A0A3Q0KV96_SCHMA Loading...

Aminopeptidase P homologue (M24 family)

AlphaFold DB , UniProt , Accession A0A3Q0KV96, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 351 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	37.5	Very low	37.6	Very low	241 Å²	241	168.3 Å²	168.3	100%	1.187	86%	0.863	S	S	*	*				0	61.7	0	-76.3	-159.5	-80.4	0	0	111.2
2	I	38.6	Very low	37.6	Very low	169 Å²	169	171.8 Å²	171.8	87%	0.867	86%	0.857	S	S	*	*			trans	-120.5	78.2	-179	-53.8	174.2	0	0	0	107.4
3	S	36.4	Very low	37.8	Very low	120 Å²	120	166.2 Å²	166.2	84%	0.839	84%	0.844	S	S	*	*			trans	-157.9	79.7	175.5	174.1	0	0	0	0	108.6
4	A	40.6	Very low	37.8	Very low	89 Å²	89	159.7 Å²	159.7	74%	0.736	82%	0.821	S	S	*	*			trans	-158.8	50.2	168.2	0	0	0	0	0	110.7	K6	A4-K6 PolarHBondContact O-N 2.93Å
5	F	38.6	Very low	37.7	Very low	209 Å²	209	152.8 Å²	152.8	92%	0.917	80%	0.798	S	S	*	*			trans	-74	82.3	161.9	-85.2	-84.5	0	0	0	108.1	K7	F5-K7 PolarHBondContact O-N 3.06Å
6	K	41.1	Very low	37.3	Very low	194 Å²	194	150.9 Å²	150.9	84%	0.843	79%	0.788	S	S	*	*			trans	-59	120.3	167.5	-83.7	-178.6	175.4	177.2	0	107.6	A4 L8	A4-K6 PolarHBondContact O-N 2.93Å; K6-L8 PolarHBondContact O-N 3.21Å
7	K	37.2	Very low	37.1	Very low	206 Å²	206	146.5 Å²	146.5	90%	0.896	77%	0.773	S	S	*	*			trans	-46.9	114.5	171.3	-85	176.9	174	172.2	0	109.1	F5	F5-K7 PolarHBondContact O-N 3.06Å
8	L	33.1	Very low	37	Very low	159 Å²	159	142.5 Å²	142.5	83%	0.832	76%	0.759	S	S	*	*			trans	-57.2	135.8	168.4	-80.6	159.4	0	0	0	108.8	K6 K10	K6-L8 PolarHBondContact O-N 3.21Å; L8-K10 PolarHBondContact O-N 3.01Å
9	P	36.7	Very low	37	Very low	111 Å²	111	138.5 Å²	138.5	72%	0.721	74%	0.74	S	S	*	*			trans	-58.6	132.5	177.7	-8.8	16.1	0	0	0	110.1	I11	P9-I11 PolarHBondContact O-N 3.36Å
10	K	37.1	Very low	36.8	Very low	205 Å²	205	143 Å²	143	89%	0.891	75%	0.746	S	S	*	*			trans	-60	109	170.5	-75.9	-177.1	175.7	-178.4	0	108.5	L8 R12	L8-K10 PolarHBondContact O-N 3.01Å; K10-R12 PolarHBondContact O-N 3.16Å; K10-R12 VanDerWaalsContact O-N 3.16Å
11	I	36.2	Very low	36.9	Very low	148 Å²	148	146.6 Å²	146.6	76%	0.759	75%	0.75	S	S	*	*			trans	-57.9	119.2	169.8	-61.9	173.2	0	0	0	107.1	P9 S13	P9-I11 PolarHBondContact O-N 3.36Å; I11-S13 PolarHBondContact O-N 3.28Å
12	R	38.1	Very low	37.2	Very low	211 Å²	211	138 Å²	138	80%	0.796	71%	0.714	S	S	*	*			trans	-58.7	124.8	179.5	-80.4	-179.4	170.8	179.8	-2.8	109.3	K10 S14 A15	K10-R12 PolarHBondContact O-N 3.16Å; K10-R12 VanDerWaalsContact O-N 3.16Å; R12-S14 PolarHBondContact O-N 3.15Å; R12-A15 PolarHBondContact O-N 3.31Å
13	S	40.3	Very low	37.4	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-17.3	-177.4	61.2	0	0	0	0	114.4	I11 A15 L16	I11-S13 PolarHBondContact O-N 3.28Å; S13-A15 PolarHBondContact O-N 3.18Å; S13-L16 PolarHBondContact O-N 3.01Å; S13-L16 VanDerWaalsContact O-N 3.15Å
14	S	38.2	Very low	37.7	Very low	75 Å²	75	133.4 Å²	133.4	52%	0.524	69%	0.691	S	S	.	*	H	α-helix	trans	-64.1	-26.7	177.3	59.9	0	0	0	0	113.5	R12 L16 S17	R12-S14 PolarHBondContact O-N 3.15Å; S14-L16 VanDerWaalsContact C-N 3.27Å; S14-L16 PolarHBondContact O-N 2.79Å; S14-S17 PolarHBondContact O-N 2.72Å; S14-S17 PolarHBondContact O-OG 2.78Å
15	A	35.7	Very low	38	Very low	56 Å²	56	133.8 Å²	133.8	46%	0.463	69%	0.688	S	S	.	*	H	α-helix	trans	-69.7	-25.1	176.3	0	0	0	0	0	112.5	R12 S13 S18 V19	R12-A15 PolarHBondContact O-N 3.31Å; S13-A15 PolarHBondContact O-N 3.18Å; A15-S18 PolarHBondContact O-OG 3.08Å; A15-S18 VanDerWaalsContact O-OG 3.12Å; A15-V19 WeakPolarHBondContact O-CG2 3.47Å
16	L	32.1	Very low	38.5	Very low	122 Å²	122	126.5 Å²	126.5	64%	0.639	66%	0.659	S	S	*	*	H	α-helix	trans	-83.6	-27.1	178.3	-72.6	163.9	0	0	0	112.4	S13 S14 V19	S13-L16 PolarHBondContact O-N 3.01Å; S13-L16 VanDerWaalsContact O-N 3.15Å; S14-L16 VanDerWaalsContact C-N 3.27Å; S14-L16 PolarHBondContact O-N 2.79Å; L16-V19 PolarHBondContact O-N 3.18Å
17	S	33.9	Very low	38.7	Very low	77 Å²	77	120.8 Å²	120.8	54%	0.538	64%	0.643	S	S	.	*	H	α-helix	trans	-71.8	-28.3	179	55.7	0	0	0	0	113.7	S14	S14-S17 PolarHBondContact O-N 2.72Å; S14-S17 PolarHBondContact O-OG 2.78Å
18	S	35.1	Very low	39.2	Very low	74 Å²	74	119.3 Å²	119.3	52%	0.517	63%	0.633	S	S	.	*	H	α-helix	trans	-71.3	-33.8	175.7	57.2	0	0	0	0	112	A15 R20 R21 S22	A15-S18 PolarHBondContact O-OG 3.08Å; A15-S18 VanDerWaalsContact O-OG 3.12Å; S18-R20 VanDerWaalsContact C-N 3.29Å; S18-R20 PolarHBondContact O-N 3.36Å; S18-R21 PolarHBondContact O-N 3.32Å; S18-S22 PolarHBondContact O-N 3.5Å
19	V	36.3	Very low	39.8	Very low	67 Å²	67	113.4 Å²	113.4	41%	0.406	60%	0.602	S	S	.	*	H	α-helix	trans	-62.5	-35	179.5	-179.3	0	0	0	0	111.7	A15 L16 R21	A15-V19 WeakPolarHBondContact O-CG2 3.47Å; L16-V19 PolarHBondContact O-N 3.18Å; V19-R21 VanDerWaalsContact C-N 3.31Å; V19-R21 PolarHBondContact O-N 2.8Å
20	R	33.1	Very low	40.3	Very low	227 Å²	227	115.1 Å²	115.1	86%	0.857	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-22.2	179.1	-81	-170.6	177.5	-172.5	-0.3	114.4	S18	S18-R20 VanDerWaalsContact C-N 3.29Å; S18-R20 PolarHBondContact O-N 3.36Å
21	R	38.5	Very low	40.9	Very low	220 Å²	220	105.9 Å²	105.9	83%	0.83	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-19.4	-176.3	-70.6	-170.9	-179.5	-171.9	0.9	114.1	S18 V19 C23	S18-R21 PolarHBondContact O-N 3.32Å; V19-R21 VanDerWaalsContact C-N 3.31Å; V19-R21 PolarHBondContact O-N 2.8Å; R21-C23 VanDerWaalsContact C-N 3.34Å
22	S	44.5	Very low	41.7	Very low	60 Å²	60	105.5 Å²	105.5	42%	0.42	57%	0.567	S	S	.	*	S	Bend	trans	-84.8	-5	-180	71	0	0	0	0	114.1	S18 T24	S18-S22 PolarHBondContact O-N 3.5Å; S22-T24 PolarHBondContact O-N 3.3Å
23	C	41.8	Very low	43.1	Very low	92 Å²	92	97.4 Å²	97.4	62%	0.622	54%	0.542	S	S	*	.			trans	-72.5	61.2	160	-63.6	0	0	0	0	108.3	R21 S25	R21-C23 VanDerWaalsContact C-N 3.34Å; C23-S25 PolarHBondContact O-N 3.43Å
24	T	44.2	Very low	45.2	Very low	100 Å²	100	97.5 Å²	97.5	61%	0.613	54%	0.543	S	S	*	.			trans	-46.1	120.7	161.8	45.4	0	0	0	0	105.7	S22 L26	S22-T24 PolarHBondContact O-N 3.3Å; T24-L26 PolarHBondContact O-N 3.12Å
25	S	46.2	Very low	47.8	Very low	97 Å²	97	94.4 Å²	94.4	68%	0.678	52%	0.521	S	S	*	.			trans	-44.2	102.6	-175.8	57.3	0	0	0	0	108.7	C23 S27	C23-S25 PolarHBondContact O-N 3.43Å; S25-S27 PolarHBondContact O-N 3Å; S25-S27 PolarHBondContact O-OG 3.05Å
26	L	49.1	Very low	50.5	Low	56 Å²	56	94.6 Å²	94.6	29%	0.293	52%	0.518	S	S	.	.			trans	-75.7	51	177.9	-82.1	144.5	0	0	0	108.3	T24 Y28 L29 R276	T24-L26 PolarHBondContact O-N 3.12Å; L26-Y28 PolarHBondContact O-N 2.94Å; L26-L29 HydrophobicContact CB-CB 4.37Å; L26-L29 HydrophobicContact CB-CD1 3.48Å; L26-L29 VanDerWaalsContact CB-CD1 3.48Å; L26-L29 HydrophobicContact CB-CG 3.77Å; L26-L29 HydrophobicContact CD1-CD1 3.88Å; L26-L29 HydrophobicContact CD2-CD1 3.86Å; L26-L29 HydrophobicContact CD2-CG 3.91Å; L26-L29 HydrophobicContact CG-CD1 3.93Å; L26-L29 HydrophobicContact CG-CG 4.34Å; L26-L29 WeakPolarHBondContact O-CB 3.42Å; L26-L29 PolarHBondContact O-N 3.46Å; L26-R276 HydrophobicContact CD1-CB 4.15Å; L26-R276 HydrophobicContact CD1-CG 4.03Å
27	S	46.3	Very low	53.6	Low	74 Å²	74	92.8 Å²	92.8	52%	0.517	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-53.7	-24.6	171.2	52	0	0	0	0	110.9	S25 L29 N30	S25-S27 PolarHBondContact O-N 3Å; S25-S27 PolarHBondContact O-OG 3.05Å; S27-L29 VanDerWaalsContact C-N 3.3Å; S27-L29 PolarHBondContact O-N 2.77Å; S27-N30 PolarHBondContact O-N 3Å
28	Y	45.8	Very low	56.6	Low	176 Å²	176	94.5 Å²	94.5	69%	0.69	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-64.2	-25.9	170.8	-59.1	-74.4	0	0	0	114.5	L26 N30 A31	L26-Y28 PolarHBondContact O-N 2.94Å; Y28-N30 VanDerWaalsContact C-N 3.26Å; Y28-N30 PolarHBondContact O-N 3.3Å; Y28-A31 PolarHBondContact O-N 2.82Å
29	L	47.5	Very low	59.5	Low	34 Å²	34	92.5 Å²	92.5	18%	0.178	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-74.5	-14.8	176.8	-66.5	173	0	0	0	113.2	L26 S27 A31 T240 R276 F318	L26-L29 HydrophobicContact CB-CB 4.37Å; L26-L29 HydrophobicContact CB-CD1 3.48Å; L26-L29 VanDerWaalsContact CB-CD1 3.48Å; L26-L29 HydrophobicContact CB-CG 3.77Å; L26-L29 HydrophobicContact CD1-CD1 3.88Å; L26-L29 HydrophobicContact CD2-CD1 3.86Å; L26-L29 HydrophobicContact CD2-CG 3.91Å; L26-L29 HydrophobicContact CG-CD1 3.93Å; L26-L29 HydrophobicContact CG-CG 4.34Å; L26-L29 WeakPolarHBondContact O-CB 3.42Å; L26-L29 PolarHBondContact O-N 3.46Å; S27-L29 VanDerWaalsContact C-N 3.3Å; S27-L29 PolarHBondContact O-N 2.77Å; L29-A31 PolarHBondContact O-N 3.04Å; L29-T240 HydrophobicContact CD2-CG2 3.76Å; L29-R276 WeakPolarHBondContact CD1-O 3.33Å; L29-R276 WeakPolarHBondContact CD2-O 3.27Å; L29-F318 HydrophobicContact CD2-CD2 4.14Å; L29-F318 HydrophobicContact CD2-CE2 3.62Å; L29-F318 HydrophobicContact CD2-CZ 4.19Å
30	N	46.1	Very low	62.5	Low	147 Å²	147	89.4 Å²	89.4	79%	0.786	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-68.5	5	171	-85.5	-5.5	0	0	0	113	S27 Y28 N32	S27-N30 PolarHBondContact O-N 3Å; Y28-N30 VanDerWaalsContact C-N 3.26Å; Y28-N30 PolarHBondContact O-N 3.3Å; N30-N32 PolarHBondContact O-N 2.86Å
31	A	49.5	Very low	65.5	Low	11 Å²	11	81 Å²	81	9%	0.091	45%	0.45	C	S	.	.			trans	-73.5	57.5	166	0	0	0	0	0	111.5	Y28 L29 S33	Y28-A31 PolarHBondContact O-N 2.82Å; L29-A31 PolarHBondContact O-N 3.04Å; A31-S33 PolarHBondContact O-N 2.87Å
32	N	54.4	Low	68.4	Low	140 Å²	140	73.8 Å²	73.8	75%	0.749	43%	0.428	S	S	*	.			trans	-69.4	45.6	152.6	-80.8	-9.5	0	0	0	109.5	N30 S34	N30-N32 PolarHBondContact O-N 2.86Å; N32-S34 PolarHBondContact O-N 3.24Å
33	S	66.2	Low	70.9	Confident	41 Å²	41	71.4 Å²	71.4	29%	0.287	41%	0.41	S	S	.	.			trans	-76.7	111.2	163.7	53.2	0	0	0	0	105.5	A31 Y233	A31-S33 PolarHBondContact O-N 2.87Å; S33-Y233 WeakPolarHBondContact O-CE2 3.45Å; S33-Y233 PolarHBondContact O-OH 3.2Å
34	S	84.7	Confident	73.6	Confident	101 Å²	101	67.7 Å²	67.7	71%	0.706	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-56.9	157.2	158.8	47.2	0	0	0	0	109.3	N32 Y233	N32-S34 PolarHBondContact O-N 3.24Å; S34-Y233 WeakPolarHBondContact O-CE2 3.44Å
