-CG 3.42Å; D344-K348 PolarHBondContact O-N 3.23Å; D344-K348 WeakPolarHBondContact OD1-CE 3.29Å; D344-K348 IonicContact OD1-NZ 2.69Å; D344-K348 PolarHBondContact OD1-NZ 3.46Å; D344-K348 WeakPolarHBondContact OD2-CE 3.49Å; D344-K348 IonicContact OD2-NZ 2.69Å; D344-K348 PolarHBondContact OD2-NZ 3.36Å; K348-H352 PolarHBondContact O-N 3.3Å
349	R	98.1	Very high	98.1	Very high	110 Å²	110	64 Å²	64	42%	0.415	31%	0.309	S	S	.	.	H	α-helix	trans	-67.3	-41.9	179.4	-173.2	58.2	173.7	175.6	3.5	111.9	A107 P345 I346 Q347 H352 L353	A107-R349 HydrophobicContact CB-CB 3.94Å; A107-R349 HydrophobicContact CB-CG 3.94Å; P345-R349 WeakPolarHBondContact O-CB 3.38Å; P345-R349 PolarHBondContact O-N 3.36Å; I346-R349 PolarHBondContact O-N 3.5Å; Q347-R349 VanDerWaalsContact C-N 3.34Å; Q347-R349 PolarHBondContact O-N 3.18Å; R349-H352 PolarHBondContact O-N 2.81Å; R349-L353 HydrophobicContact CG-CD1 3.92Å; R349-L353 HydrophobicContact CG-CG 4.44Å; R349-L353 WeakPolarHBondContact O-CB 3.17Å; R349-L353 VanDerWaalsContact O-CG 3.24Å; R349-L353 WeakPolarHBondContact O-CG 2.93Å; R349-L353 PolarHBondContact O-N 3.41Å
350	L	97.5	Very high	98	Very high	9 Å²	9	68.6 Å²	68.6	5%	0.047	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-45.4	176.6	-178.5	58.3	0	0	0	111.5	A103 A107 T269 I346 Q347 H352 L353 M354	A103-L350 HydrophobicContact CB-CD1 3.5Å; A107-L350 HydrophobicContact CB-CB 4.05Å; T269-L350 HydrophobicContact CG2-CD2 3.42Å; T269-L350 VanDerWaalsContact CG2-CD2 3.42Å; I346-L350 WeakPolarHBondContact O-CB 3.17Å; I346-L350 PolarHBondContact O-N 3.23Å; Q347-L350 PolarHBondContact O-N 3.46Å; L350-H352 PolarHBondContact O-N 3.14Å; L350-L353 PolarHBondContact O-N 3.12Å; L350-M354 HydrophobicContact CD1-CG 3.95Å; L350-M354 WeakPolarHBondContact O-CB 3.28Å; L350-M354 WeakPolarHBondContact O-CG 3.3Å; L350-M354 PolarHBondContact O-N 3.09Å
351	H	97.5	Very high	98	Very high	121 Å²	121	69.3 Å²	69.3	56%	0.56	34%	0.339	S	S	*	.	H	α-helix	trans	-58.8	-47.3	175.3	-179.1	-80.5	0	0	0	111.4	Q347 M354 N355	Q347-H351 VanDerWaalsContact O-CB 3.3Å; Q347-H351 WeakPolarHBondContact O-CB 3.24Å; Q347-H351 PolarHBondContact O-N 2.9Å; H351-M354 PolarHBondContact O-N 2.99Å; H351-N355 PolarHBondContact CD2-ND2 2.87Å; H351-N355 PolarHBondContact NE2-ND2 3.46Å; H351-N355 VanDerWaalsContact NE2-ND2 3.12Å; H351-N355 VanDerWaalsContact O-CB 3.26Å; H351-N355 WeakPolarHBondContact O-CB 3.31Å; H351-N355 PolarHBondContact O-N 2.84Å; H351-N355 PolarHBondContact O-ND2 2.91Å
352	H	98.4	Very high	98	Very high	50 Å²	50	63.4 Å²	63.4	23%	0.231	31%	0.314	C	S	.	.	H	α-helix	trans	-60	-47.3	175.7	169.2	79.2	0	0	0	112	K348 R349 L350 M354 T356 E358	K348-H352 PolarHBondContact O-N 3.3Å; R349-H352 PolarHBondContact O-N 2.81Å; L350-H352 PolarHBondContact O-N 3.14Å; H352-M354 VanDerWaalsContact C-N 3.34Å; H352-M354 PolarHBondContact O-N 2.83Å; H352-T356 PolarHBondContact CE1-OG1 2.63Å; H352-T356 PolarHBondContact ND1-OG1 3.28Å; H352-T356 WeakPolarHBondContact O-CB 3.3Å; H352-T356 PolarHBondContact O-N 3.43Å; H352-T356 PolarHBondContact O-OG1 3.1Å; H352-E358 IonicContact CE1-OE2 2.67Å
353	L	98.3	Very high	98	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-39.3	-179.2	-74.7	167.8	0	0	0	112.8	A103 L106 A107 R349 L350 G359 Q360 T362 I363	A103-L353 HydrophobicContact CB-CB 3.9Å; A103-L353 HydrophobicContact CB-CD1 4.32Å; A103-L353 VanDerWaalsContact O-CD1 3.31Å; A103-L353 WeakPolarHBondContact O-CD1 3.37Å; L106-L353 HydrophobicContact CB-CD1 3.75Å; L106-L353 HydrophobicContact CD1-CD2 4.33Å; A107-L353 HydrophobicContact CB-CD1 4.35Å; R349-L353 HydrophobicContact CG-CD1 3.92Å; R349-L353 HydrophobicContact CG-CG 4.44Å; R349-L353 WeakPolarHBondContact O-CB 3.17Å; R349-L353 VanDerWaalsContact O-CG 3.24Å; R349-L353 WeakPolarHBondContact O-CG 2.93Å; R349-L353 PolarHBondContact O-N 3.41Å; L350-L353 PolarHBondContact O-N 3.12Å; L353-G359 CarbonylContact O-C 3.55Å; L353-Q360 PolarHBondContact O-N 3.45Å; L353-T362 HydrophobicContact CD2-CG2 4.1Å; L353-I363 HydrophobicContact CB-CD1 4.27Å; L353-I363 HydrophobicContact CD2-CG1 4.47Å; L353-I363 WeakPolarHBondContact O-CD1 3.33Å