35	V	92	Very high	76.2	Confident	11 Å²	11	68.2 Å²	68.2	7%	0.067	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-59.6	130.6	171.7	-172.9	0	0	0	0	107.6	L37 E39 L40 Y233	V35-L37 PolarHBondContact O-N 2.95Å; V35-E39 HydrophobicContact CG1-CB 4Å; V35-E39 HydrophobicContact CG1-CG 4.01Å; V35-L40 HydrophobicContact CB-CD1 4.48Å; V35-L40 HydrophobicContact CB-CD2 3.9Å; V35-L40 HydrophobicContact CB-CG 4.04Å; V35-L40 HydrophobicContact CG1-CD2 3.67Å; V35-L40 HydrophobicContact CG1-CG 3.83Å; V35-L40 HydrophobicContact CG2-CD2 4.34Å; V35-Y233 HydrophobicContact CB-CE1 4.34Å; V35-Y233 HydrophobicContact CG2-CD1 4.08Å; V35-Y233 HydrophobicContact CG2-CE1 3.48Å; V35-Y233 VanDerWaalsContact CG2-CE1 3.48Å; V35-Y233 HydrophobicContact CG2-CE2 4.48Å
36	P	94.1	Very high	78.6	Confident	59 Å²	59	67.8 Å²	67.8	38%	0.383	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-56	136.5	175.7	-25.3	34.6	0	0	0	111.3	I38 E39 L40	P36-I38 HydrophobicContact CB-CG2 4.05Å; P36-I38 PolarHBondContact O-N 2.96Å; P36-E39 HydrophobicContact CB-CB 4.25Å; P36-E39 WeakPolarHBondContact O-CA 3.34Å; P36-E39 WeakPolarHBondContact O-CB 2.8Å; P36-E39 PolarHBondContact O-N 3.19Å; P36-L40 PolarHBondContact O-N 3.38Å; P36-L40 VanDerWaalsContact O-N 3.11Å
37	L	95.6	Very high	81	Confident	84 Å²	84	65.1 Å²	65.1	44%	0.44	35%	0.353	S	S	.	.	H	α-helix	trans	-56.7	-37.5	-178.9	-68.7	-178.9	0	0	0	112.6	V35 E39 L40 S41 A151	V35-L37 PolarHBondContact O-N 2.95Å; L37-E39 VanDerWaalsContact C-N 3.27Å; L37-E39 PolarHBondContact O-N 2.96Å; L37-L40 HydrophobicContact CD2-CD1 4.36Å; L37-L40 PolarHBondContact O-N 3.49Å; L37-S41 PolarHBondContact O-N 3.04Å; L37-A151 VanDerWaalsContact CD2-O 3.25Å; L37-A151 WeakPolarHBondContact CD2-O 3.27Å
38	I	96.9	Very high	83.4	Confident	113 Å²	113	62.2 Å²	62.2	58%	0.579	33%	0.332	S	S	*	.	H	α-helix	trans	-61.2	-35.9	174.7	-172	59.1	0	0	0	112.1	P36 S41 N42	P36-I38 HydrophobicContact CB-CG2 4.05Å; P36-I38 PolarHBondContact O-N 2.96Å; I38-S41 PolarHBondContact O-N 3.4Å; I38-N42 WeakPolarHBondContact O-CB 3.49Å; I38-N42 PolarHBondContact O-N 3.24Å; I38-N42 PolarHBondContact O-ND2 2.01Å; I38-N42 PolarHBondContact O-OD1 3.35Å
39	E	97.3	Very high	85.7	Confident	33 Å²	33	57.3 Å²	57.3	15%	0.154	32%	0.318	C	S	.	.	H	α-helix	trans	-70.3	-42.3	176.6	-177.3	174.7	157.4	0	0	111	V35 P36 L37 S41 N42 R43 S231 Y233	V35-E39 HydrophobicContact CG1-CB 4Å; V35-E39 HydrophobicContact CG1-CG 4.01Å; P36-E39 HydrophobicContact CB-CB 4.25Å; P36-E39 WeakPolarHBondContact O-CA 3.34Å; P36-E39 WeakPolarHBondContact O-CB 2.8Å; P36-E39 PolarHBondContact O-N 3.19Å; L37-E39 VanDerWaalsContact C-N 3.27Å; L37-E39 PolarHBondContact O-N 2.96Å; E39-S41 VanDerWaalsContact C-N 3.33Å; E39-S41 PolarHBondContact O-N 2.95Å; E39-N42 PolarHBondContact O-N 3.37Å; E39-R43 VanDerWaalsContact O-CG 3.24Å; E39-R43 WeakPolarHBondContact O-CG 3.43Å; E39-R43 PolarHBondContact O-N 3.36Å; E39-R43 IonicContact OE1-CZ 3.71Å; E39-R43 IonicContact OE1-NE 3.87Å; E39-R43 IonicContact OE1-NH2 3.91Å; E39-R43 PolarHBondContact OE1-NH2 3.26Å; E39-S231 VanDerWaalsContact CD-OG 3.23Å; E39-S231 VanDerWaalsContact OE1-CB 3.23Å; E39-S231 WeakPolarHBondContact OE1-CB 3.5Å; E39-S231 PolarHBondContact OE1-OG 2.89Å; E39-S231 PolarHBondContact OE2-OG 3.34Å; E39-Y233 WeakPolarHBondContact OE2-CB 3.38Å
40	L	97.9	Very high	88.1	Confident	2 Å²	2	59 Å²	59	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-60.1	-43.1	173.4	-65.2	178.9	0	0	0	111.7	V35 P36 L37 R43 R44 T95	V35-L40 HydrophobicContact CB-CD1 4.48Å; V35-L40 HydrophobicContact CB-CD2 3.9Å; V35-L40 HydrophobicContact CB-CG 4.04Å; V35-L40 HydrophobicContact CG1-CD2 3.67Å; V35-L40 HydrophobicContact CG1-CG 3.83Å; V35-L40 HydrophobicContact CG2-CD2 4.34Å; P36-L40 PolarHBondContact O-N 3.38Å; P36-L40 VanDerWaalsContact O-N 3.11Å; L37-L40 HydrophobicContact CD2-CD1 4.36Å; L37-L40 PolarHBondContact O-N 3.49Å; L40-R43 PolarHBondContact O-N 3.11Å; L40-R44 WeakPolarHBondContact O-CG 3.14Å; L40-R44 PolarHBondContact O-N 3.41Å; L40-T95 WeakPolarHBondContact CD1-O 3.46Å
41	S	98	Very high	90.4	Very high	50 Å²	50	52 Å²	52	35%	0.35	29%	0.286	S	S	.	.	H	α-helix	trans	-59.5	-50.4	175.5	-168.8	0	0	0	0	111.7	L37 I38 E39 R43 R44 E45	L37-S41 PolarHBondContact O-N 3.04Å; I38-S41 PolarHBondContact O-N 3.4Å; E39-S41 VanDerWaalsContact C-N 3.33Å; E39-S41 PolarHBondContact O-N 2.95Å; S41-R43 VanDerWaalsContact C-N 3.31Å; S41-R43 PolarHBondContact O-N 3.21Å; S41-R44 PolarHBondContact O-N 3.42Å; S41-R44 VanDerWaalsContact O-N 3.11Å; S41-E45 PolarHBondContact O-N 3.19Å
42	N	98.1	Very high	92.5	Very high	68 Å²	68	51.7 Å²	51.7	36%	0.364	28%	0.283	S	S	.	.	H	α-helix	trans	-61	-39.3	179.6	-67.9	-6.8	0	0	0	112.1	I38 E39 R44 E45 I46	I38-N42 WeakPolarHBondContact O-CB 3.49Å; I38-N42 PolarHBondContact O-N 3.24Å; I38-N42 PolarHBondContact O-ND2 2.01Å; I38-N42 PolarHBondContact O-OD1 3.35Å; E39-N42 PolarHBondContact O-N 3.37Å; N42-R44 VanDerWaalsContact C-N 3.32Å; N42-R44 PolarHBondContact O-N 3.26Å; N42-E45 PolarHBondContact O-N 3.33Å; N42-I46 WeakPolarHBondContact O-CB 3.42Å; N42-I46 WeakPolarHBondContact O-CD1 3.32Å; N42-I46 WeakPolarHBondContact O-CG1 3.35Å; N42-I46 PolarHBondContact O-N 2.6Å
43	R	98.2	Very high	94.3	Very high	11 Å²	11	49.7 Å²	49.7	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-47.1	175.2	-71	170.4	-175.3	-168.3	-1.2	110.7	E39 L40 S41 F47 Y93 F94 E234 Y321	E39-R43 VanDerWaalsContact O-CG 3.24Å; E39-R43 WeakPolarHBondContact O-CG 3.43Å; E39-R43 PolarHBondContact O-N 3.36Å; E39-R43 IonicContact OE1-CZ 3.71Å; E39-R43 IonicContact OE1-NE 3.87Å; E39-R43 IonicContact OE1-NH2 3.91Å; E39-R43 PolarHBondContact OE1-NH2 3.26Å; L40-R43 PolarHBondContact O-N 3.11Å; S41-R43 VanDerWaalsContact C-N 3.31Å; S41-R43 PolarHBondContact O-N 3.21Å; R43-F47 WeakPolarHBondContact O-CB 3.44Å; R43-F47 PolarHBondContact O-N 3.33Å; R43-F47 VanDerWaalsContact O-N 3.09Å; R43-Y93 HydrophobicContact CB-CE1 3.92Å; R43-Y93 WeakPolarHBondContact CD-O 3.4Å; R43-Y93 HydrophobicContact CG-CE1 3.76Å; R43-Y93 HydrophobicContact CG-CE2 4.37Å; R43-Y93 PolarHBondContact NH1-O 2.81Å; R43-F94 HydrophobicContact CB-CD1 3.94Å; R43-F94 HydrophobicContact CB-CE1 4.14Å; R43-F94 WeakPolarHBondContact O-CE1 3.47Å; R43-E234 IonicContact NH2-OE1 2.65Å; R43-Y321 PolarHBondContact NH2-OH 3.38Å
44	R	98.2	Very high	95.5	Very high	14 Å²	14	48.9 Å²	48.9	5%	0.053	27%	0.265	C	S	.	.	H	α-helix	trans	-65.4	-43.5	179.2	-67.4	-170	-65	-98.4	7.7	112.1	L40 S41 N42 F47 V48 F94 F106 T152 G153	L40-R44 WeakPolarHBondContact O-CG 3.14Å; L40-R44 PolarHBondContact O-N 3.41Å; S41-R44 PolarHBondContact O-N 3.42Å; S41-R44 VanDerWaalsContact O-N 3.11Å; N42-R44 VanDerWaalsContact C-N 3.32Å; N42-R44 PolarHBondContact O-N 3.26Å; R44-F47 WeakPolarHBondContact O-CB 3.27Å; R44-F47 PolarHBondContact O-N 2.6Å; R44-V48 WeakPolarHBondContact O-CB 3.28Å; R44-V48 WeakPolarHBondContact O-CG2 2.98Å; R44-V48 PolarHBondContact O-N 3.35Å; R44-F94 HydrophobicContact CG-CB 4.19Å; R44-F94 HydrophobicContact CG-CD1 3.87Å; R44-F94 HydrophobicContact CG-CG 4.4Å; R44-F94 PolarHBondContact NH1-O 3.12Å; R44-F106 HydrophobicContact CB-CE1 3.93Å; R44-F106 HydrophobicContact CB-CZ 4.09Å; R44-F106 HydrophobicContact CG-CE1 4.07Å; R44-F106 HydrophobicContact CG-CZ 3.84Å; R44-T152 PolarHBondContact NH1-O 2.96Å; R44-T152 PolarHBondContact NH2-O 3.45Å; R44-G153 PolarHBondContact NH2-O 3.39Å; R44-G153 VanDerWaalsContact NH2-O 3.15Å
45	E	97.4	Very high	95.8	Very high	110 Å²	110	44 Å²	44	51%	0.514	23%	0.232	S	C	.	.	H	α-helix	trans	-62.1	-49.3	178.3	-173.1	-175.5	171.1	0	0	112	S41 N42 F47 V48 N49	S41-E45 PolarHBondContact O-N 3.19Å; N42-E45 PolarHBondContact O-N 3.33Å; E45-F47 VanDerWaalsContact C-N 3.26Å; E45-F47 PolarHBondContact O-N 2.79Å; E45-V48 PolarHBondContact O-N 2.91Å; E45-N49 WeakPolarHBondContact O-CB 3.39Å; E45-N49 VanDerWaalsContact O-CG 3.27Å; E45-N49 PolarHBondContact O-N 3Å; E45-N49 PolarHBondContact O-ND2 3.37Å
46	I	98	Very high	95.6	Very high	88 Å²	88	46.7 Å²	46.7	45%	0.451	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-40.5	177.6	-64.7	166.5	0	0	0	110.6	N42 K50 I226	N42-I46 WeakPolarHBondContact O-CB 3.42Å; N42-I46 WeakPolarHBondContact O-CD1 3.32Å; N42-I46 WeakPolarHBondContact O-CG1 3.35Å; N42-I46 PolarHBondContact O-N 2.6Å; I46-K50 WeakPolarHBondContact O-CG 3.27Å; I46-K50 PolarHBondContact O-N 3.14Å; I46-K50 VanDerWaalsContact O-N 3.08Å; I46-I226 HydrophobicContact CG2-CG2 3.59Å
47	F	98.2	Very high	95.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-50.6	177.7	173.7	-112.2	0	0	0	112	R43 R44 E45 N49 K50 V51 V67 I69 F94 F106 P219 L222 I223 I226	R43-F47 WeakPolarHBondContact O-CB 3.44Å; R43-F47 PolarHBondContact O-N 3.33Å; R43-F47 VanDerWaalsContact O-N 3.09Å; R44-F47 WeakPolarHBondContact O-CB 3.27Å; R44-F47 PolarHBondContact O-N 2.6Å; E45-F47 VanDerWaalsContact C-N 3.26Å; E45-F47 PolarHBondContact O-N 2.79Å; F47-N49 VanDerWaalsContact C-N 3.31Å; F47-N49 PolarHBondContact O-N 3.2Å; F47-K50 WeakPolarHBondContact O-CB 3.14Å; F47-K50 PolarHBondContact O-N 3.3Å; F47-K50 VanDerWaalsContact O-N 3.1Å; F47-V51 HydrophobicContact CD2-CG2 4.39Å; F47-V51 HydrophobicContact CE1-CG2 4.09Å; F47-V51 HydrophobicContact CE2-CG2 3.9Å; F47-V51 HydrophobicContact CZ-CG2 3.73Å; F47-V51 WeakPolarHBondContact O-CG2 3.46Å; F47-V51 PolarHBondContact O-N 2.72Å; F47-V67 HydrophobicContact CE1-CB 4.48Å; F47-V67 HydrophobicContact CE1-CG1 3.77Å; F47-V67 HydrophobicContact CE1-CG2 4.47Å; F47-V67 HydrophobicContact CZ-CG1 3.76Å; F47-I69 HydrophobicContact CE1-CD1 4.16Å; F47-I69 HydrophobicContact CZ-CD1 4.37Å; F47-F94 HydrophobicContact CB-CE1 3.66Å; F47-F94 HydrophobicContact CB-CZ 3.72Å; F47-F94 HydrophobicContact CD1-CE1 4.42Å; F47-F94 HydrophobicContact CD1-CZ 4.04Å; F47-F94 AromaticContact CD2-CZ 3.93Å; F47-F94 HydrophobicContact CD2-CZ 3.93Å; F47-F94 HydrophobicContact CG-CE1 4.03Å; F47-F94 HydrophobicContact CG-CE2 4.46Å; F47-F94 AromaticContact CG-CZ 3.6Å; F47-F94 HydrophobicContact CG-CZ 3.6Å; F47-F106 HydrophobicContact CD1-CD2 4.32Å; F47-F106 AromaticContact CD1-CE2 3.93Å; F47-F106 HydrophobicContact CD1-CE2 3.93Å; F47-F106 HydrophobicContact CD1-CZ 4.23Å; F47-F106 AromaticContact CE1-CD2 3.97Å; F47-F106 HydrophobicContact CE1-CD2 3.97Å; F47-F106 AromaticContact CE1-CE2 3.87Å; F47-F106 HydrophobicContact CE1-CE2 3.87Å; F47-P219 HydrophobicContact CE2-CB 4.23Å; F47-P219 HydrophobicContact CZ-CB 3.94Å; F47-L222 HydrophobicContact CD2-CB 4.31Å; F47-L222 HydrophobicContact CE2-CB 4.06Å; F47-I223 HydrophobicContact CD2-CG1 3.83Å; F47-I223 HydrophobicContact CE2-CD1 4.15Å; F47-I223 HydrophobicContact CE2-CG1 3.45Å; F47-I223 VanDerWaalsContact CE2-CG1 3.45Å; F47-I223 HydrophobicContact CZ-CD1 4.39Å; F47-I223 HydrophobicContact CZ-CG1 4.16Å; F47-I226 HydrophobicContact CB-CD1 3.99Å; F47-I226 HydrophobicContact CD2-CD1 4.48Å