354	M	97	Very high	98	Very high	30 Å²	30	64.4 Å²	64.4	15%	0.148	32%	0.323	C	S	.	.	H	α-helix	trans	-83.8	-32.4	-176.5	-68.5	-62.5	-70.4	0	0	113.7	H99 E100 A103 L350 H351 H352 Q360 I363	H99-M354 HydrophobicContact CB-CE 4.32Å; H99-M354 HydrophobicContact CB-SD 4.35Å; E100-M354 HydrophobicContact CB-CE 4.09Å; A103-M354 HydrophobicContact CB-CG 3.88Å; A103-M354 HydrophobicContact CB-SD 3.54Å; A103-M354 VanDerWaalsContact CB-SD 3.54Å; L350-M354 HydrophobicContact CD1-CG 3.95Å; L350-M354 WeakPolarHBondContact O-CB 3.28Å; L350-M354 WeakPolarHBondContact O-CG 3.3Å; L350-M354 PolarHBondContact O-N 3.09Å; H351-M354 PolarHBondContact O-N 2.99Å; H352-M354 VanDerWaalsContact C-N 3.34Å; H352-M354 PolarHBondContact O-N 2.83Å; M354-Q360 PolarHBondContact O-NE2 3.2Å; M354-I363 HydrophobicContact SD-CD1 4.2Å
355	N	97.7	Very high	98	Very high	103 Å²	103	65 Å²	65	55%	0.551	33%	0.326	S	S	*	.	H	α-helix	trans	-112.5	5.2	-165.9	-58.4	-32.8	0	0	0	114.8	H351	H351-N355 PolarHBondContact CD2-ND2 2.87Å; H351-N355 PolarHBondContact NE2-ND2 3.46Å; H351-N355 VanDerWaalsContact NE2-ND2 3.12Å; H351-N355 VanDerWaalsContact O-CB 3.26Å; H351-N355 WeakPolarHBondContact O-CB 3.31Å; H351-N355 PolarHBondContact O-N 2.84Å; H351-N355 PolarHBondContact O-ND2 2.91Å
356	T	98.3	Very high	98	Very high	48 Å²	48	61.4 Å²	61.4	29%	0.294	30%	0.303	S	S	.	.	S	Bend	trans	-122.5	149.5	175.5	70.1	0	0	0	0	111.1	H352 E358 G359 Q360	H352-T356 PolarHBondContact CE1-OG1 2.63Å; H352-T356 PolarHBondContact ND1-OG1 3.28Å; H352-T356 WeakPolarHBondContact O-CB 3.3Å; H352-T356 PolarHBondContact O-N 3.43Å; H352-T356 PolarHBondContact O-OG1 3.1Å; T356-E358 VanDerWaalsContact C-N 3.31Å; T356-E358 PolarHBondContact O-N 3.44Å; T356-G359 PolarHBondContact O-N 3.42Å; T356-G359 PolarHBondContact OG1-N 3.43Å; T356-Q360 WeakPolarHBondContact O-CG 3.48Å; T356-Q360 PolarHBondContact O-N 2.97Å
357	E	98	Very high	98	Very high	173 Å²	173	62.2 Å²	62.2	81%	0.808	31%	0.307	S	S	*	.	H	α-helix	trans	-61	-40.6	177.2	-65.3	-177.1	178.5	0	0	111.8	Q360 S361	E357-Q360 PolarHBondContact O-N 3.04Å; E357-S361 VanDerWaalsContact O-CB 3.3Å; E357-S361 WeakPolarHBondContact O-CB 3.13Å; E357-S361 PolarHBondContact O-N 3.12Å
358	E	97.9	Very high	97.9	Very high	135 Å²	135	63.7 Å²	63.7	63%	0.631	32%	0.322	S	S	*	.	H	α-helix	trans	-60.9	-45.2	174.4	-175.3	-170.4	172.5	0	0	111.6	H352 T356 S361 T362	H352-E358 IonicContact CE1-OE2 2.67Å; T356-E358 VanDerWaalsContact C-N 3.31Å; T356-E358 PolarHBondContact O-N 3.44Å; E358-S361 PolarHBondContact O-N 2.54Å; E358-T362 PolarHBondContact O-N 3.44Å; E358-T362 PolarHBondContact O-OG1 3.22Å
359	G	98	Very high	97.9	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.8	-47.4	176.9	0	0	0	0	0	112.7	L353 T356 T362 I363	L353-G359 CarbonylContact O-C 3.55Å; T356-G359 PolarHBondContact O-N 3.42Å; T356-G359 PolarHBondContact OG1-N 3.43Å; G359-T362 VanDerWaalsContact O-CB 3.31Å; G359-T362 WeakPolarHBondContact O-CB 3.39Å; G359-T362 PolarHBondContact O-N 3.4Å; G359-T362 VanDerWaalsContact O-N 3.16Å; G359-I363 WeakPolarHBondContact O-CG1 3.36Å; G359-I363 PolarHBondContact O-N 2.81Å; G359-I363 VanDerWaalsContact O-N 3.1Å
360	Q	97.6	Very high	97.9	Very high	98 Å²	98	54.9 Å²	54.9	46%	0.458	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-40.5	177.4	-70.1	179.9	-8.1	0	0	111.6	L353 M354 T356 E357 T362 I363 V364	L353-Q360 PolarHBondContact O-N 3.45Å; M354-Q360 PolarHBondContact O-NE2 3.2Å; T356-Q360 WeakPolarHBondContact O-CG 3.48Å; T356-Q360 PolarHBondContact O-N 2.97Å; E357-Q360 PolarHBondContact O-N 3.04Å; Q360-T362 VanDerWaalsContact C-N 3.3Å; Q360-T362 PolarHBondContact O-N 3.46Å; Q360-I363 PolarHBondContact O-N 2.89Å; Q360-V364 WeakPolarHBondContact O-CG2 3.48Å; Q360-V364 PolarHBondContact O-N 3.01Å
361	S	98	Very high	97.9	Very high	59 Å²	59	55.5 Å²	55.5	41%	0.413	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-41.2	172.4	-172.2	0	0	0	0	111.4	E357 E358 I363 V364 N365	E357-S361 VanDerWaalsContact O-CB 3.3Å; E357-S361 WeakPolarHBondContact O-CB 3.13Å; E357-S361 PolarHBondContact O-N 3.12Å; E358-S361 PolarHBondContact O-N 2.54Å; S361-I363 PolarHBondContact O-N 3.02Å; S361-V364 PolarHBondContact O-N 2.98Å; S361-N365 VanDerWaalsContact O-CB 3.28Å; S361-N365 WeakPolarHBondContact O-CB 3.31Å; S361-N365 PolarHBondContact O-N 3.22Å; S361-N365 PolarHBondContact O-ND2 3.11Å; S361-N365 VanDerWaalsContact O-ND2 3.13Å; S361-N365 PolarHBondContact OG-ND2 3.4Å
362	T	98.2	Very high	98	Very high	32 Å²	32	56.4 Å²	56.4	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-42.9	176.3	-59.6	0	0	0	0	112	L106 A112 L353 E358 G359 Q360 C366	L106-T362 HydrophobicContact CD1-CG2 4.27Å; A112-T362 HydrophobicContact CB-CG2 4.08Å; L353-T362 HydrophobicContact CD2-CG2 4.1Å; E358-T362 PolarHBondContact O-N 3.44Å; E358-T362 PolarHBondContact O-OG1 3.22Å; G359-T362 VanDerWaalsContact O-CB 3.31Å; G359-T362 WeakPolarHBondContact O-CB 3.39Å; G359-T362 PolarHBondContact O-N 3.4Å; G359-T362 VanDerWaalsContact O-N 3.16Å; Q360-T362 VanDerWaalsContact C-N 3.3Å; Q360-T362 PolarHBondContact O-N 3.46Å; T362-C366 VanDerWaalsContact O-CB 3.31Å; T362-C366 WeakPolarHBondContact O-CB 3.44Å; T362-C366 PolarHBondContact O-N 2.91Å
363	I	98.2	Very high	97.9	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-48.9	176.6	-66.1	165.5	0	0	0	110.9	V102 A103 L106 L353 M354 G359 Q360 S361 N365 C366 L367	V102-I363 HydrophobicContact CB-CG2 3.98Å; V102-I363 HydrophobicContact CG1-CB 4.45Å; V102-I363 HydrophobicContact CG1-CG2 3.81Å; A103-I363 HydrophobicContact CB-CD1 3.74Å; A103-I363 HydrophobicContact CB-CG1 4.34Å; L106-I363 HydrophobicContact CD1-CG1 4.48Å; L353-I363 HydrophobicContact CB-CD1 4.27Å; L353-I363 HydrophobicContact CD2-CG1 4.47Å; L353-I363 WeakPolarHBondContact O-CD1 3.33Å; M354-I363 HydrophobicContact SD-CD1 4.2Å; G359-I363 WeakPolarHBondContact O-CG1 3.36Å; G359-I363 PolarHBondContact O-N 2.81Å; G359-I363 VanDerWaalsContact O-N 3.1Å; Q360-I363 PolarHBondContact O-N 2.89Å; S361-I363 PolarHBondContact O-N 3.02Å; I363-N365 PolarHBondContact O-N 2.97Å; I363-C366 WeakPolarHBondContact O-CB 3.43Å; I363-C366 PolarHBondContact O-N 3.24Å; I363-L367 HydrophobicContact CG2-CD1 4.48Å; I363-L367 PolarHBondContact O-N 3Å; I363-L367 VanDerWaalsContact O-N 3.09Å
364	V	97.8	Very high	97.9	Very high	67 Å²	67	55.4 Å²	55.4	41%	0.406	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-42	-179.2	173.4	0	0	0	0	111.3	Q360 S361 L367 S368	Q360-V364 WeakPolarHBondContact O-CG2 3.48Å; Q360-V364 PolarHBondContact O-N 3.01Å; S361-V364 PolarHBondContact O-N 2.98Å; V364-L367 PolarHBondContact O-N 3.17Å; V364-S368 VanDerWaalsContact O-CB 3.31Å; V364-S368 WeakPolarHBondContact O-CB 3.39Å; V364-S368 PolarHBondContact O-N 3Å; V364-S368 PolarHBondContact O-OG 3.43Å
365	N	97.8	Very high	97.9	Very high	78 Å²	78	55.9 Å²	55.9	42%	0.417	29%	0.293	S	S	.	.	H	α-helix	trans	-64.1	-41.2	177.3	-72	-26.1	0	0	0	111.5	S361 I363 S368 H369	S361-N365 VanDerWaalsContact O-CB 3.28Å; S361-N365 WeakPolarHBondContact O-CB 3.31Å; S361-N365 PolarHBondContact O-N 3.22Å; S361-N365 PolarHBondContact O-ND2 3.11Å; S361-N365 VanDerWaalsContact O-ND2 3.13Å; S361-N365 PolarHBondContact OG-ND2 3.4Å; I363-N365 PolarHBondContact O-N 2.97Å; N365-S368 PolarHBondContact O-N 3.1Å; N365-H369 VanDerWaalsContact O-CB 3.23Å; N365-H369 WeakPolarHBondContact O-CB 3.34Å; N365-H369 PolarHBondContact O-N 3.48Å
366	C	98.4	Very high	97.9	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.007	30%	0.295	C	S	.	.	H	α-helix	trans	-57.3	-53.1	174.9	-179.1	0	0	0	0	111.6	L106 A112 T362 I363 S368 H369 G370	L106-C366 HydrophobicContact CD1-CB 4.46Å; A112-C366 HydrophobicContact CB-CB 3.88Å; A112-C366 WeakPolarHBondContact O-CA 3.37Å; A112-C366 PolarHBondContact O-SG 2.99Å; T362-C366 VanDerWaalsContact O-CB 3.31Å; T362-C366 WeakPolarHBondContact O-CB 3.44Å; T362-C366 PolarHBondContact O-N 2.91Å; I363-C366 WeakPolarHBondContact O-CB 3.43Å; I363-C366 PolarHBondContact O-N 3.24Å; C366-S368 VanDerWaalsContact C-N 3.34Å; C366-S368 PolarHBondContact O-N 2.92Å; C366-H369 PolarHBondContact O-N 3.17Å; C366-G370 PolarHBondContact O-N 3.33Å