48	V	96.6	Very high	95.1	Very high	14 Å²	14	48 Å²	48	9%	0.085	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-42.1	177.4	164.8	0	0	0	0	111.5	R44 E45 K50 V51 N52 F106 W122	R44-V48 WeakPolarHBondContact O-CB 3.28Å; R44-V48 WeakPolarHBondContact O-CG2 2.98Å; R44-V48 PolarHBondContact O-N 3.35Å; E45-V48 PolarHBondContact O-N 2.91Å; V48-K50 VanDerWaalsContact C-N 3.3Å; V48-K50 PolarHBondContact O-N 2.95Å; V48-V51 WeakPolarHBondContact O-CB 3.36Å; V48-V51 PolarHBondContact O-N 2.59Å; V48-V51 VanDerWaalsContact O-N 3.13Å; V48-N52 PolarHBondContact O-N 3.28Å; V48-F106 HydrophobicContact CG2-CD1 3.63Å; V48-F106 HydrophobicContact CG2-CE1 3.99Å; V48-F106 HydrophobicContact CG2-CG 4.16Å; V48-W122 HydrophobicContact CB-CG 4.49Å; V48-W122 HydrophobicContact CG1-CB 3.86Å; V48-W122 HydrophobicContact CG1-CD2 3.63Å; V48-W122 HydrophobicContact CG1-CG 3.27Å; V48-W122 HydrophobicContact CG2-CD2 4.39Å; V48-W122 HydrophobicContact CG2-CG 4.43Å
49	N	95.9	Very high	94.5	Very high	73 Å²	73	49.9 Å²	49.9	39%	0.39	26%	0.258	S	S	.	.	H	α-helix	trans	-61	-38.5	175.9	-72.8	-21.2	0	0	0	112.3	E45 F47 N52 I53	E45-N49 WeakPolarHBondContact O-CB 3.39Å; E45-N49 VanDerWaalsContact O-CG 3.27Å; E45-N49 PolarHBondContact O-N 3Å; E45-N49 PolarHBondContact O-ND2 3.37Å; F47-N49 VanDerWaalsContact C-N 3.31Å; F47-N49 PolarHBondContact O-N 3.2Å; N49-N52 WeakPolarHBondContact O-CB 3.25Å; N49-N52 PolarHBondContact O-N 2.83Å; N49-I53 WeakPolarHBondContact O-CG1 3.46Å; N49-I53 PolarHBondContact O-N 2.83Å; N49-I53 VanDerWaalsContact O-N 3.08Å
50	K	96.3	Very high	93.8	Very high	68 Å²	68	52.8 Å²	52.8	30%	0.296	28%	0.275	S	S	.	.	H	α-helix	trans	-66.4	-41	173.5	-77.6	177.3	176.2	-75.7	0	112.4	I46 F47 V48 N52 I53 C54 L222 S225 I226	I46-K50 WeakPolarHBondContact O-CG 3.27Å; I46-K50 PolarHBondContact O-N 3.14Å; I46-K50 VanDerWaalsContact O-N 3.08Å; F47-K50 WeakPolarHBondContact O-CB 3.14Å; F47-K50 PolarHBondContact O-N 3.3Å; F47-K50 VanDerWaalsContact O-N 3.1Å; V48-K50 VanDerWaalsContact C-N 3.3Å; V48-K50 PolarHBondContact O-N 2.95Å; K50-N52 VanDerWaalsContact C-N 3.32Å; K50-N52 PolarHBondContact O-N 3.1Å; K50-I53 PolarHBondContact O-N 2.98Å; K50-C54 PolarHBondContact O-N 2.76Å; K50-C54 VanDerWaalsContact O-N 3.1Å; K50-L222 HydrophobicContact CB-CD1 4.39Å; K50-L222 HydrophobicContact CB-CD2 4.2Å; K50-S225 VanDerWaalsContact CE-OG 3.27Å; K50-S225 WeakPolarHBondContact CE-OG 3.35Å; K50-S225 PolarHBondContact NZ-OG 2.8Å; K50-I226 HydrophobicContact CD-CG2 3.52Å
51	V	95.4	Very high	93.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-42.3	174.8	177	0	0	0	0	110.5	F47 V48 I53 C54 A55 V67 W122 W180 L222	F47-V51 HydrophobicContact CD2-CG2 4.39Å; F47-V51 HydrophobicContact CE1-CG2 4.09Å; F47-V51 HydrophobicContact CE2-CG2 3.9Å; F47-V51 HydrophobicContact CZ-CG2 3.73Å; F47-V51 WeakPolarHBondContact O-CG2 3.46Å; F47-V51 PolarHBondContact O-N 2.72Å; V48-V51 WeakPolarHBondContact O-CB 3.36Å; V48-V51 PolarHBondContact O-N 2.59Å; V48-V51 VanDerWaalsContact O-N 3.13Å; V51-I53 PolarHBondContact O-N 2.93Å; V51-C54 PolarHBondContact O-N 3.5Å; V51-A55 VanDerWaalsContact O-CB 3.3Å; V51-A55 WeakPolarHBondContact O-CB 3.25Å; V51-A55 PolarHBondContact O-N 3.29Å; V51-V67 HydrophobicContact CG1-CG2 4.24Å; V51-V67 HydrophobicContact CG2-CG2 4.38Å; V51-W122 HydrophobicContact CB-CH2 4.29Å; V51-W122 HydrophobicContact CB-CZ2 4.22Å; V51-W122 HydrophobicContact CG1-CH2 3.46Å; V51-W122 VanDerWaalsContact CG1-CH2 3.46Å; V51-W122 HydrophobicContact CG1-CZ2 3.65Å; V51-W180 HydrophobicContact CG1-CD2 4.29Å; V51-W180 HydrophobicContact CG1-CH2 4.48Å; V51-W180 HydrophobicContact CG1-CZ2 3.69Å; V51-L222 HydrophobicContact CB-CD1 4.5Å; V51-L222 HydrophobicContact CG2-CD1 3.77Å
52	N	92.4	Very high	92.6	Very high	6 Å²	6	54.4 Å²	54.4	3%	0.032	28%	0.275	C	S	.	.	H	α-helix	trans	-57	-47.1	174.7	-88.8	-18.8	0	0	0	112.7	V48 N49 K50 C54 A55 K56 W122	V48-N52 PolarHBondContact O-N 3.28Å; N49-N52 WeakPolarHBondContact O-CB 3.25Å; N49-N52 PolarHBondContact O-N 2.83Å; K50-N52 VanDerWaalsContact C-N 3.32Å; K50-N52 PolarHBondContact O-N 3.1Å; N52-C54 VanDerWaalsContact C-N 3.34Å; N52-C54 PolarHBondContact O-N 3.45Å; N52-A55 PolarHBondContact O-N 2.96Å; N52-K56 WeakPolarHBondContact O-CG 3.36Å; N52-K56 PolarHBondContact O-N 3.27Å; N52-W122 PolarHBondContact ND2-NE1 3.37Å; N52-W122 PolarHBondContact OD1-NE1 2.74Å
53	I	92.9	Very high	92	Very high	98 Å²	98	52.1 Å²	52.1	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-59.5	-46.9	177.6	-68.1	163.8	0	0	0	110.5	N49 K50 V51 K56 Q57	N49-I53 WeakPolarHBondContact O-CG1 3.46Å; N49-I53 PolarHBondContact O-N 2.83Å; N49-I53 VanDerWaalsContact O-N 3.08Å; K50-I53 PolarHBondContact O-N 2.98Å; V51-I53 PolarHBondContact O-N 2.93Å; I53-K56 PolarHBondContact O-N 3.11Å; I53-Q57 WeakPolarHBondContact O-CG 3.26Å; I53-Q57 PolarHBondContact O-N 2.78Å
54	C	92.4	Very high	91.7	Very high	23 Å²	23	51.8 Å²	51.8	16%	0.155	26%	0.263	C	S	.	.	H	α-helix	trans	-66.9	-40.1	178.3	-68.8	0	0	0	0	112.4	K50 V51 N52 K56 Q57 M58 W180 Y221	K50-C54 PolarHBondContact O-N 2.76Å; K50-C54 VanDerWaalsContact O-N 3.1Å; V51-C54 PolarHBondContact O-N 3.5Å; N52-C54 VanDerWaalsContact C-N 3.34Å; N52-C54 PolarHBondContact O-N 3.45Å; C54-K56 VanDerWaalsContact C-N 3.29Å; C54-K56 PolarHBondContact O-N 2.89Å; C54-Q57 PolarHBondContact O-N 2.82Å; C54-M58 WeakPolarHBondContact O-CG 3.41Å; C54-M58 PolarHBondContact O-N 3Å; C54-W180 HydrophobicContact CB-CH2 3.69Å; C54-W180 HydrophobicContact CB-CZ2 4.36Å; C54-Y221 PolarHBondContact SG-OH 3Å
55	A	90.1	Very high	91.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-40.5	175.9	0	0	0	0	0	111.7	V51 N52 Q57 M58 R114 L120	V51-A55 VanDerWaalsContact O-CB 3.3Å; V51-A55 WeakPolarHBondContact O-CB 3.25Å; V51-A55 PolarHBondContact O-N 3.29Å; N52-A55 PolarHBondContact O-N 2.96Å; A55-Q57 PolarHBondContact O-N 3.23Å; A55-M58 PolarHBondContact O-N 2.93Å; A55-R114 PolarHBondContact O-NH2 2.77Å; A55-L120 HydrophobicContact CB-CD1 4.46Å
56	K	87.8	Confident	91.4	Very high	67 Å²	67	45.9 Å²	45.9	29%	0.291	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-21.7	174.9	-70.1	-179.9	-174	-174.4	0	113.7	N52 I53 C54 R114 D119	N52-K56 WeakPolarHBondContact O-CG 3.36Å; N52-K56 PolarHBondContact O-N 3.27Å; I53-K56 PolarHBondContact O-N 3.11Å; C54-K56 VanDerWaalsContact C-N 3.29Å; C54-K56 PolarHBondContact O-N 2.89Å; K56-R114 VanDerWaalsContact N-NH2 3.17Å; K56-D119 WeakPolarHBondContact CE-OD1 3.25Å; K56-D119 IonicContact NZ-OD1 2.75Å; K56-D119 PolarHBondContact NZ-OD1 3.44Å
57	Q	89.4	Confident	91.5	Very high	150 Å²	150	41.7 Å²	41.7	70%	0.701	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-4.1	-180	-64.2	172.4	-7.6	0	0	113.4	I53 C54 A55	I53-Q57 WeakPolarHBondContact O-CG 3.26Å; I53-Q57 PolarHBondContact O-N 2.78Å; C54-Q57 PolarHBondContact O-N 2.82Å; A55-Q57 PolarHBondContact O-N 3.23Å
58	M	89.2	Confident	91.5	Very high	20 Å²	20	41.9 Å²	41.9	10%	0.099	22%	0.216	C	C	.	.			trans	-69.6	131.5	179.8	-71.2	-174.6	176.3	0	0	111.7	C54 A55 N60 K61 P62 W180 E217	C54-M58 WeakPolarHBondContact O-CG 3.41Å; C54-M58 PolarHBondContact O-N 3Å; A55-M58 PolarHBondContact O-N 2.93Å; M58-N60 VanDerWaalsContact C-N 3.32Å; M58-N60 PolarHBondContact O-N 3.16Å; M58-K61 WeakPolarHBondContact O-CG 3.41Å; M58-K61 PolarHBondContact O-N 2.96Å; M58-K61 VanDerWaalsContact O-N 3.14Å; M58-P62 HydrophobicContact SD-CG 4.09Å; M58-W180 HydrophobicContact CE-CH2 3.36Å; M58-W180 HydrophobicContact CE-CZ2 3.08Å; M58-W180 HydrophobicContact CE-CZ3 4.32Å; M58-E217 HydrophobicContact CE-CB 4.44Å; M58-E217 HydrophobicContact CE-CG 3.75Å
59	V	85.1	Confident	91.5	Very high	153 Å²	153	41.5 Å²	41.5	93%	0.927	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-41.5	-179.8	178.9	0	0	0	0	112	K61	V59-K61 VanDerWaalsContact C-N 3.29Å; V59-K61 PolarHBondContact O-N 2.9Å
60	N	81.9	Confident	91.6	Very high	94 Å²	94	38.3 Å²	38.3	50%	0.503	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.1	-179.2	62.4	-22.5	0	0	0	113.9	M58 P62 S215	M58-N60 VanDerWaalsContact C-N 3.32Å; M58-N60 PolarHBondContact O-N 3.16Å; N60-P62 WeakPolarHBondContact OD1-CD 3.25Å; N60-S215 PolarHBondContact ND2-OG 3.46Å
61	K	83.4	Confident	91.7	Very high	85 Å²	85	35.1 Å²	35.1	37%	0.37	18%	0.183	S	C	.	.			trans	33.6	64.8	-178.8	-63.7	-172.5	177.6	-171.4	0	114	M58 V59 S63 D116	M58-K61 WeakPolarHBondContact O-CG 3.41Å; M58-K61 PolarHBondContact O-N 2.96Å; M58-K61 VanDerWaalsContact O-N 3.14Å; V59-K61 VanDerWaalsContact C-N 3.29Å; V59-K61 PolarHBondContact O-N 2.9Å; K61-S63 PolarHBondContact O-N 3.32Å; K61-D116 IonicContact NZ-OD1 3.65Å; K61-D116 PolarHBondContact NZ-OD1 3.33Å; K61-D116 IonicContact NZ-OD2 3.04Å; K61-D116 PolarHBondContact NZ-OD2 3.21Å
62	P	87.6	Confident	91.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.			trans	-56.5	139.5	179.5	-20.7	33.7	0	0	0	111.3	M58 N60 H65 S176 C178	M58-P62 HydrophobicContact SD-CG 4.09Å; N60-P62 WeakPolarHBondContact OD1-CD 3.25Å; P62-H65 PolarHBondContact O-NE2 3.39Å; P62-S176 WeakPolarHBondContact CA-OG 3.37Å; P62-C178 HydrophobicContact CB-CB 3.72Å; P62-C178 HydrophobicContact CG-CB 3.58Å
63	S	86.3	Confident	91.9	Very high	21 Å²	21	37.3 Å²	37.3	15%	0.147	20%	0.195	C	C	.	.	S	Bend	trans	-81.9	-21.7	180	-51.2	0	0	0	0	112.7	K61 S176	K61-S63 PolarHBondContact O-N 3.32Å; S63-S176 PolarHBondContact N-O 2.87Å; S63-S176 PolarHBondContact N-OG 3.35Å