367	L	98.2	Very high	97.8	Very high	24 Å²	24	56.4 Å²	56.4	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-41.7	178.1	-73.9	175.6	0	0	0	112.3	I80 I98 V102 L121 I363 V364 S371	I80-L367 HydrophobicContact CG1-CD2 4.35Å; I98-L367 HydrophobicContact CG2-CD1 4.06Å; V102-L367 HydrophobicContact CG2-CD1 4.25Å; V102-L367 HydrophobicContact CG2-CD2 3.8Å; V102-L367 HydrophobicContact CG2-CG 4.12Å; L121-L367 HydrophobicContact CB-CD2 4.3Å; I363-L367 HydrophobicContact CG2-CD1 4.48Å; I363-L367 PolarHBondContact O-N 3Å; I363-L367 VanDerWaalsContact O-N 3.09Å; V364-L367 PolarHBondContact O-N 3.17Å; L367-S371 WeakPolarHBondContact O-CB 3.31Å; L367-S371 PolarHBondContact O-N 3.01Å
368	S	97.8	Very high	97.8	Very high	68 Å²	68	48.2 Å²	48.2	48%	0.476	25%	0.252	S	S	.	.	H	α-helix	trans	-66.8	-42.6	179.6	-60.4	0	0	0	0	111.8	V364 N365 C366 K372	V364-S368 VanDerWaalsContact O-CB 3.31Å; V364-S368 WeakPolarHBondContact O-CB 3.39Å; V364-S368 PolarHBondContact O-N 3Å; V364-S368 PolarHBondContact O-OG 3.43Å; N365-S368 PolarHBondContact O-N 3.1Å; C366-S368 VanDerWaalsContact C-N 3.34Å; C366-S368 PolarHBondContact O-N 2.92Å; S368-K372 PolarHBondContact O-N 3.46Å; S368-K372 VanDerWaalsContact O-N 3.12Å
369	H	97.7	Very high	97.8	Very high	55 Å²	55	46.2 Å²	46.2	26%	0.255	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-52.4	176.2	-179	82.5	0	0	0	111	N365 C366 S371 K372 Q373	N365-H369 VanDerWaalsContact O-CB 3.23Å; N365-H369 WeakPolarHBondContact O-CB 3.34Å; N365-H369 PolarHBondContact O-N 3.48Å; C366-H369 PolarHBondContact O-N 3.17Å; H369-S371 PolarHBondContact O-N 3.34Å; H369-K372 PolarHBondContact O-N 2.9Å; H369-Q373 PolarHBondContact CD2-OE1 2.88Å; H369-Q373 VanDerWaalsContact NE2-CD 3.3Å; H369-Q373 PolarHBondContact NE2-NE2 3.3Å; H369-Q373 VanDerWaalsContact NE2-NE2 3.11Å; H369-Q373 PolarHBondContact NE2-OE1 3.35Å; H369-Q373 PolarHBondContact O-N 3.06Å
370	G	98.1	Very high	97.7	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-65.4	-39.8	-179.1	0	0	0	0	0	112.7	I119 F120 C366 K372 Q373 A374	I119-G370 WeakPolarHBondContact O-CA 3.25Å; F120-G370 VanDerWaalsContact CB-C 3.49Å; C366-G370 PolarHBondContact O-N 3.33Å; G370-K372 VanDerWaalsContact C-N 3.32Å; G370-K372 PolarHBondContact O-N 2.67Å; G370-Q373 PolarHBondContact O-N 2.76Å; G370-A374 VanDerWaalsContact O-CB 3.26Å; G370-A374 WeakPolarHBondContact O-CB 3.29Å; G370-A374 PolarHBondContact O-N 2.87Å
371	S	98.1	Very high	97.7	Very high	21 Å²	21	50.1 Å²	50.1	15%	0.147	26%	0.264	C	S	.	.	H	α-helix	trans	-59.2	-43.1	175.6	-178.3	0	0	0	0	111.7	S124 L367 H369 N375	S124-S371 VanDerWaalsContact CB-OG 3.24Å; S124-S371 WeakPolarHBondContact CB-OG 3.38Å; S124-S371 PolarHBondContact O-OG 3.11Å; S124-S371 VanDerWaalsContact OG-CB 3.31Å; S124-S371 WeakPolarHBondContact OG-CB 3.45Å; S124-S371 PolarHBondContact OG-OG 3.34Å; L367-S371 WeakPolarHBondContact O-CB 3.31Å; L367-S371 PolarHBondContact O-N 3.01Å; H369-S371 PolarHBondContact O-N 3.34Å; S371-N375 VanDerWaalsContact O-CB 3.3Å; S371-N375 WeakPolarHBondContact O-CB 3.28Å; S371-N375 PolarHBondContact O-N 3.44Å; S371-N375 PolarHBondContact O-ND2 3.03Å; S371-N375 PolarHBondContact OG-ND2 3.29Å
372	K	98.1	Very high	97.7	Very high	141 Å²	141	47.7 Å²	47.7	61%	0.613	25%	0.246	S	C	*	.	H	α-helix	trans	-60.5	-47.7	176.3	-177.6	179.9	178.8	179.7	0	111.7	S368 H369 G370 Q376	S368-K372 PolarHBondContact O-N 3.46Å; S368-K372 VanDerWaalsContact O-N 3.12Å; H369-K372 PolarHBondContact O-N 2.9Å; G370-K372 VanDerWaalsContact C-N 3.32Å; G370-K372 PolarHBondContact O-N 2.67Å; K372-Q376 VanDerWaalsContact O-CG 3.28Å; K372-Q376 WeakPolarHBondContact O-CG 3.28Å; K372-Q376 PolarHBondContact O-N 3.26Å; K372-Q376 VanDerWaalsContact O-N 3.09Å
373	Q	96.9	Very high	97.6	Very high	29 Å²	29	49.5 Å²	49.5	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-66.9	-44.2	-179.6	-69	176.7	-41.8	0	0	112.3	L115 I118 H369 G370 Q376 L377	L115-Q373 VanDerWaalsContact CD2-NE2 3.26Å; I118-Q373 HydrophobicContact CD1-CB 4.1Å; I118-Q373 HydrophobicContact CG2-CB 4.19Å; H369-Q373 PolarHBondContact CD2-OE1 2.88Å; H369-Q373 VanDerWaalsContact NE2-CD 3.3Å; H369-Q373 PolarHBondContact NE2-NE2 3.3Å; H369-Q373 VanDerWaalsContact NE2-NE2 3.11Å; H369-Q373 PolarHBondContact NE2-OE1 3.35Å; H369-Q373 PolarHBondContact O-N 3.06Å; G370-Q373 PolarHBondContact O-N 2.76Å; Q373-Q376 PolarHBondContact O-N 3.32Å; Q373-L377 PolarHBondContact O-N 2.66Å
374	A	97.6	Very high	97.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-44.7	178.5	0	0	0	0	0	111.1	F120 V125 Y196 G370 Q376 L377 A378	F120-A374 HydrophobicContact CB-CB 4.47Å; F120-A374 HydrophobicContact CD1-CB 3.97Å; F120-A374 HydrophobicContact CD2-CB 3.7Å; F120-A374 HydrophobicContact CE1-CB 4.1Å; F120-A374 HydrophobicContact CE2-CB 3.83Å; F120-A374 HydrophobicContact CG-CB 3.77Å; F120-A374 HydrophobicContact CZ-CB 4.03Å; V125-A374 HydrophobicContact CG2-CB 3.69Å; Y196-A374 HydrophobicContact CE1-CB 4.04Å; G370-A374 VanDerWaalsContact O-CB 3.26Å; G370-A374 WeakPolarHBondContact O-CB 3.29Å; G370-A374 PolarHBondContact O-N 2.87Å; A374-Q376 PolarHBondContact O-N 3.18Å; A374-L377 PolarHBondContact O-N 3.3Å; A374-A378 WeakPolarHBondContact O-CB 3.49Å; A374-A378 PolarHBondContact O-N 3.22Å
375	N	98.4	Very high	97.6	Very high	40 Å²	40	50.2 Å²	50.2	21%	0.214	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-44.4	174.7	-85.5	-65.6	0	0	0	112.4	S124 S371 L377 A378 T379	S124-N375 PolarHBondContact O-ND2 3.09Å; S371-N375 VanDerWaalsContact O-CB 3.3Å; S371-N375 WeakPolarHBondContact O-CB 3.28Å; S371-N375 PolarHBondContact O-N 3.44Å; S371-N375 PolarHBondContact O-ND2 3.03Å; S371-N375 PolarHBondContact OG-ND2 3.29Å; N375-L377 VanDerWaalsContact C-N 3.3Å; N375-L377 PolarHBondContact O-N 3.18Å; N375-A378 PolarHBondContact O-N 3.29Å; N375-T379 WeakPolarHBondContact O-CB 3.49Å; N375-T379 PolarHBondContact O-N 3.45Å; N375-T379 PolarHBondContact O-OG1 3.27Å
376	Q	97.5	Very high	97.6	Very high	123 Å²	123	49.7 Å²	49.7	58%	0.575	25%	0.248	S	C	*	.	H	α-helix	trans	-56	-44.6	178.3	-76.6	174.7	-11	0	0	112.3	K372 Q373 A374 K380	K372-Q376 VanDerWaalsContact O-CG 3.28Å; K372-Q376 WeakPolarHBondContact O-CG 3.28Å; K372-Q376 PolarHBondContact O-N 3.26Å; K372-Q376 VanDerWaalsContact O-N 3.09Å; Q373-Q376 PolarHBondContact O-N 3.32Å; A374-Q376 PolarHBondContact O-N 3.18Å; Q376-K380 PolarHBondContact O-N 3.11Å
377	L	95.8	Very high	97.5	Very high	38 Å²	38	52.1 Å²	52.1	20%	0.199	27%	0.265	C	S	.	.	H	α-helix	trans	-72.7	-44.8	177.8	-178.3	55.7	0	0	0	111.9	F41 F77 Y196 Q373 A374 N375 K380 R381	F41-L377 HydrophobicContact CE2-CD2 4.41Å; F77-L377 HydrophobicContact CE1-CD2 4.32Å; F77-L377 HydrophobicContact CE2-CD2 4.3Å; F77-L377 HydrophobicContact CZ-CD2 3.6Å; Y196-L377 HydrophobicContact CD1-CD2 3.96Å; Y196-L377 HydrophobicContact CD1-CG 4.24Å; Q373-L377 PolarHBondContact O-N 2.66Å; A374-L377 PolarHBondContact O-N 3.3Å; N375-L377 VanDerWaalsContact C-N 3.3Å; N375-L377 PolarHBondContact O-N 3.18Å; L377-K380 PolarHBondContact O-N 2.92Å; L377-R381 HydrophobicContact CD1-CG 4.15Å; L377-R381 WeakPolarHBondContact O-CG 3.38Å; L377-R381 PolarHBondContact O-N 3.09Å
378	A	97.9	Very high	97.5	Very high	1 Å²	1	52 Å²	52	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-48.5	-179.4	0	0	0	0	0	112	V125 L195 Y196 A374 N375 K380 R381 L382	V125-A378 HydrophobicContact CG1-CB 3.61Å; L195-A378 HydrophobicContact CD1-CB 4.04Å; L195-A378 HydrophobicContact CD2-CB 3.78Å; L195-A378 HydrophobicContact CG-CB 3.87Å; Y196-A378 HydrophobicContact CE1-CB 4.26Å; A374-A378 WeakPolarHBondContact O-CB 3.49Å; A374-A378 PolarHBondContact O-N 3.22Å; N375-A378 PolarHBondContact O-N 3.29Å; A378-K380 PolarHBondContact O-N 2.97Å; A378-R381 PolarHBondContact O-N 3.15Å; A378-L382 WeakPolarHBondContact O-CB 3.17Å; A378-L382 PolarHBondContact O-N 3.12Å