64	Y	91	Very high	91.9	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.2	-177.9	-170.5	-119	0	0	0	111	I66 C107 T108 K110 Q170 S176 I177 C178	Y64-I66 HydrophobicContact CD1-CD1 4.25Å; Y64-I66 HydrophobicContact CD1-CG1 3.97Å; Y64-I66 HydrophobicContact CE1-CD1 3.63Å; Y64-I66 HydrophobicContact CE1-CG1 3.46Å; Y64-I66 VanDerWaalsContact CE1-CG1 3.46Å; Y64-C107 HydrophobicContact CE2-CB 4.41Å; Y64-C107 WeakPolarHBondContact OH-CB 3.42Å; Y64-T108 WeakPolarHBondContact CE2-O 3.38Å; Y64-K110 HydrophobicContact CD2-CG 3.83Å; Y64-K110 HydrophobicContact CE2-CG 3.75Å; Y64-Q170 HydrophobicContact CE1-CB 4.09Å; Y64-Q170 HydrophobicContact CE1-CG 4.15Å; Y64-Q170 PolarHBondContact OH-OE1 3.34Å; Y64-Q170 VanDerWaalsContact OH-OE1 3.07Å; Y64-S176 PolarHBondContact N-O 3.18Å; Y64-S176 VanDerWaalsContact N-O 3.1Å; Y64-I177 HydrophobicContact CD1-CD1 4.33Å; Y64-I177 HydrophobicContact CD1-CG1 4.03Å; Y64-I177 HydrophobicContact CD1-CG2 4.05Å; Y64-I177 CarbonylContact O-C 3.57Å; Y64-I177 VanDerWaalsContact O-CA 3.32Å; Y64-I177 WeakPolarHBondContact O-CA 3.45Å; Y64-C178 PolarHBondContact O-N 2.89Å
65	H	94.2	Very high	92	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.6	178.1	-65.9	-91.1	0	0	0	110.9	P62 C107 T108 W122 C178 W180	P62-H65 PolarHBondContact O-NE2 3.39Å; H65-C107 VanDerWaalsContact O-CA 3.23Å; H65-C107 WeakPolarHBondContact O-CA 3.38Å; H65-T108 HydrophobicContact CB-CG2 3.98Å; H65-T108 PolarHBondContact N-OG1 3.18Å; H65-T108 VanDerWaalsContact N-OG1 3.11Å; H65-T108 PolarHBondContact O-N 3.38Å; H65-T108 VanDerWaalsContact O-N 3.1Å; H65-W122 HydrophobicContact CB-CH2 3.65Å; H65-W122 HydrophobicContact CB-CZ2 4.33Å; H65-W122 HydrophobicContact CB-CZ3 4.26Å; H65-C178 WeakPolarHBondContact CA-O 3.31Å; H65-W180 AromaticContact ND1-NE1 3.31Å; H65-W180 PolarHBondContact ND1-NE1 3.13Å
66	I	96.3	Very high	92.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.6	172.1	-50.7	176.4	0	0	0	107.5	Y64 V68 L105 F106 C107 Q170 I177 C178 V179 W180 F205	Y64-I66 HydrophobicContact CD1-CD1 4.25Å; Y64-I66 HydrophobicContact CD1-CG1 3.97Å; Y64-I66 HydrophobicContact CE1-CD1 3.63Å; Y64-I66 HydrophobicContact CE1-CG1 3.46Å; Y64-I66 VanDerWaalsContact CE1-CG1 3.46Å; I66-V68 HydrophobicContact CG2-CG2 3.94Å; I66-L105 HydrophobicContact CG2-CD1 3.71Å; I66-L105 HydrophobicContact CG2-CD2 4.4Å; I66-L105 HydrophobicContact CG2-CG 3.98Å; I66-F106 CarbonylContact C-O 3.56Å; I66-F106 WeakPolarHBondContact CA-O 3.28Å; I66-C107 HydrophobicContact CG1-CB 4.5Å; I66-Q170 HydrophobicContact CD1-CB 4.37Å; I66-Q170 HydrophobicContact CD1-CG 4.4Å; I66-I177 HydrophobicContact CD1-CG2 4.18Å; I66-I177 HydrophobicContact CG1-CG2 4.37Å; I66-C178 PolarHBondContact N-O 3.37Å; I66-V179 CarbonylContact O-C 3.56Å; I66-V179 VanDerWaalsContact O-CA 3.31Å; I66-V179 WeakPolarHBondContact O-CA 3.49Å; I66-W180 PolarHBondContact O-N 2.88Å; I66-F205 HydrophobicContact CD1-CE1 3.96Å; I66-F205 HydrophobicContact CD1-CZ 3.8Å
67	V	98.2	Very high	92.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.5	171.4	-175.4	0	0	0	0	109	F47 V51 I69 L105 F106 W122 W180 P219	F47-V67 HydrophobicContact CE1-CB 4.48Å; F47-V67 HydrophobicContact CE1-CG1 3.77Å; F47-V67 HydrophobicContact CE1-CG2 4.47Å; F47-V67 HydrophobicContact CZ-CG1 3.76Å; V51-V67 HydrophobicContact CG1-CG2 4.24Å; V51-V67 HydrophobicContact CG2-CG2 4.38Å; V67-I69 HydrophobicContact CG1-CG1 4.17Å; V67-L105 VanDerWaalsContact O-CA 3.28Å; V67-L105 WeakPolarHBondContact O-CA 3.27Å; V67-F106 HydrophobicContact CB-CB 4.09Å; V67-F106 HydrophobicContact CB-CD2 4.04Å; V67-F106 HydrophobicContact CG1-CD2 4.24Å; V67-F106 HydrophobicContact CG2-CB 4.36Å; V67-F106 PolarHBondContact N-O 3.23Å; V67-F106 PolarHBondContact O-N 3.29Å; V67-W122 HydrophobicContact CG2-CH2 4.08Å; V67-W122 HydrophobicContact CG2-CZ3 3.89Å; V67-W180 HydrophobicContact CB-CB 4.12Å; V67-W180 HydrophobicContact CG1-CB 3.98Å; V67-W180 HydrophobicContact CG2-CB 3.84Å; V67-W180 HydrophobicContact CG2-CG 3.88Å; V67-P219 HydrophobicContact CG1-CB 4.31Å
68	V	98.4	Very high	92.5	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	113	-176	-175.6	0	0	0	0	109.5	I66 I103 L105 V179 W180 Y181 V198 I202	I66-V68 HydrophobicContact CG2-CG2 3.94Å; V68-I103 HydrophobicContact CG1-CG2 3.8Å; V68-L105 HydrophobicContact CG2-CD1 4.45Å; V68-V179 HydrophobicContact CG2-CG1 4.3Å; V68-W180 PolarHBondContact N-O 3.46Å; V68-Y181 HydrophobicContact CB-CD2 3.89Å; V68-Y181 HydrophobicContact CB-CG 4.43Å; V68-Y181 HydrophobicContact CG1-CD2 4.01Å; V68-Y181 HydrophobicContact CG1-CE2 4.23Å; V68-V198 HydrophobicContact CG1-CG1 3.71Å; V68-I202 HydrophobicContact CG1-CD1 4.45Å; V68-I202 HydrophobicContact CG2-CD1 3.89Å
69	I	97.8	Very high	92.7	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	99	176.4	-53.5	-176.8	0	0	0	107.9	F47 V67 N90 F91 F94 L104 F106 I223	F47-I69 HydrophobicContact CE1-CD1 4.16Å; F47-I69 HydrophobicContact CZ-CD1 4.37Å; V67-I69 HydrophobicContact CG1-CG1 4.17Å; I69-N90 HydrophobicContact CG2-CB 4.08Å; I69-F91 HydrophobicContact CG2-CB 4.1Å; I69-F91 WeakPolarHBondContact O-CD2 3.36Å; I69-F94 HydrophobicContact CD1-CD2 3.58Å; I69-F94 HydrophobicContact CD1-CE2 3.52Å; I69-L104 HydrophobicContact CB-CB 4.31Å; I69-L104 PolarHBondContact N-O 3.28Å; I69-L104 PolarHBondContact O-N 3.49Å; I69-F106 HydrophobicContact CD1-CE2 4.06Å; I69-I223 HydrophobicContact CD1-CD1 3.98Å
70	P	98	Very high	92.7	Very high	7 Å²	7	49.5 Å²	49.5	5%	0.045	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	145	-177.9	33.3	-36	0	0	0	112	D88 F91 Y181 N195 V198	P70-D88 WeakPolarHBondContact O-CB 3.37Å; P70-F91 WeakPolarHBondContact O-CB 3.41Å; P70-Y181 HydrophobicContact CG-CE2 4.04Å; P70-N195 HydrophobicContact CB-CB 3.94Å; P70-V198 HydrophobicContact CB-CB 4.24Å; P70-V198 HydrophobicContact CB-CG1 4.22Å; P70-V198 HydrophobicContact CB-CG2 3.96Å
71	A	97.6	Very high	93.2	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.008	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-70.2	158.7	159.5	0	0	0	0	0	110.4	F91 G102 N195	A71-F91 HydrophobicContact CB-CD1 3.6Å; A71-F91 HydrophobicContact CB-CD2 4Å; A71-F91 HydrophobicContact CB-CE1 3.6Å; A71-F91 HydrophobicContact CB-CE2 4.02Å; A71-F91 HydrophobicContact CB-CG 3.79Å; A71-F91 HydrophobicContact CB-CZ 3.82Å; A71-G102 PolarHBondContact N-O 3.33Å; A71-N195 PolarHBondContact O-ND2 2.88Å
72	S	96.8	Very high	93.7	Very high	18 Å²	18	47.8 Å²	47.8	13%	0.126	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-66.8	148.5	172.4	-73.3	0	0	0	0	111.6	H86 D88 P100 N101	S72-H86 WeakPolarHBondContact CB-O 3.14Å; S72-H86 PolarHBondContact OG-O 3.2Å; S72-D88 PolarHBondContact OG-N 2.91Å; S72-P100 WeakPolarHBondContact O-CA 3.38Å; S72-N101 PolarHBondContact O-N 3.14Å
73	E	95.1	Very high	93.9	Very high	34 Å²	34	53.1 Å²	53.1	16%	0.159	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-86.6	157.5	165	63.5	-178.3	-141.4	0	0	110.2	Q75 K196	E73-Q75 PolarHBondContact O-N 3.06Å; E73-K196 WeakPolarHBondContact OE1-CE 3.21Å; E73-K196 IonicContact OE1-NZ 2.81Å; E73-K196 PolarHBondContact OE1-NZ 3.28Å; E73-K196 PolarHBondContact OE2-N 3.32Å
74	I	93.2	Very high	94.2	Very high	42 Å²	42	57.8 Å²	57.8	22%	0.215	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-65.2	128	170.5	-63	175.7	0	0	0	108.8	Y76 P82 F85 P100	I74-Y76 HydrophobicContact CB-CE2 4.18Å; I74-Y76 HydrophobicContact CG2-CD2 4.34Å; I74-Y76 HydrophobicContact CG2-CE1 4.42Å; I74-Y76 HydrophobicContact CG2-CE2 3.83Å; I74-P82 HydrophobicContact CG2-CB 3.53Å; I74-F85 HydrophobicContact CG1-CD2 4.24Å; I74-P100 HydrophobicContact CD1-CB 4.3Å; I74-P100 HydrophobicContact CD1-CG 4.13Å; I74-P100 HydrophobicContact CG1-CB 3.76Å; I74-P100 HydrophobicContact CG1-CG 4.12Å
75	Q	94.2	Very high	94.2	Very high	94 Å²	94	60.4 Å²	60.4	44%	0.439	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-95.9	141.6	173.1	-62.1	-159.6	-28	0	0	110.9	E73 P82 Y83	E73-Q75 PolarHBondContact O-N 3.06Å; Q75-P82 CarbonylContact O-C 3.55Å; Q75-P82 WeakPolarHBondContact O-CA 3.49Å; Q75-Y83 HydrophobicContact CB-CD2 4.24Å; Q75-Y83 PolarHBondContact O-N 3.01Å
76	Y	93	Very high	94.1	Very high	127 Å²	127	64.8 Å²	64.8	50%	0.498	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.9	-175.2	-68.8	-93.7	0	0	0	111.4	I74 V81 P82	I74-Y76 HydrophobicContact CB-CE2 4.18Å; I74-Y76 HydrophobicContact CG2-CD2 4.34Å; I74-Y76 HydrophobicContact CG2-CE1 4.42Å; I74-Y76 HydrophobicContact CG2-CE2 3.83Å; Y76-V81 CarbonylContact C-O 3.57Å; Y76-V81 WeakPolarHBondContact CA-O 3.3Å; Y76-P82 HydrophobicContact CD1-CB 4.34Å; Y76-P82 HydrophobicContact CE1-CB 4.32Å
77	M	92.6	Very high	94.1	Very high	116 Å²	116	65.1 Å²	65.1	57%	0.571	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	-40.1	172.5	178.2	-173.1	-75.9	0	0	111.2	V81 Y83	M77-V81 PolarHBondContact N-O 2.73Å; M77-Y83 HydrophobicContact CB-CD1 4.27Å; M77-Y83 HydrophobicContact CB-CD2 3.98Å; M77-Y83 HydrophobicContact CB-CE1 3.96Å; M77-Y83 HydrophobicContact CB-CE2 3.65Å; M77-Y83 HydrophobicContact CB-CG 4.27Å; M77-Y83 HydrophobicContact CE-CD1 3.78Å; M77-Y83 HydrophobicContact CE-CE1 3.35Å; M77-Y83 HydrophobicContact CG-CE1 4.09Å; M77-Y83 HydrophobicContact CG-CE2 4.34Å
78	A	93.5	Very high	93.9	Very high	54 Å²	54	65.8 Å²	65.8	45%	0.446	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	177.7	177.1	0	0	0	0	0	109.6	H80 V81	A78-H80 PolarHBondContact O-N 2.84Å; A78-V81 HydrophobicContact CB-CB 4.14Å; A78-V81 HydrophobicContact CB-CG2 4.31Å; A78-V81 PolarHBondContact N-O 3.13Å; A78-V81 PolarHBondContact O-N 3.04Å
79	Y	91.5	Very high	93.8	Very high	203 Å²	203	68.4 Å²	68.4	80%	0.796	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	114.2	177.4	-173.1	-115	0	0	0	110.7	V81	Y79-V81 PolarHBondContact O-N 2.92Å
80	H	86.9	Confident	93.7	Very high	130 Å²	130	68.6 Å²	68.6	60%	0.602	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	14.3	-174.5	-60.1	-58.7	0	0	0	117	A78	A78-H80 PolarHBondContact O-N 2.84Å
81	V	91.7	Very high	93.7	Very high	74 Å²	74	68.4 Å²	68.4	45%	0.448	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	105.8	174.7	-176.8	0	0	0	0	109.5	Y76 M77 A78 Y79	Y76-V81 CarbonylContact C-O 3.57Å; Y76-V81 WeakPolarHBondContact CA-O 3.3Å; M77-V81 PolarHBondContact N-O 2.73Å; A78-V81 HydrophobicContact CB-CB 4.14Å; A78-V81 HydrophobicContact CB-CG2 4.31Å; A78-V81 PolarHBondContact N-O 3.13Å; A78-V81 PolarHBondContact O-N 3.04Å; Y79-V81 PolarHBondContact O-N 2.92Å
82	P	93.1	Very high	93.6	Very high	70 Å²	70	70 Å²	70	46%	0.455	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	149.4	-179.2	32.7	-35.6	0	0	0	111.9	I74 Q75 Y76	I74-P82 HydrophobicContact CG2-CB 3.53Å; Q75-P82 CarbonylContact O-C 3.55Å; Q75-P82 WeakPolarHBondContact O-CA 3.49Å; Y76-P82 HydrophobicContact CD1-CB 4.34Å; Y76-P82 HydrophobicContact CE1-CB 4.32Å
83	Y	93.5	Very high	93.7	Very high	111 Å²	111	69.9 Å²	69.9	44%	0.435	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-66.9	157.3	154.7	-73.9	-78.2	0	0	0	109.4	Q75 M77 F85	Q75-Y83 HydrophobicContact CB-CD2 4.24Å; Q75-Y83 PolarHBondContact O-N 3.01Å; M77-Y83 HydrophobicContact CB-CD1 4.27Å; M77-Y83 HydrophobicContact CB-CD2 3.98Å; M77-Y83 HydrophobicContact CB-CE1 3.96Å; M77-Y83 HydrophobicContact CB-CE2 3.65Å; M77-Y83 HydrophobicContact CB-CG 4.27Å; M77-Y83 HydrophobicContact CE-CD1 3.78Å; M77-Y83 HydrophobicContact CE-CE1 3.35Å; M77-Y83 HydrophobicContact CG-CE1 4.09Å; M77-Y83 HydrophobicContact CG-CE2 4.34Å; Y83-F85 PolarHBondContact O-N 3.28Å
84	P	90.9	Very high	93.8	Very high	120 Å²	120	68.2 Å²	68.2	78%	0.779	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-50.3	126.7	165.7	-25.7	35.2	0	0	0	110.3	H86	P84-H86 PolarHBondContact O-N 3.02Å
85	F	92.4	Very high	94	Very high	58 Å²	58	66.3 Å²	66.3	25%	0.254	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60.4	137.5	-176.7	177.1	-107.8	0	0	0	111.1	I74 Y83 Q87 N98 P100	I74-F85 HydrophobicContact CG1-CD2 4.24Å; Y83-F85 PolarHBondContact O-N 3.28Å; F85-Q87 HydrophobicContact CE1-CB 3.93Å; F85-Q87 HydrophobicContact CZ-CB 4.23Å; F85-N98 WeakPolarHBondContact CD1-O 3.46Å; F85-N98 WeakPolarHBondContact CE1-O 3.33Å; F85-P100 HydrophobicContact CD2-CB 4.09Å; F85-P100 HydrophobicContact CE2-CB 3.64Å; F85-P100 HydrophobicContact CZ-CB 3.97Å
86	H	92.3	Very high	94.1	Very high	92 Å²	92	63.2 Å²	63.2	43%	0.426	32%	0.323	S	S	.	.			trans	-130.6	125.1	174.2	-177.9	-90.1	0	0	0	109.1	S72 P84 R317	S72-H86 WeakPolarHBondContact CB-O 3.14Å; S72-H86 PolarHBondContact OG-O 3.2Å; P84-H86 PolarHBondContact O-N 3.02Å; H86-R317 PolarHBondContact CD2-NH1 3.4Å; H86-R317 PolarHBondContact NE2-NH1 3.13Å
87	Q	95	Very high	94.1	Very high	7 Å²	7	57.8 Å²	57.8	3%	0.033	30%	0.303	C	S	.	.			trans	-79.4	155.4	-175.8	-172.3	57.2	-76.9	0	0	112.5	F85 F91 F92 L97 N98 E99	F85-Q87 HydrophobicContact CE1-CB 3.93Å; F85-Q87 HydrophobicContact CZ-CB 4.23Å; Q87-F91 HydrophobicContact CG-CD1 4.11Å; Q87-F92 HydrophobicContact CB-CB 4.43Å; Q87-F92 HydrophobicContact CG-CB 3.78Å; Q87-F92 HydrophobicContact CG-CD2 4.21Å; Q87-F92 HydrophobicContact CG-CG 4.41Å; Q87-L97 PolarHBondContact NE2-O 3.4Å; Q87-N98 WeakPolarHBondContact CB-OD1 3.47Å; Q87-E99 PolarHBondContact NE2-O 2.87Å
88	D	95.3	Very high	94.1	Very high	15 Å²	15	56.7 Å²	56.7	8%	0.08	30%	0.299	C	S	.	.			trans	-65.7	125	166.5	178.3	-83.3	0	0	0	109.4	P70 S72 N90 F91 F92	P70-D88 WeakPolarHBondContact O-CB 3.37Å; S72-D88 PolarHBondContact OG-N 2.91Å; D88-N90 VanDerWaalsContact C-N 3.26Å; D88-N90 PolarHBondContact O-N 3.09Å; D88-N90 WeakPolarHBondContact OD1-CA 3.32Å; D88-N90 VanDerWaalsContact OD1-CB 3.3Å; D88-N90 WeakPolarHBondContact OD1-CB 3.4Å; D88-N90 PolarHBondContact OD1-N 3.06Å; D88-F91 HydrophobicContact CB-CB 4.04Å; D88-F91 PolarHBondContact O-N 3.24Å; D88-F91 PolarHBondContact OD1-N 3Å; D88-F92 WeakPolarHBondContact O-CB 3.41Å; D88-F92 PolarHBondContact O-N 3.13Å
89	P	94.6	Very high	94	Very high	58 Å²	58	57.5 Å²	57.5	38%	0.377	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-27.3	-173.2	26.5	-34.9	0	0	0	113	Y93	P89-Y93 WeakPolarHBondContact O-CB 3.29Å; P89-Y93 PolarHBondContact O-N 2.74Å
90	N	96.1	Very high	94.1	Very high	9 Å²	9	48.5 Å²	48.5	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-76.3	-44.2	177.9	-68.5	-15.4	0	0	0	110.2	I69 D88 F92 Y93 F94 D220 I223 R227	I69-N90 HydrophobicContact CG2-CB 4.08Å; D88-N90 VanDerWaalsContact C-N 3.26Å; D88-N90 PolarHBondContact O-N 3.09Å; D88-N90 WeakPolarHBondContact OD1-CA 3.32Å; D88-N90 VanDerWaalsContact OD1-CB 3.3Å; D88-N90 WeakPolarHBondContact OD1-CB 3.4Å; D88-N90 PolarHBondContact OD1-N 3.06Å; N90-F92 PolarHBondContact O-N 2.81Å; N90-Y93 PolarHBondContact O-N 2.89Å; N90-F94 WeakPolarHBondContact O-CD2 3.37Å; N90-F94 PolarHBondContact O-N 2.94Å; N90-D220 PolarHBondContact ND2-OD1 3.04Å; N90-I223 HydrophobicContact CB-CD1 4.11Å; N90-I223 HydrophobicContact CB-CG2 4.23Å; N90-I223 VanDerWaalsContact OD1-CG2 3.32Å; N90-I223 WeakPolarHBondContact OD1-CG2 3.47Å; N90-R227 PolarHBondContact OD1-NH1 2.86Å
91	F	97.6	Very high	94.4	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.018	24%	0.24	C	C	.	.	H	α-helix	trans	-58.3	-48.1	172	-178.8	-94.9	0	0	0	111.4	I69 P70 A71 Q87 D88 Y93 F94 T95 L97 L104 L126	I69-F91 HydrophobicContact CG2-CB 4.1Å; I69-F91 WeakPolarHBondContact O-CD2 3.36Å; P70-F91 WeakPolarHBondContact O-CB 3.41Å; A71-F91 HydrophobicContact CB-CD1 3.6Å; A71-F91 HydrophobicContact CB-CD2 4Å; A71-F91 HydrophobicContact CB-CE1 3.6Å; A71-F91 HydrophobicContact CB-CE2 4.02Å; A71-F91 HydrophobicContact CB-CG 3.79Å; A71-F91 HydrophobicContact CB-CZ 3.82Å; Q87-F91 HydrophobicContact CG-CD1 4.11Å; D88-F91 HydrophobicContact CB-CB 4.04Å; D88-F91 PolarHBondContact O-N 3.24Å; D88-F91 PolarHBondContact OD1-N 3Å; F91-Y93 VanDerWaalsContact C-N 3.32Å; F91-Y93 PolarHBondContact O-N 2.84Å; F91-F94 PolarHBondContact O-N 2.94Å; F91-T95 HydrophobicContact CD2-CG2 4.22Å; F91-T95 HydrophobicContact CE1-CG2 4.39Å; F91-T95 WeakPolarHBondContact CE1-OG1 3.42Å; F91-T95 HydrophobicContact CE2-CG2 3.95Å; F91-T95 HydrophobicContact CZ-CG2 4.04Å; F91-T95 WeakPolarHBondContact O-CB 3.3Å; F91-T95 WeakPolarHBondContact O-CG2 3.38Å; F91-T95 PolarHBondContact O-N 2.91Å; F91-T95 VanDerWaalsContact O-N 3.09Å; F91-T95 PolarHBondContact O-OG1 3.09Å; F91-L97 HydrophobicContact CE1-CB 3.9Å; F91-L97 HydrophobicContact CZ-CB 4.45Å; F91-L104 HydrophobicContact CD2-CB 4.11Å; F91-L104 HydrophobicContact CE2-CB 4.13Å; F91-L126 HydrophobicContact CE2-CD1 4.12Å; F91-L126 HydrophobicContact CZ-CD1 4.19Å
92	F	96.4	Very high	94.6	Very high	34 Å²	34	40.5 Å²	40.5	15%	0.149	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-39.6	178.3	-169.1	-106.3	0	0	0	112	Q87 D88 N90 F94 T95 G96 L97 N98 N319	Q87-F92 HydrophobicContact CB-CB 4.43Å; Q87-F92 HydrophobicContact CG-CB 3.78Å; Q87-F92 HydrophobicContact CG-CD2 4.21Å; Q87-F92 HydrophobicContact CG-CG 4.41Å; D88-F92 WeakPolarHBondContact O-CB 3.41Å; D88-F92 PolarHBondContact O-N 3.13Å; N90-F92 PolarHBondContact O-N 2.81Å; F92-F94 VanDerWaalsContact C-N 3.31Å; F92-F94 PolarHBondContact O-N 3.22Å; F92-T95 PolarHBondContact O-N 2.86Å; F92-G96 VanDerWaalsContact CE2-O 3.3Å; F92-G96 WeakPolarHBondContact CE2-O 3.34Å; F92-G96 WeakPolarHBondContact O-CA 3.18Å; F92-G96 PolarHBondContact O-N 2.99Å; F92-L97 WeakPolarHBondContact CD2-O 3.33Å; F92-N98 HydrophobicContact CD2-CB 4.5Å; F92-N98 HydrophobicContact CE2-CB 4.13Å; F92-N319 WeakPolarHBondContact CE1-O 3.32Å
93	Y	97.7	Very high	94.8	Very high	15 Å²	15	37.1 Å²	37.1	6%	0.059	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-37.2	179.7	-179.8	-103.1	0	0	0	113.1	R43 P89 N90 F91 I226 R227 E234	R43-Y93 HydrophobicContact CB-CE1 3.92Å; R43-Y93 WeakPolarHBondContact CD-O 3.4Å; R43-Y93 HydrophobicContact CG-CE1 3.76Å; R43-Y93 HydrophobicContact CG-CE2 4.37Å; R43-Y93 PolarHBondContact NH1-O 2.81Å; P89-Y93 WeakPolarHBondContact O-CB 3.29Å; P89-Y93 PolarHBondContact O-N 2.74Å; N90-Y93 PolarHBondContact O-N 2.89Å; F91-Y93 VanDerWaalsContact C-N 3.32Å; F91-Y93 PolarHBondContact O-N 2.84Å; Y93-I226 HydrophobicContact CD1-CD1 4.43Å; Y93-I226 HydrophobicContact CE1-CD1 3.63Å; Y93-I226 HydrophobicContact CE1-CG1 3.99Å; Y93-R227 HydrophobicContact CD1-CG 3.99Å; Y93-R227 HydrophobicContact CD2-CG 3.9Å; Y93-R227 HydrophobicContact CE1-CG 3.8Å; Y93-R227 HydrophobicContact CE2-CG 3.7Å; Y93-R227 HydrophobicContact CG-CG 4.03Å; Y93-E234 WeakPolarHBondContact CE2-OE1 3.36Å
94	F	98.4	Very high	95.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-91.8	-19.9	-178.2	-68.8	-63.3	0	0	0	115	R43 R44 F47 I69 N90 F91 F92 L104 I223 I226	R43-F94 HydrophobicContact CB-CD1 3.94Å; R43-F94 HydrophobicContact CB-CE1 4.14Å; R43-F94 WeakPolarHBondContact O-CE1 3.47Å; R44-F94 HydrophobicContact CG-CB 4.19Å; R44-F94 HydrophobicContact CG-CD1 3.87Å; R44-F94 HydrophobicContact CG-CG 4.4Å; R44-F94 PolarHBondContact NH1-O 3.12Å; F47-F94 HydrophobicContact CB-CE1 3.66Å; F47-F94 HydrophobicContact CB-CZ 3.72Å; F47-F94 HydrophobicContact CD1-CE1 4.42Å; F47-F94 HydrophobicContact CD1-CZ 4.04Å; F47-F94 AromaticContact CD2-CZ 3.93Å; F47-F94 HydrophobicContact CD2-CZ 3.93Å; F47-F94 HydrophobicContact CG-CE1 4.03Å; F47-F94 HydrophobicContact CG-CE2 4.46Å; F47-F94 AromaticContact CG-CZ 3.6Å; F47-F94 HydrophobicContact CG-CZ 3.6Å; I69-F94 HydrophobicContact CD1-CD2 3.58Å; I69-F94 HydrophobicContact CD1-CE2 3.52Å; N90-F94 WeakPolarHBondContact O-CD2 3.37Å; N90-F94 PolarHBondContact O-N 2.94Å; F91-F94 PolarHBondContact O-N 2.94Å; F92-F94 VanDerWaalsContact C-N 3.31Å; F92-F94 PolarHBondContact O-N 3.22Å; F94-L104 HydrophobicContact CB-CD2 3.28Å; F94-L104 HydrophobicContact CD2-CD2 4.26Å; F94-L104 HydrophobicContact CG-CD2 3.99Å; F94-I223 HydrophobicContact CE2-CD1 4Å; F94-I223 HydrophobicContact CE2-CG1 3.89Å; F94-I223 HydrophobicContact CE2-CG2 3.92Å; F94-I223 HydrophobicContact CZ-CG1 4.06Å; F94-I223 HydrophobicContact CZ-CG2 4.12Å; F94-I226 HydrophobicContact CE1-CD1 3.63Å; F94-I226 HydrophobicContact CZ-CD1 3.53Å