379	T	98	Very high	97.4	Very high	94 Å²	94	49.9 Å²	49.9	58%	0.577	25%	0.251	S	S	*	.	H	α-helix	trans	-60.1	-44.8	178.7	-59.7	0	0	0	0	111.5	N375 R381 L382 D383	N375-T379 WeakPolarHBondContact O-CB 3.49Å; N375-T379 PolarHBondContact O-N 3.45Å; N375-T379 PolarHBondContact O-OG1 3.27Å; T379-R381 VanDerWaalsContact C-N 3.34Å; T379-R381 PolarHBondContact O-N 3.41Å; T379-L382 PolarHBondContact O-N 2.82Å; T379-D383 PolarHBondContact O-N 3.18Å
380	K	96.8	Very high	97.3	Very high	151 Å²	151	50.3 Å²	50.3	66%	0.657	27%	0.271	S	S	*	.	H	α-helix	trans	-61.7	-42.8	177.5	-177.9	178.5	178.2	-179.7	0	111.7	Q376 L377 A378 L384	Q376-K380 PolarHBondContact O-N 3.11Å; L377-K380 PolarHBondContact O-N 2.92Å; A378-K380 PolarHBondContact O-N 2.97Å; K380-L384 WeakPolarHBondContact O-CG 3.42Å; K380-L384 PolarHBondContact O-N 3Å
381	R	97	Very high	97.2	Very high	29 Å²	29	54.4 Å²	54.4	11%	0.109	30%	0.298	C	S	.	.	H	α-helix	trans	-71.2	-38.9	179.9	-73.6	-177.2	55.4	77.4	4.2	111.9	L194 L195 I231 L377 A378 T379 L384 I385	L194-R381 PolarHBondContact O-NH2 3.24Å; L195-R381 WeakPolarHBondContact O-CD 3.4Å; L195-R381 PolarHBondContact O-NE 2.96Å; I231-R381 PolarHBondContact O-NH1 3.11Å; I231-R381 PolarHBondContact O-NH2 3.4Å; L377-R381 HydrophobicContact CD1-CG 4.15Å; L377-R381 WeakPolarHBondContact O-CG 3.38Å; L377-R381 PolarHBondContact O-N 3.09Å; A378-R381 PolarHBondContact O-N 3.15Å; T379-R381 VanDerWaalsContact C-N 3.34Å; T379-R381 PolarHBondContact O-N 3.41Å; R381-L384 WeakPolarHBondContact O-CB 3.35Å; R381-L384 PolarHBondContact O-N 2.76Å; R381-I385 VanDerWaalsContact O-CG1 3.31Å; R381-I385 WeakPolarHBondContact O-CG1 3.5Å; R381-I385 PolarHBondContact O-N 2.69Å
382	L	97.6	Very high	96.8	Very high	7 Å²	7	57.9 Å²	57.9	4%	0.037	31%	0.311	C	S	.	.	H	α-helix	trans	-65.3	-38.4	175.5	-84.8	167.9	0	0	0	112.9	E130 L131 L195 A378 T379 L384 I385 Y386	E130-L382 HydrophobicContact CB-CD1 4.2Å; E130-L382 HydrophobicContact CB-CD2 4.33Å; L131-L382 HydrophobicContact CB-CD2 4.26Å; L195-L382 HydrophobicContact CD1-CD1 3.94Å; L195-L382 HydrophobicContact CD1-CD2 4.41Å; L195-L382 HydrophobicContact CD1-CG 3.84Å; A378-L382 WeakPolarHBondContact O-CB 3.17Å; A378-L382 PolarHBondContact O-N 3.12Å; T379-L382 PolarHBondContact O-N 2.82Å; L382-L384 PolarHBondContact O-N 2.92Å; L382-I385 HydrophobicContact CD2-CD1 4.4Å; L382-I385 PolarHBondContact O-N 3Å; L382-I385 VanDerWaalsContact O-N 3.11Å; L382-Y386 HydrophobicContact CB-CD2 4.32Å; L382-Y386 HydrophobicContact CB-CE2 4.36Å; L382-Y386 HydrophobicContact CD2-CE2 4.19Å; L382-Y386 WeakPolarHBondContact O-CB 3.46Å; L382-Y386 VanDerWaalsContact O-CD2 3.27Å; L382-Y386 WeakPolarHBondContact O-CD2 3.3Å; L382-Y386 PolarHBondContact O-N 3.2Å
383	D	96.8	Very high	96.3	Very high	71 Å²	71	58.2 Å²	58.2	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-58.2	-40	173.8	-175.8	58.6	0	0	0	111.7	T379 S387 K392	T379-D383 PolarHBondContact O-N 3.18Å; D383-S387 WeakPolarHBondContact O-CB 3.39Å; D383-S387 PolarHBondContact O-N 3.27Å; D383-S387 PolarHBondContact O-OG 3.32Å; D383-K392 WeakPolarHBondContact OD1-CE 3.5Å; D383-K392 IonicContact OD1-NZ 3.76Å; D383-K392 PolarHBondContact OD1-NZ 3.44Å; D383-K392 IonicContact OD2-NZ 2.77Å; D383-K392 PolarHBondContact OD2-NZ 3.44Å
384	L	97	Very high	95.5	Very high	82 Å²	82	62.5 Å²	62.5	43%	0.429	35%	0.348	S	S	.	.	H	α-helix	trans	-66.1	-43.6	173.8	-63.7	173.9	0	0	0	111.9	I231 K380 R381 L382 S387 A388	I231-L384 HydrophobicContact CD1-CB 3.88Å; I231-L384 WeakPolarHBondContact CD1-O 3.34Å; I231-L384 HydrophobicContact CG1-CB 4.26Å; I231-L384 HydrophobicContact CG2-CB 4.37Å; K380-L384 WeakPolarHBondContact O-CG 3.42Å; K380-L384 PolarHBondContact O-N 3Å; R381-L384 WeakPolarHBondContact O-CB 3.35Å; R381-L384 PolarHBondContact O-N 2.76Å; L382-L384 PolarHBondContact O-N 2.92Å; L384-S387 PolarHBondContact O-N 3.02Å; L384-A388 VanDerWaalsContact O-CB 3.31Å; L384-A388 WeakPolarHBondContact O-CB 3.09Å; L384-A388 PolarHBondContact O-N 3.23Å