95	T	97.6	Very high	95.4	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-115.4	-28.6	-173.4	65.9	0	0	0	0	113.3	L40 F91 F92 L97 L104 L126 T152	L40-T95 WeakPolarHBondContact CD1-O 3.46Å; F91-T95 HydrophobicContact CD2-CG2 4.22Å; F91-T95 HydrophobicContact CE1-CG2 4.39Å; F91-T95 WeakPolarHBondContact CE1-OG1 3.42Å; F91-T95 HydrophobicContact CE2-CG2 3.95Å; F91-T95 HydrophobicContact CZ-CG2 4.04Å; F91-T95 WeakPolarHBondContact O-CB 3.3Å; F91-T95 WeakPolarHBondContact O-CG2 3.38Å; F91-T95 PolarHBondContact O-N 2.91Å; F91-T95 VanDerWaalsContact O-N 3.09Å; F91-T95 PolarHBondContact O-OG1 3.09Å; F92-T95 PolarHBondContact O-N 2.86Å; T95-L97 PolarHBondContact O-N 2.9Å; T95-L97 PolarHBondContact OG1-N 3.39Å; T95-L97 VanDerWaalsContact OG1-N 3.08Å; T95-L104 HydrophobicContact CG2-CB 4.12Å; T95-L104 HydrophobicContact CG2-CD1 4.26Å; T95-L104 HydrophobicContact CG2-CD2 3.96Å; T95-L104 HydrophobicContact CG2-CG 4.36Å; T95-L126 HydrophobicContact CG2-CD1 4.13Å; T95-T152 WeakPolarHBondContact O-CG2 3.46Å
96	G	95.2	Very high	95.7	Very high	30 Å²	30	23.4 Å²	23.4	31%	0.309	13%	0.128	S	C	.	.			trans	68.1	4.9	-166.9	0	0	0	0	0	114.2	F92	F92-G96 VanDerWaalsContact CE2-O 3.3Å; F92-G96 WeakPolarHBondContact CE2-O 3.34Å; F92-G96 WeakPolarHBondContact O-CA 3.18Å; F92-G96 PolarHBondContact O-N 2.99Å
97	L	94.6	Very high	95.9	Very high	13 Å²	13	19.2 Å²	19.2	7%	0.068	11%	0.109	C	C	.	.			trans	-89.1	127.4	-175.6	-65.1	-175.8	0	0	0	112.3	Q87 F91 F92 T95 L126 V128 L143 A151 T152	Q87-L97 PolarHBondContact NE2-O 3.4Å; F91-L97 HydrophobicContact CE1-CB 3.9Å; F91-L97 HydrophobicContact CZ-CB 4.45Å; F92-L97 WeakPolarHBondContact CD2-O 3.33Å; T95-L97 PolarHBondContact O-N 2.9Å; T95-L97 PolarHBondContact OG1-N 3.39Å; T95-L97 VanDerWaalsContact OG1-N 3.08Å; L97-L126 HydrophobicContact CD1-CD2 3.9Å; L97-V128 HydrophobicContact CD1-CG1 4.47Å; L97-L143 HydrophobicContact CD1-CD1 4.4Å; L97-L143 HydrophobicContact CD2-CD1 3.71Å; L97-A151 HydrophobicContact CD2-CB 4.02Å; L97-T152 HydrophobicContact CD1-CG2 3.46Å; L97-T152 VanDerWaalsContact CD1-CG2 3.46Å; L97-T152 HydrophobicContact CD2-CG2 3.8Å; L97-T152 HydrophobicContact CG-CG2 3.43Å; L97-T152 VanDerWaalsContact CG-CG2 3.43Å
98	N	92.4	Very high	95.8	Very high	92 Å²	92	19 Å²	19	49%	0.492	11%	0.108	S	C	.	.			trans	-103.9	20.9	176.1	-158.2	50.2	0	0	0	113	F85 Q87 F92	F85-N98 WeakPolarHBondContact CD1-O 3.46Å; F85-N98 WeakPolarHBondContact CE1-O 3.33Å; Q87-N98 WeakPolarHBondContact CB-OD1 3.47Å; F92-N98 HydrophobicContact CD2-CB 4.5Å; F92-N98 HydrophobicContact CE2-CB 4.13Å
99	E	90.8	Very high	95.4	Very high	72 Å²	72	22.1 Å²	22.1	34%	0.336	13%	0.125	S	C	.	.			trans	-80.5	140.5	172.7	-68.5	-58.9	135.2	0	0	110.7	Q87 R131 L143	Q87-E99 PolarHBondContact NE2-O 2.87Å; E99-R131 IonicContact OE2-NH1 2.73Å; E99-R131 IonicContact OE2-NH2 2.74Å; E99-L143 HydrophobicContact CG-CD1 3.92Å; E99-L143 HydrophobicContact CG-CG 4.23Å
100	P	93.4	Very high	94.4	Very high	13 Å²	13	23.3 Å²	23.3	8%	0.084	12%	0.124	C	C	.	.	S	Bend	trans	-66.3	162	170.8	32.6	-36.5	0	0	0	110.2	S72 I74 F85	S72-P100 WeakPolarHBondContact O-CA 3.38Å; I74-P100 HydrophobicContact CD1-CB 4.3Å; I74-P100 HydrophobicContact CD1-CG 4.13Å; I74-P100 HydrophobicContact CG1-CB 3.76Å; I74-P100 HydrophobicContact CG1-CG 4.12Å; F85-P100 HydrophobicContact CD2-CB 4.09Å; F85-P100 HydrophobicContact CE2-CB 3.64Å; F85-P100 HydrophobicContact CZ-CB 3.97Å
101	N	92.9	Very high	93.1	Very high	34 Å²	34	25.2 Å²	25.2	18%	0.182	14%	0.136	C	C	.	.	S	Bend	trans	55.1	92.7	170.4	-55.4	-41.1	0	0	0	113.4	S72 E129 L160	S72-N101 PolarHBondContact O-N 3.14Å; N101-E129 HydrophobicContact CB-CB 3.95Å; N101-E129 PolarHBondContact ND2-OE2 2.78Å; N101-E129 PolarHBondContact O-N 3.33Å; N101-L160 HydrophobicContact CB-CD2 3.82Å
102	G	95.7	Very high	91.4	Very high	2 Å²	2	33.8 Å²	33.8	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166	167.2	177.7	0	0	0	0	0	111	A71 F127	A71-G102 PolarHBondContact N-O 3.33Å; G102-F127 CarbonylContact C-O 3.51Å; G102-F127 WeakPolarHBondContact CA-O 3.39Å
103	I	98.6	Very high	89.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	118.5	-178.6	-46.8	171.7	0	0	0	108	V68 L105 L126 F127 L160 F163 V198	V68-I103 HydrophobicContact CG1-CG2 3.8Å; I103-L105 HydrophobicContact CG2-CB 4.45Å; I103-L126 WeakPolarHBondContact O-CA 3.44Å; I103-F127 HydrophobicContact CB-CB 4.07Å; I103-F127 HydrophobicContact CB-CD2 4.21Å; I103-F127 HydrophobicContact CD1-CB 4.48Å; I103-F127 HydrophobicContact CG1-CB 4.39Å; I103-F127 PolarHBondContact N-O 3.01Å; I103-F127 PolarHBondContact O-N 3.46Å; I103-L160 HydrophobicContact CD1-CD1 3.66Å; I103-L160 HydrophobicContact CG1-CD1 3.8Å; I103-F163 HydrophobicContact CD1-CB 4.05Å; I103-F163 HydrophobicContact CD1-CD1 3.28Å; I103-F163 HydrophobicContact CD1-CD2 3.54Å; I103-F163 HydrophobicContact CD1-CE1 3.42Å; I103-F163 VanDerWaalsContact CD1-CE1 3.42Å; I103-F163 HydrophobicContact CD1-CE2 3.68Å; I103-F163 HydrophobicContact CD1-CG 3.33Å; I103-F163 HydrophobicContact CD1-CZ 3.6Å; I103-F163 HydrophobicContact CG2-CE2 4.18Å; I103-F163 HydrophobicContact CG2-CZ 4.37Å; I103-V198 HydrophobicContact CD1-CG2 3.62Å; I103-V198 HydrophobicContact CG1-CG2 3.67Å
104	L	98.8	Very high	87.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	119.2	162.3	-179.7	68.6	0	0	0	107.2	I69 F91 F94 T95 F106 T124 L126 V154	I69-L104 HydrophobicContact CB-CB 4.31Å; I69-L104 PolarHBondContact N-O 3.28Å; I69-L104 PolarHBondContact O-N 3.49Å; F91-L104 HydrophobicContact CD2-CB 4.11Å; F91-L104 HydrophobicContact CE2-CB 4.13Å; F94-L104 HydrophobicContact CB-CD2 3.28Å; F94-L104 HydrophobicContact CD2-CD2 4.26Å; F94-L104 HydrophobicContact CG-CD2 3.99Å; T95-L104 HydrophobicContact CG2-CB 4.12Å; T95-L104 HydrophobicContact CG2-CD1 4.26Å; T95-L104 HydrophobicContact CG2-CD2 3.96Å; T95-L104 HydrophobicContact CG2-CG 4.36Å; L104-F106 HydrophobicContact CD1-CZ 4.37Å; L104-F106 HydrophobicContact CD2-CE2 3.69Å; L104-F106 HydrophobicContact CD2-CZ 3.64Å; L104-F106 HydrophobicContact CG-CE2 3.8Å; L104-F106 HydrophobicContact CG-CZ 3.95Å; L104-T124 HydrophobicContact CD1-CG2 3.61Å; L104-L126 HydrophobicContact CD1-CD1 4.42Å; L104-V154 HydrophobicContact CD1-CG2 4.33Å
105	L	98.6	Very high	85.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.6	-178.9	-178.9	146.6	0	0	0	110	I66 V67 V68 I103 C107 H125 F127 F163 F166	I66-L105 HydrophobicContact CG2-CD1 3.71Å; I66-L105 HydrophobicContact CG2-CD2 4.4Å; I66-L105 HydrophobicContact CG2-CG 3.98Å; V67-L105 VanDerWaalsContact O-CA 3.28Å; V67-L105 WeakPolarHBondContact O-CA 3.27Å; V68-L105 HydrophobicContact CG2-CD1 4.45Å; I103-L105 HydrophobicContact CG2-CB 4.45Å; L105-C107 HydrophobicContact CD2-CB 3.99Å; L105-H125 HydrophobicContact CB-CB 4.34Å; L105-H125 HydrophobicContact CD2-CB 4.24Å; L105-H125 PolarHBondContact N-O 3.18Å; L105-H125 PolarHBondContact O-N 3.03Å; L105-F127 HydrophobicContact CB-CD2 4.49Å; L105-F127 HydrophobicContact CB-CE2 4.15Å; L105-F127 HydrophobicContact CD1-CE2 4.41Å; L105-F163 HydrophobicContact CD1-CE2 3.8Å; L105-F166 HydrophobicContact CD1-CD1 4.28Å; L105-F166 HydrophobicContact CD1-CE1 3.9Å; L105-F166 HydrophobicContact CD2-CE1 3.73Å; L105-F166 HydrophobicContact CD2-CZ 3.85Å
106	F	98.1	Very high	84.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.9	166.9	-53.7	-91.1	0	0	0	108.1	R44 F47 V48 I66 V67 I69 L104 W122 S123 T124	R44-F106 HydrophobicContact CB-CE1 3.93Å; R44-F106 HydrophobicContact CB-CZ 4.09Å; R44-F106 HydrophobicContact CG-CE1 4.07Å; R44-F106 HydrophobicContact CG-CZ 3.84Å; F47-F106 HydrophobicContact CD1-CD2 4.32Å; F47-F106 AromaticContact CD1-CE2 3.93Å; F47-F106 HydrophobicContact CD1-CE2 3.93Å; F47-F106 HydrophobicContact CD1-CZ 4.23Å; F47-F106 AromaticContact CE1-CD2 3.97Å; F47-F106 HydrophobicContact CE1-CD2 3.97Å; F47-F106 AromaticContact CE1-CE2 3.87Å; F47-F106 HydrophobicContact CE1-CE2 3.87Å; V48-F106 HydrophobicContact CG2-CD1 3.63Å; V48-F106 HydrophobicContact CG2-CE1 3.99Å; V48-F106 HydrophobicContact CG2-CG 4.16Å; I66-F106 CarbonylContact C-O 3.56Å; I66-F106 WeakPolarHBondContact CA-O 3.28Å; V67-F106 HydrophobicContact CB-CB 4.09Å; V67-F106 HydrophobicContact CB-CD2 4.04Å; V67-F106 HydrophobicContact CG1-CD2 4.24Å; V67-F106 HydrophobicContact CG2-CB 4.36Å; V67-F106 PolarHBondContact N-O 3.23Å; V67-F106 PolarHBondContact O-N 3.29Å; I69-F106 HydrophobicContact CD1-CE2 4.06Å; L104-F106 HydrophobicContact CD1-CZ 4.37Å; L104-F106 HydrophobicContact CD2-CE2 3.69Å; L104-F106 HydrophobicContact CD2-CZ 3.64Å; L104-F106 HydrophobicContact CG-CE2 3.8Å; L104-F106 HydrophobicContact CG-CZ 3.95Å; F106-W122 HydrophobicContact CB-CE3 3.68Å; F106-W122 HydrophobicContact CB-CZ3 3.87Å; F106-S123 WeakPolarHBondContact CA-O 3.37Å; F106-T124 HydrophobicContact CD1-CG2 4Å; F106-T124 WeakPolarHBondContact CD1-OG1 3.2Å; F106-T124 HydrophobicContact CE1-CG2 3.68Å; F106-T124 WeakPolarHBondContact CE1-OG1 3.28Å; F106-T124 HydrophobicContact CZ-CG2 4.37Å
107	C	95.5	Very high	82.4	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.027	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.7	169.4	55.6	0	0	0	0	111.6	Y64 H65 I66 L105 W122 S123	Y64-C107 HydrophobicContact CE2-CB 4.41Å; Y64-C107 WeakPolarHBondContact OH-CB 3.42Å; H65-C107 VanDerWaalsContact O-CA 3.23Å; H65-C107 WeakPolarHBondContact O-CA 3.38Å; I66-C107 HydrophobicContact CG1-CB 4.5Å; L105-C107 HydrophobicContact CD2-CB 3.99Å; C107-W122 CarbonylContact O-C 3.47Å; C107-W122 WeakPolarHBondContact O-CA 3.39Å; C107-S123 PolarHBondContact N-O 3.23Å; C107-S123 PolarHBondContact O-N 2.99Å; C107-S123 PolarHBondContact O-OG 3.05Å; C107-S123 PolarHBondContact SG-OG 2.76Å
108	T	92.9	Very high	81	Confident	3 Å²	3	60 Å²	60	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	169.1	175.6	59.5	0	0	0	0	110.8	Y64 H65 L120 N121 W122	Y64-T108 WeakPolarHBondContact CE2-O 3.38Å; H65-T108 HydrophobicContact CB-CG2 3.98Å; H65-T108 PolarHBondContact N-OG1 3.18Å; H65-T108 VanDerWaalsContact N-OG1 3.11Å; H65-T108 PolarHBondContact O-N 3.38Å; H65-T108 VanDerWaalsContact O-N 3.1Å; T108-L120 HydrophobicContact CG2-CB 3.63Å; T108-L120 HydrophobicContact CG2-CD1 3.8Å; T108-L120 HydrophobicContact CG2-CG 4.24Å; T108-N121 CarbonylContact C-O 3.38Å; T108-N121 WeakPolarHBondContact CA-O 3.29Å; T108-W122 HydrophobicContact CG2-CD2 3.56Å; T108-W122 HydrophobicContact CG2-CE3 3.79Å; T108-W122 HydrophobicContact CG2-CG 4.22Å; T108-W122 HydrophobicContact CG2-CH2 3.72Å; T108-W122 HydrophobicContact CG2-CZ2 3.46Å; T108-W122 VanDerWaalsContact CG2-CZ2 3.46Å; T108-W122 HydrophobicContact CG2-CZ3 3.87Å
109	D	87.4	Confident	79.9	Confident	80 Å²	80	60.9 Å²	60.9	43%	0.428	31%	0.307	S	S	.	.			trans	-65.1	154.7	160.4	-73.9	-27.5	0	0	0	110.6	T111 N121	D109-T111 PolarHBondContact O-N 3.25Å; D109-N121 PolarHBondContact N-O 3.41Å; D109-N121 WeakPolarHBondContact OD2-CB 3.37Å; D109-N121 PolarHBondContact OD2-ND2 3.33Å
110	K	74.8	Confident	79.2	Confident	83 Å²	83	58.3 Å²	58.3	36%	0.361	30%	0.296	S	S	.	.			trans	-79.9	101	172.2	-65.5	-177.8	-176.2	177.9	0	107.8	Y64 H169	Y64-K110 HydrophobicContact CD2-CG 3.83Å; Y64-K110 HydrophobicContact CE2-CG 3.75Å; K110-H169 PolarHBondContact NZ-O 3.17Å
111	T	67.9	Low	79	Confident	50 Å²	50	62.6 Å²	62.6	31%	0.307	32%	0.318	S	S	.	.			trans	-102.2	132.7	173.9	58.5	0	0	0	0	111.7	D109 Q175	D109-T111 PolarHBondContact O-N 3.25Å; T111-Q175 PolarHBondContact O-NE2 2.93Å
112	E	61.8	Low	79	Confident	184 Å²	184	62.6 Å²	62.6	86%	0.86	32%	0.315	S	S	*	.	S	Bend	trans	-70.7	-38.4	177.6	-66.8	-171.9	165.3	0	0	111.4
113	E	59	Low	79	Confident	173 Å²	173	64 Å²	64	81%	0.808	33%	0.325	S	S	*	.	S	Bend	trans	-120.4	135.8	-179.2	-65.9	-175.6	172.2	0	0	110.8
114	R	58	Low	79	Confident	45 Å²	45	65.5 Å²	65.5	17%	0.17	33%	0.334	C	S	.	.			trans	-98.2	97.3	175.2	-163	-178.1	-164.4	-84.8	-5.7	107.9	A55 K56 D116	A55-R114 PolarHBondContact O-NH2 2.77Å; K56-R114 VanDerWaalsContact N-NH2 3.17Å; R114-D116 IonicContact NH1-OD1 3.68Å; R114-D116 PolarHBondContact O-N 2.84Å
115	D	59.8	Low	79	Confident	103 Å²	103	66.5 Å²	66.5	55%	0.551	34%	0.339	S	S	*	.			trans	-68	125.2	161.5	-174.1	-5.6	0	0	0	107.5	Q117 S118	D115-Q117 PolarHBondContact O-N 3.46Å; D115-Q117 PolarHBondContact OD1-N 3.34Å; D115-S118 PolarHBondContact O-N 3.03Å; D115-S118 PolarHBondContact O-OG 2.67Å
116	D	60.1	Low	79	Confident	88 Å²	88	66.5 Å²	66.5	47%	0.471	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17	-174.9	-84.9	-26.7	0	0	0	112.5	K61 R114	K61-D116 IonicContact NZ-OD1 3.65Å; K61-D116 PolarHBondContact NZ-OD1 3.33Å; K61-D116 IonicContact NZ-OD2 3.04Å; K61-D116 PolarHBondContact NZ-OD2 3.21Å; R114-D116 IonicContact NH1-OD1 3.68Å; R114-D116 PolarHBondContact O-N 2.84Å
117	Q	59.7	Low	79	Confident	170 Å²	170	66.6 Å²	66.6	79%	0.794	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-27.6	-179	-67.1	-174.7	17.3	0	0	114.8	D115	D115-Q117 PolarHBondContact O-N 3.46Å; D115-Q117 PolarHBondContact OD1-N 3.34Å
118	S	64.3	Low	79	Confident	63 Å²	63	66.9 Å²	66.9	44%	0.441	34%	0.341	S	S	.	.	S	Bend	trans	-77	140.7	-173.9	63.5	0	0	0	0	112.4	D115	D115-S118 PolarHBondContact O-N 3.03Å; D115-S118 PolarHBondContact O-OG 2.67Å
119	D	70.2	Confident	79	Confident	111 Å²	111	70 Å²	70	59%	0.594	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-76.7	136.9	169.9	-73.3	-35.1	0	0	0	109.5	K56 N121	K56-D119 WeakPolarHBondContact CE-OD1 3.25Å; K56-D119 IonicContact NZ-OD1 2.75Å; K56-D119 PolarHBondContact NZ-OD1 3.44Å; D119-N121 PolarHBondContact O-N 3.01Å
120	L	76.8	Confident	79.1	Confident	19 Å²	19	69.5 Å²	69.5	10%	0.099	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-66.7	132.7	174.8	-58.4	168.9	0	0	0	108	A55 T108 W122	A55-L120 HydrophobicContact CB-CD1 4.46Å; T108-L120 HydrophobicContact CG2-CB 3.63Å; T108-L120 HydrophobicContact CG2-CD1 3.8Å; T108-L120 HydrophobicContact CG2-CG 4.24Å; L120-W122 PolarHBondContact O-NE1 3.18Å
121	N	87.5	Confident	79.6	Confident	103 Å²	103	67.4 Å²	67.4	55%	0.551	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-77.6	131.2	171.1	-176.2	34.4	0	0	0	109.1	T108 D109 D119	T108-N121 CarbonylContact C-O 3.38Å; T108-N121 WeakPolarHBondContact CA-O 3.29Å; D109-N121 PolarHBondContact N-O 3.41Å; D109-N121 WeakPolarHBondContact OD2-CB 3.37Å; D109-N121 PolarHBondContact OD2-ND2 3.33Å; D119-N121 PolarHBondContact O-N 3.01Å
122	W	93.7	Very high	80.5	Confident	33 Å²	33	70 Å²	70	13%	0.125	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.7	-175.5	-69.6	81.4	0	0	0	111.6	V48 V51 N52 H65 V67 F106 C107 T108 L120	V48-W122 HydrophobicContact CB-CG 4.49Å; V48-W122 HydrophobicContact CG1-CB 3.86Å; V48-W122 HydrophobicContact CG1-CD2 3.63Å; V48-W122 HydrophobicContact CG1-CG 3.27Å; V48-W122 HydrophobicContact CG2-CD2 4.39Å; V48-W122 HydrophobicContact CG2-CG 4.43Å; V51-W122 HydrophobicContact CB-CH2 4.29Å; V51-W122 HydrophobicContact CB-CZ2 4.22Å; V51-W122 HydrophobicContact CG1-CH2 3.46Å; V51-W122 VanDerWaalsContact CG1-CH2 3.46Å; V51-W122 HydrophobicContact CG1-CZ2 3.65Å; N52-W122 PolarHBondContact ND2-NE1 3.37Å; N52-W122 PolarHBondContact OD1-NE1 2.74Å; H65-W122 HydrophobicContact CB-CH2 3.65Å; H65-W122 HydrophobicContact CB-CZ2 4.33Å; H65-W122 HydrophobicContact CB-CZ3 4.26Å; V67-W122 HydrophobicContact CG2-CH2 4.08Å; V67-W122 HydrophobicContact CG2-CZ3 3.89Å; F106-W122 HydrophobicContact CB-CE3 3.68Å; F106-W122 HydrophobicContact CB-CZ3 3.87Å; C107-W122 CarbonylContact O-C 3.47Å; C107-W122 WeakPolarHBondContact O-CA 3.39Å; T108-W122 HydrophobicContact CG2-CD2 3.56Å; T108-W122 HydrophobicContact CG2-CE3 3.79Å; T108-W122 HydrophobicContact CG2-CG 4.22Å; T108-W122 HydrophobicContact CG2-CH2 3.72Å; T108-W122 HydrophobicContact CG2-CZ2 3.46Å; T108-W122 VanDerWaalsContact CG2-CZ2 3.46Å; T108-W122 HydrophobicContact CG2-CZ3 3.87Å; L120-W122 PolarHBondContact O-NE1 3.18Å
123	S	95.2	Very high	81.7	Confident	32 Å²	32	69.8 Å²	69.8	22%	0.224	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	142.1	164.1	65	0	0	0	0	110.5	F106 C107 H125	F106-S123 WeakPolarHBondContact CA-O 3.37Å; C107-S123 PolarHBondContact N-O 3.23Å; C107-S123 PolarHBondContact O-N 2.99Å; C107-S123 PolarHBondContact O-OG 3.05Å; C107-S123 PolarHBondContact SG-OG 2.76Å; S123-H125 WeakPolarHBondContact CB-NE2 3.39Å; S123-H125 PolarHBondContact OG-CD2 3.33Å; S123-H125 PolarHBondContact OG-NE2 2.85Å
124	T	98.2	Very high	83.1	Confident	31 Å²	31	67.5 Å²	67.5	19%	0.19	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.8	171.9	-55.3	0	0	0	0	108.7	L104 F106 V154 N156	L104-T124 HydrophobicContact CD1-CG2 3.61Å; F106-T124 HydrophobicContact CD1-CG2 4Å; F106-T124 WeakPolarHBondContact CD1-OG1 3.2Å; F106-T124 HydrophobicContact CE1-CG2 3.68Å; F106-T124 WeakPolarHBondContact CE1-OG1 3.28Å; F106-T124 HydrophobicContact CZ-CG2 4.37Å; T124-V154 HydrophobicContact CG2-CG1 3.82Å; T124-V154 HydrophobicContact CG2-CG2 3.89Å; T124-N156 WeakPolarHBondContact O-CB 3.34Å; T124-N156 PolarHBondContact O-ND2 3.1Å; T124-N156 VanDerWaalsContact O-ND2 3.09Å
125	H	98.4	Very high	84.4	Confident	22 Å²	22	66.5 Å²	66.5	10%	0.102	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.2	178.9	-63.7	-100.6	0	0	0	109.8	L105 S123 F127 N156 H158 F166	L105-H125 HydrophobicContact CB-CB 4.34Å; L105-H125 HydrophobicContact CD2-CB 4.24Å; L105-H125 PolarHBondContact N-O 3.18Å; L105-H125 PolarHBondContact O-N 3.03Å; S123-H125 WeakPolarHBondContact CB-NE2 3.39Å; S123-H125 PolarHBondContact OG-CD2 3.33Å; S123-H125 PolarHBondContact OG-NE2 2.85Å; H125-F127 HydrophobicContact CB-CE2 3.93Å; H125-N156 WeakPolarHBondContact CA-O 3.44Å; H125-H158 AromaticContact ND1-CD2 3.92Å; H125-H158 AromaticContact ND1-NE2 3.3Å; H125-H158 PolarHBondContact ND1-NE2 3.5Å; H125-F166 AromaticContact CE1-CE2 3.96Å; H125-F166 AromaticContact ND1-CE2 3.99Å
126	L	98.7	Very high	85.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.1	176.3	-177.1	67.7	0	0	0	109.2	F91 T95 L97 I103 L104 V128 A148 T152 V154 N156 S157 H158	F91-L126 HydrophobicContact CE2-CD1 4.12Å; F91-L126 HydrophobicContact CZ-CD1 4.19Å; T95-L126 HydrophobicContact CG2-CD1 4.13Å; L97-L126 HydrophobicContact CD1-CD2 3.9Å; I103-L126 WeakPolarHBondContact O-CA 3.44Å; L104-L126 HydrophobicContact CD1-CD1 4.42Å; L126-V128 HydrophobicContact CD1-CG1 4.41Å; L126-V128 HydrophobicContact CD2-CG1 3.94Å; L126-V128 HydrophobicContact CG-CG1 3.82Å; L126-A148 HydrophobicContact CD2-CB 4.07Å; L126-T152 HydrophobicContact CD2-CG2 3.84Å; L126-V154 HydrophobicContact CB-CB 4.23Å; L126-V154 HydrophobicContact CB-CG1 3.84Å; L126-N156 PolarHBondContact N-O 3.48Å; L126-S157 CarbonylContact O-C 3.51Å; L126-S157 VanDerWaalsContact O-CA 3.27Å; L126-S157 WeakPolarHBondContact O-CA 3.36Å; L126-H158 PolarHBondContact O-N 3.1Å
127	F	98.5	Very high	87.1	Confident	1 Å²	1	67.1 Å²	67.1	0%	0.004	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.5	172.8	-62.1	-94.5	0	0	0	108.7	G102 I103 L105 H125 H158 L160 F163 F166	G102-F127 CarbonylContact C-O 3.51Å; G102-F127 WeakPolarHBondContact CA-O 3.39Å; I103-F127 HydrophobicContact CB-CB 4.07Å; I103-F127 HydrophobicContact CB-CD2 4.21Å; I103-F127 HydrophobicContact CD1-CB 4.48Å; I103-F127 HydrophobicContact CG1-CB 4.39Å; I103-F127 PolarHBondContact N-O 3.01Å; I103-F127 PolarHBondContact O-N 3.46Å; L105-F127 HydrophobicContact CB-CD2 4.49Å; L105-F127 HydrophobicContact CB-CE2 4.15Å; L105-F127 HydrophobicContact CD1-CE2 4.41Å; H125-F127 HydrophobicContact CB-CE2 3.93Å; F127-H158 CarbonylContact C-O 3.5Å; F127-H158 VanDerWaalsContact CA-O 3.3Å; F127-H158 WeakPolarHBondContact CA-O 3.45Å; F127-H158 HydrophobicContact CD1-CB 3.62Å; F127-H158 HydrophobicContact CE1-CB 3.68Å; F127-H158 HydrophobicContact CG-CB 4.4Å; F127-H158 HydrophobicContact CZ-CB 4.5Å; F127-L160 HydrophobicContact CB-CD1 4.07Å; F127-F163 HydrophobicContact CD1-CB 3.88Å; F127-F163 HydrophobicContact CD1-CD2 4.27Å; F127-F163 AromaticContact CD2-CD2 3.93Å; F127-F163 HydrophobicContact CD2-CD2 3.93Å; F127-F163 HydrophobicContact CE1-CB 4.18Å; F127-F163 HydrophobicContact CE1-CD2 4.23Å; F127-F163 AromaticContact CE2-CD2 3.88Å; F127-F163 HydrophobicContact CE2-CD2 3.88Å; F127-F163 HydrophobicContact CE2-CE2 4.43Å; F127-F163 HydrophobicContact CG-CB 4.25Å; F127-F163 HydrophobicContact CG-CD2 4.14Å; F127-F163 HydrophobicContact CZ-CD2 4.05Å; F127-F166 HydrophobicContact CE1-CB 4.12Å; F127-F166 HydrophobicContact CE1-CG 4.45Å; F127-F166 HydrophobicContact CZ-CB 3.85Å; F127-F166 HydrophobicContact CZ-CD1 4.19Å; F127-F166 AromaticContact CZ-CD2 3.91Å; F127-F166 HydrophobicContact CZ-CD2 3.91Å; F127-F166 AromaticContact CZ-CG 3.71Å; F127-F166 HydrophobicContact CZ-CG 3.71Å