385	I	98.2	Very high	94.8	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-62.7	-49.7	178.8	-68.1	168.9	0	0	0	110.3	L131 I134 L228 I231 L232 R381 L382 S387 A388 I389	L131-I385 HydrophobicContact CD1-CD1 3.94Å; L131-I385 HydrophobicContact CD2-CD1 4.44Å; I134-I385 HydrophobicContact CD1-CG2 3.72Å; L228-I385 HydrophobicContact CD2-CB 4.34Å; L228-I385 HydrophobicContact CD2-CG1 4.28Å; L228-I385 HydrophobicContact CD2-CG2 4.04Å; I231-I385 HydrophobicContact CG2-CD1 4.41Å; I231-I385 HydrophobicContact CG2-CG1 3.7Å; L232-I385 HydrophobicContact CD2-CD1 4.13Å; R381-I385 VanDerWaalsContact O-CG1 3.31Å; R381-I385 WeakPolarHBondContact O-CG1 3.5Å; R381-I385 PolarHBondContact O-N 2.69Å; L382-I385 HydrophobicContact CD2-CD1 4.4Å; L382-I385 PolarHBondContact O-N 3Å; L382-I385 VanDerWaalsContact O-N 3.11Å; I385-S387 VanDerWaalsContact C-N 3.31Å; I385-S387 PolarHBondContact O-N 3.44Å; I385-A388 PolarHBondContact O-N 3.4Å; I385-A388 VanDerWaalsContact O-N 3.1Å; I385-I389 WeakPolarHBondContact O-CG1 3.33Å; I385-I389 PolarHBondContact O-N 2.79Å
386	Y	98	Very high	93.9	Very high	67 Å²	67	72.6 Å²	72.6	26%	0.263	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-39.5	177.8	-79.6	-56.6	0	0	0	112.3	E130 I134 L382 I389 G390 C391	E130-Y386 WeakPolarHBondContact OE2-CE2 3.27Å; E130-Y386 PolarHBondContact OE2-OH 3.31Å; I134-Y386 HydrophobicContact CD1-CD1 4.36Å; I134-Y386 HydrophobicContact CD1-CE1 3.95Å; L382-Y386 HydrophobicContact CB-CD2 4.32Å; L382-Y386 HydrophobicContact CB-CE2 4.36Å; L382-Y386 HydrophobicContact CD2-CE2 4.19Å; L382-Y386 WeakPolarHBondContact O-CB 3.46Å; L382-Y386 VanDerWaalsContact O-CD2 3.27Å; L382-Y386 WeakPolarHBondContact O-CD2 3.3Å; L382-Y386 PolarHBondContact O-N 3.2Å; Y386-I389 HydrophobicContact CD1-CD1 4.12Å; Y386-G390 PolarHBondContact O-N 3.26Å; Y386-C391 HydrophobicContact CD1-CB 3.7Å; Y386-C391 HydrophobicContact CE1-CB 4.47Å; Y386-C391 PolarHBondContact O-N 2.97Å
387	S	96.4	Very high	92.9	Very high	52 Å²	52	75 Å²	75	36%	0.364	42%	0.423	S	S	.	.	H	α-helix	trans	-61.4	-45.3	172.7	-58.5	0	0	0	0	111.5	D383 L384 I385 I389 G390 K392	D383-S387 WeakPolarHBondContact O-CB 3.39Å; D383-S387 PolarHBondContact O-N 3.27Å; D383-S387 PolarHBondContact O-OG 3.32Å; L384-S387 PolarHBondContact O-N 3.02Å; I385-S387 VanDerWaalsContact C-N 3.31Å; I385-S387 PolarHBondContact O-N 3.44Å; S387-I389 VanDerWaalsContact C-N 3.35Å; S387-I389 PolarHBondContact O-N 3.19Å; S387-G390 PolarHBondContact O-N 2.86Å; S387-K392 WeakPolarHBondContact OG-CD 3.43Å
388	A	97	Very high	91.7	Very high	22 Å²	22	78.5 Å²	78.5	18%	0.182	45%	0.45	C	S	.	.	H	α-helix	trans	-68.1	-30.1	-177.2	0	0	0	0	0	113.9	L228 I231 L384 I385	L228-A388 HydrophobicContact CD2-CB 3.67Å; L228-A388 HydrophobicContact CG-CB 4.23Å; I231-A388 HydrophobicContact CD1-CB 3.64Å; L384-A388 VanDerWaalsContact O-CB 3.31Å; L384-A388 WeakPolarHBondContact O-CB 3.09Å; L384-A388 PolarHBondContact O-N 3.23Å; I385-A388 PolarHBondContact O-N 3.4Å; I385-A388 VanDerWaalsContact O-N 3.1Å
389	I	97.4	Very high	90	Very high	23 Å²	23	88.7 Å²	88.7	12%	0.118	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-0.5	176.6	70.7	177.9	0	0	0	113.6	I134 W225 L228 I385 Y386 S387 C391	I134-I389 HydrophobicContact CD1-CD1 3.88Å; I134-I389 HydrophobicContact CG1-CD1 4.07Å; I134-I389 HydrophobicContact CG2-CD1 4.21Å; W225-I389 HydrophobicContact CB-CG2 4.1Å; W225-I389 HydrophobicContact CD2-CB 4.07Å; W225-I389 HydrophobicContact CD2-CG2 3.53Å; W225-I389 HydrophobicContact CE3-CG2 3.77Å; W225-I389 HydrophobicContact CG-CB 4.15Å; W225-I389 HydrophobicContact CG-CG2 3.71Å; W225-I389 HydrophobicContact CZ2-CB 4.4Å; W225-I389 HydrophobicContact CZ2-CG2 4.42Å; W225-I389 HydrophobicContact CZ3-CG2 4.28Å; L228-I389 HydrophobicContact CD1-CG2 3.85Å; L228-I389 HydrophobicContact CD2-CG2 4.08Å; L228-I389 HydrophobicContact CG-CG2 4.1Å; I385-I389 WeakPolarHBondContact O-CG1 3.33Å; I385-I389 PolarHBondContact O-N 2.79Å; Y386-I389 HydrophobicContact CD1-CD1 4.12Å; S387-I389 VanDerWaalsContact C-N 3.35Å; S387-I389 PolarHBondContact O-N 3.19Å; I389-C391 HydrophobicContact CD1-CB 4.3Å; I389-C391 HydrophobicContact CG1-CB 4.04Å
390	G	95.5	Very high	88.1	Confident	65 Å²	65	89 Å²	89	67%	0.67	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	21.9	177	0	0	0	0	0	115.3	Y386 S387	Y386-G390 PolarHBondContact O-N 3.26Å; S387-G390 PolarHBondContact O-N 2.86Å
391	C	94.9	Very high	85.9	Confident	86 Å²	86	87.2 Å²	87.2	58%	0.581	50%	0.503	S	S	*	.			trans	-101.1	9.3	-179.4	-71.8	0	0	0	0	113.9	Y386 I389	Y386-C391 HydrophobicContact CD1-CB 3.7Å; Y386-C391 HydrophobicContact CE1-CB 4.47Å; Y386-C391 PolarHBondContact O-N 2.97Å; I389-C391 HydrophobicContact CD1-CB 4.3Å; I389-C391 HydrophobicContact CG1-CB 4.04Å
392	K	89.5	Confident	83.6	Confident	95 Å²	95	90.7 Å²	90.7	41%	0.413	53%	0.531	S	S	.	.	S	Bend	trans	-87.9	142.1	175	-171.5	163.9	-179.7	164.6	0	110.8	D383 S387 P394	D383-K392 WeakPolarHBondContact OD1-CE 3.5Å; D383-K392 IonicContact OD1-NZ 3.76Å; D383-K392 PolarHBondContact OD1-NZ 3.44Å; D383-K392 IonicContact OD2-NZ 2.77Å; D383-K392 PolarHBondContact OD2-NZ 3.44Å; S387-K392 WeakPolarHBondContact OG-CD 3.43Å; K392-P394 WeakPolarHBondContact O-CD 3.36Å
393	I	87.7	Confident	81.4	Confident	148 Å²	148	99 Å²	99	76%	0.759	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-59.4	123.3	173.7	-60.6	175.4	0	0	0	108.7	V395	I393-V395 PolarHBondContact O-N 3.32Å
394	P	80.7	Confident	78.9	Confident	118 Å²	118	107 Å²	107	77%	0.766	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-61.2	134.3	176.4	-22.8	33.5	0	0	0	111.1	K392 C396	K392-P394 WeakPolarHBondContact O-CD 3.36Å; P394-C396 PolarHBondContact O-N 2.91Å
395	V	82	Confident	78	Confident	130 Å²	130	108.3 Å²	108.3	79%	0.788	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-76.1	119	171	-176.9	0	0	0	0	108	I393 K397	I393-V395 PolarHBondContact O-N 3.32Å; V395-K397 PolarHBondContact O-N 3.1Å; V395-K397 VanDerWaalsContact O-N 3.11Å
396	C	80.6	Confident	77	Confident	123 Å²	123	113.9 Å²	113.9	83%	0.831	65%	0.654	S	S	*	*			trans	-64.3	113	172.8	-159.3	0	0	0	0	108.2	P394 S398	P394-C396 PolarHBondContact O-N 2.91Å; C396-S398 PolarHBondContact O-N 3.11Å; C396-S398 VanDerWaalsContact O-N 3.1Å
397	K	77	Confident	75.8	Confident	174 Å²	174	116.6 Å²	116.6	76%	0.757	68%	0.676	S	S	*	*			trans	-69.1	107.7	169.8	-69.6	-176.8	-179.9	-179.7	0	106.7	V395 Y399	V395-K397 PolarHBondContact O-N 3.1Å; V395-K397 VanDerWaalsContact O-N 3.11Å; K397-Y399 PolarHBondContact O-N 3.12Å
398	S	69.2	Low	74.6	Confident	110 Å²	110	120.4 Å²	120.4	77%	0.769	69%	0.694	S	S	*	*			trans	-60.7	105.6	164.6	55.1	0	0	0	0	106.9	C396 S400	C396-S398 PolarHBondContact O-N 3.11Å; C396-S398 VanDerWaalsContact O-N 3.1Å; S398-S400 VanDerWaalsContact C-N 3.27Å; S398-S400 PolarHBondContact O-N 3.38Å
399	Y	61.7	Low	73.2	Confident	216 Å²	216	126.5 Å²	126.5	85%	0.847	73%	0.726	S	S	*	*			trans	-63.2	100	162.3	-81.7	-87.8	0	0	0	105.5	K397 S401	K397-Y399 PolarHBondContact O-N 3.12Å; Y399-S401 PolarHBondContact O-N 2.75Å
400	S	58.1	Low	71.6	Confident	100 Å²	100	133.4 Å²	133.4	70%	0.699	77%	0.767	S	S	*	*			trans	-53.8	112.3	161.5	49.9	0	0	0	0	105.6	S398 S402	S398-S400 VanDerWaalsContact C-N 3.27Å; S398-S400 PolarHBondContact O-N 3.38Å; S400-S402 PolarHBondContact O-N 2.94Å
401	S	52.4	Low	69.9	Low	114 Å²	114	138.3 Å²	138.3	80%	0.797	77%	0.774	S	S	*	*			trans	-61.4	86.3	175.9	50.7	0	0	0	0	108.6	Y399 H403	Y399-S401 PolarHBondContact O-N 2.75Å; S401-H403 PolarHBondContact O-N 2.98Å; S401-H403 VanDerWaalsContact O-N 3.12Å
402	S	47.9	Very low	67.9	Low	101 Å²	101	142.3 Å²	142.3	71%	0.706	79%	0.789	S	S	*	*			trans	-81.3	70.1	163.1	58.5	0	0	0	0	107.8	S400	S400-S402 PolarHBondContact O-N 2.94Å
403	H	50.6	Low	66.1	Low	183 Å²	183	146.3 Å²	146.3	85%	0.847	82%	0.82	S	S	*	*			trans	-128.7	90.6	156.7	-81.8	-50.5	0	0	0	106.2	S401	S401-H403 PolarHBondContact O-N 2.98Å; S401-H403 VanDerWaalsContact O-N 3.12Å
404	N	45.7	Very low	64.2	Low	238 Å²	238	146.1 Å²	146.1	100%	1.273	83%	0.826	S	S	*	*			trans	-61.4	0	157.4	-77.6	-22.2	0	0	0	109.8

Retrieved 404 of 404 residues in 95.2 ms (Link to these results)

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