128	V	96.5	Very high	88.3	Confident	11 Å²	11	68.2 Å²	68.2	7%	0.067	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.9	-179.3	-62.2	0	0	0	0	111.4	L97 L126 T130 L145 A148 H158 P159 L160	L97-V128 HydrophobicContact CD1-CG1 4.47Å; L126-V128 HydrophobicContact CD1-CG1 4.41Å; L126-V128 HydrophobicContact CD2-CG1 3.94Å; L126-V128 HydrophobicContact CG-CG1 3.82Å; V128-T130 PolarHBondContact O-N 3.07Å; V128-L145 HydrophobicContact CG2-CD2 3.55Å; V128-A148 HydrophobicContact CG1-CB 4.01Å; V128-A148 HydrophobicContact CG2-CB 4.26Å; V128-H158 PolarHBondContact N-O 2.96Å; V128-P159 CarbonylContact O-C 3.46Å; V128-L160 WeakPolarHBondContact O-CB 3.38Å; V128-L160 PolarHBondContact O-N 2.83Å
129	E	92.7	Very high	89.2	Confident	67 Å²	67	69.8 Å²	69.8	31%	0.313	34%	0.344	S	S	.	.			trans	-64.3	125.4	171	-177.9	171.9	-139.7	0	0	110.5	N101 R131 L160	N101-E129 HydrophobicContact CB-CB 3.95Å; N101-E129 PolarHBondContact ND2-OE2 2.78Å; N101-E129 PolarHBondContact O-N 3.33Å; E129-R131 IonicContact OE2-NH2 3.51Å; E129-L160 HydrophobicContact CB-CD2 4.3Å
130	T	88.4	Confident	90	Very high	71 Å²	71	65.8 Å²	65.8	44%	0.436	33%	0.329	S	S	.	.			trans	-107.1	129.2	173.8	55.1	0	0	0	0	109.2	V128 L145 P159	V128-T130 PolarHBondContact O-N 3.07Å; T130-L145 HydrophobicContact CG2-CD2 3.97Å; T130-P159 HydrophobicContact CG2-CB 4.48Å
131	R	85.3	Confident	90.3	Very high	39 Å²	39	69.8 Å²	69.8	15%	0.147	36%	0.356	C	S	.	.			trans	-99.6	146.8	-177.9	-66.9	178.5	-167.9	124.7	13.8	110.6	E99 E129 A135 E136 G140 P141 S142	E99-R131 IonicContact OE2-NH1 2.73Å; E99-R131 IonicContact OE2-NH2 2.74Å; E129-R131 IonicContact OE2-NH2 3.51Å; R131-A135 HydrophobicContact CB-CB 3.95Å; R131-A135 HydrophobicContact CG-CB 4.16Å; R131-E136 HydrophobicContact CB-CG 3.79Å; R131-G140 PolarHBondContact NH1-O 3.25Å; R131-P141 PolarHBondContact NH1-O 2.84Å; R131-S142 WeakPolarHBondContact CB-OG 3.22Å; R131-S142 PolarHBondContact N-OG 2.64Å
132	N	88	Confident	90.2	Very high	105 Å²	105	65.6 Å²	65.6	56%	0.561	34%	0.335	S	S	*	.			trans	-83.5	165	164.8	67.4	32.3	0	0	0	109.9	H134 A135 E136	N132-H134 PolarHBondContact O-N 3.18Å; N132-H134 WeakPolarHBondContact OD1-CB 3.4Å; N132-H134 PolarHBondContact OD1-N 2.82Å; N132-H134 VanDerWaalsContact OD1-N 3.13Å; N132-A135 PolarHBondContact O-N 3.45Å; N132-A135 PolarHBondContact OD1-N 3.2Å; N132-E136 PolarHBondContact O-N 2.77Å
133	K	86	Confident	89.9	Confident	178 Å²	178	66.1 Å²	66.1	77%	0.774	34%	0.34	S	S	*	.	H	α-helix	trans	-53	-32.8	-179.5	-66.7	-175.7	178	-178.7	0	113.8	I137	K133-I137 WeakPolarHBondContact O-CG1 3.32Å; K133-I137 PolarHBondContact O-N 2.7Å
134	H	88.6	Confident	89.8	Confident	125 Å²	125	68 Å²	68	58%	0.579	35%	0.35	S	S	*	.	H	α-helix	trans	-69.2	-44.3	178	-178.1	79.3	0	0	0	111.6	N132 E136 I137 W138	N132-H134 PolarHBondContact O-N 3.18Å; N132-H134 WeakPolarHBondContact OD1-CB 3.4Å; N132-H134 PolarHBondContact OD1-N 2.82Å; N132-H134 VanDerWaalsContact OD1-N 3.13Å; H134-E136 VanDerWaalsContact C-N 3.31Å; H134-E136 PolarHBondContact O-N 2.83Å; H134-I137 PolarHBondContact O-N 2.99Å; H134-W138 AromaticContact CE1-NE1 3.78Å; H134-W138 AromaticContact NE2-CD1 3.95Å; H134-W138 AromaticContact NE2-NE1 3.62Å
135	A	85.1	Confident	89.6	Confident	25 Å²	25	69.2 Å²	69.2	21%	0.207	36%	0.355	C	S	.	.	H	α-helix	trans	-66.7	-31.8	177	0	0	0	0	0	112.5	R131 N132 W138 N139	R131-A135 HydrophobicContact CB-CB 3.95Å; R131-A135 HydrophobicContact CG-CB 4.16Å; N132-A135 PolarHBondContact O-N 3.45Å; N132-A135 PolarHBondContact OD1-N 3.2Å; A135-W138 PolarHBondContact O-N 3.13Å; A135-N139 WeakPolarHBondContact O-CB 3.29Å; A135-N139 PolarHBondContact O-N 3.37Å; A135-N139 PolarHBondContact O-ND2 2.99Å; A135-N139 VanDerWaalsContact O-ND2 3.1Å
136	E	88.1	Confident	89.4	Confident	66 Å²	66	72 Å²	72	31%	0.308	38%	0.377	S	S	.	.	H	α-helix	trans	-68.6	-30.8	176.3	-66.1	-175	145.8	0	0	113.4	R131 N132 H134 W138 G140 S142	R131-E136 HydrophobicContact CB-CG 3.79Å; N132-E136 PolarHBondContact O-N 2.77Å; H134-E136 VanDerWaalsContact C-N 3.31Å; H134-E136 PolarHBondContact O-N 2.83Å; E136-W138 PolarHBondContact O-N 3.08Å; E136-G140 WeakPolarHBondContact CA-O 3.49Å; E136-G140 CarbonylContact O-C 3.52Å; E136-G140 VanDerWaalsContact O-CA 3.23Å; E136-G140 WeakPolarHBondContact O-CA 3.49Å; E136-G140 PolarHBondContact O-N 3.43Å; E136-S142 PolarHBondContact OE1-N 2.93Å
137	I	88.9	Confident	89.1	Confident	138 Å²	138	76.3 Å²	76.3	71%	0.708	40%	0.397	S	S	*	.	H	α-helix	trans	-60.3	-36.2	173.4	-69.2	164.9	0	0	0	110.9	K133 H134	K133-I137 WeakPolarHBondContact O-CG1 3.32Å; K133-I137 PolarHBondContact O-N 2.7Å; H134-I137 PolarHBondContact O-N 2.99Å
138	W	85.1	Confident	89	Confident	192 Å²	192	76.3 Å²	76.3	73%	0.727	40%	0.397	S	S	*	.	H	α-helix	trans	-87.3	-39.7	-178.3	-71.1	103.2	0	0	0	113.5	H134 A135 E136	H134-W138 AromaticContact CE1-NE1 3.78Å; H134-W138 AromaticContact NE2-CD1 3.95Å; H134-W138 AromaticContact NE2-NE1 3.62Å; A135-W138 PolarHBondContact O-N 3.13Å; E136-W138 PolarHBondContact O-N 3.08Å
139	N	84.1	Confident	88.9	Confident	97 Å²	97	76.9 Å²	76.9	52%	0.519	40%	0.402	S	S	.	.	H	α-helix	trans	-115.7	1	-166.4	-56.6	-66.3	0	0	0	113.9	A135	A135-N139 WeakPolarHBondContact O-CB 3.29Å; A135-N139 PolarHBondContact O-N 3.37Å; A135-N139 PolarHBondContact O-ND2 2.99Å; A135-N139 VanDerWaalsContact O-ND2 3.1Å
140	G	85.4	Confident	89	Confident	26 Å²	26	79.7 Å²	79.7	27%	0.268	42%	0.418	S	S	.	.			trans	78.2	172.6	-170.7	0	0	0	0	0	113.1	R131 E136	R131-G140 PolarHBondContact NH1-O 3.25Å; E136-G140 WeakPolarHBondContact CA-O 3.49Å; E136-G140 CarbonylContact O-C 3.52Å; E136-G140 VanDerWaalsContact O-CA 3.23Å; E136-G140 WeakPolarHBondContact O-CA 3.49Å; E136-G140 PolarHBondContact O-N 3.43Å
141	P	84.6	Confident	89.3	Confident	103 Å²	103	78.6 Å²	78.6	67%	0.669	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-60.1	145.7	-177.1	27.4	-34.9	0	0	0	110.9	R131	R131-P141 PolarHBondContact NH1-O 2.84Å
142	S	85.4	Confident	89.8	Confident	15 Å²	15	76.7 Å²	76.7	11%	0.105	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-97.6	150.3	164.6	56.5	0	0	0	0	110.2	R131 E136 T144	R131-S142 WeakPolarHBondContact CB-OG 3.22Å; R131-S142 PolarHBondContact N-OG 2.64Å; E136-S142 PolarHBondContact OE1-N 2.93Å; S142-T144 PolarHBondContact O-N 2.98Å
143	L	87.3	Confident	90.2	Very high	44 Å²	44	73.3 Å²	73.3	23%	0.23	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-59	132.2	169.1	-66.3	171.5	0	0	0	110.1	L97 E99 E147 A148	L97-L143 HydrophobicContact CD1-CD1 4.4Å; L97-L143 HydrophobicContact CD2-CD1 3.71Å; E99-L143 HydrophobicContact CG-CD1 3.92Å; E99-L143 HydrophobicContact CG-CG 4.23Å; L143-E147 HydrophobicContact CB-CB 4.45Å; L143-E147 HydrophobicContact CD2-CB 3.93Å; L143-A148 HydrophobicContact CB-CB 4.45Å
144	T	91.7	Very high	90.7	Very high	72 Å²	72	65 Å²	65	44%	0.442	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-66.7	160.9	160.8	64.2	0	0	0	0	109.9	S142 S146 E147 A148	S142-T144 PolarHBondContact O-N 2.98Å; T144-S146 PolarHBondContact O-N 3.07Å; T144-E147 WeakPolarHBondContact CB-OE2 3.38Å; T144-E147 WeakPolarHBondContact CG2-OE2 3.34Å; T144-E147 PolarHBondContact N-OE2 3.4Å; T144-E147 PolarHBondContact O-N 2.86Å; T144-E147 WeakPolarHBondContact OG1-CB 3.4Å; T144-E147 VanDerWaalsContact OG1-CD 3.22Å; T144-E147 WeakPolarHBondContact OG1-CG 3.49Å; T144-E147 PolarHBondContact OG1-N 3.42Å; T144-E147 PolarHBondContact OG1-OE2 3.41Å; T144-A148 PolarHBondContact O-N 3.44Å
145	L	94.3	Very high	90.9	Very high	56 Å²	56	65.9 Å²	65.9	29%	0.293	37%	0.372	S	S	.	.	H	α-helix	trans	-59.3	-38.1	177.8	-55.1	-177.5	0	0	0	112	V128 T130 A148 S149 S157 P159	V128-L145 HydrophobicContact CG2-CD2 3.55Å; T130-L145 HydrophobicContact CG2-CD2 3.97Å; L145-A148 PolarHBondContact O-N 3.04Å; L145-S149 PolarHBondContact O-N 3.21Å; L145-S149 PolarHBondContact O-OG 2.82Å; L145-S157 WeakPolarHBondContact O-CB 3.43Å; L145-P159 HydrophobicContact CD1-CG 4.04Å; L145-P159 HydrophobicContact CD2-CG 4.4Å
146	S	94.3	Very high	91.5	Very high	80 Å²	80	68.1 Å²	68.1	56%	0.559	38%	0.381	S	S	*	.	H	α-helix	trans	-65	-45.5	176.6	-174.8	0	0	0	0	111.5	T144 A148 S149 L150	T144-S146 PolarHBondContact O-N 3.07Å; S146-A148 VanDerWaalsContact C-N 3.32Å; S146-A148 PolarHBondContact O-N 3.03Å; S146-S149 PolarHBondContact O-N 3.42Å; S146-L150 WeakPolarHBondContact O-CB 3.27Å; S146-L150 VanDerWaalsContact O-CG 3.3Å; S146-L150 WeakPolarHBondContact O-CG 3.05Å; S146-L150 PolarHBondContact O-N 3.37Å
147	E	93.7	Very high	91.9	Very high	92 Å²	92	65.7 Å²	65.7	43%	0.43	37%	0.371	S	S	.	.	H	α-helix	trans	-63.7	-38	175.9	-70.7	163.3	145.8	0	0	111.9	L143 T144 L150 A151	L143-E147 HydrophobicContact CB-CB 4.45Å; L143-E147 HydrophobicContact CD2-CB 3.93Å; T144-E147 WeakPolarHBondContact CB-OE2 3.38Å; T144-E147 WeakPolarHBondContact CG2-OE2 3.34Å; T144-E147 PolarHBondContact N-OE2 3.4Å; T144-E147 PolarHBondContact O-N 2.86Å; T144-E147 WeakPolarHBondContact OG1-CB 3.4Å; T144-E147 VanDerWaalsContact OG1-CD 3.22Å; T144-E147 WeakPolarHBondContact OG1-CG 3.49Å; T144-E147 PolarHBondContact OG1-N 3.42Å; T144-E147 PolarHBondContact OG1-OE2 3.41Å; E147-L150 PolarHBondContact O-N 3.47Å; E147-A151 WeakPolarHBondContact O-CB 3.41Å; E147-A151 PolarHBondContact O-N 2.76Å
148	A	94.5	Very high	92.4	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-43.8	174.4	0	0	0	0	0	111.8	L126 V128 L143 T144 L145 S146 A151 T152	L126-A148 HydrophobicContact CD2-CB 4.07Å; V128-A148 HydrophobicContact CG1-CB 4.01Å; V128-A148 HydrophobicContact CG2-CB 4.26Å; L143-A148 HydrophobicContact CB-CB 4.45Å; T144-A148 PolarHBondContact O-N 3.44Å; L145-A148 PolarHBondContact O-N 3.04Å; S146-A148 VanDerWaalsContact C-N 3.32Å; S146-A148 PolarHBondContact O-N 3.03Å; A148-A151 PolarHBondContact O-N 3.41Å; A148-T152 WeakPolarHBondContact O-CB 3.34Å; A148-T152 VanDerWaalsContact O-CG2 3.3Å; A148-T152 WeakPolarHBondContact O-CG2 3Å; A148-T152 PolarHBondContact O-N 3.48Å; A148-T152 PolarHBondContact O-OG1 2.95Å
149	S	95.7	Very high	92.9	Very high	24 Å²	24	53.1 Å²	53.1	17%	0.168	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-45.4	174.3	-73.3	0	0	0	0	112.2	L145 S146 A151 T152 G153 V154 S157	L145-S149 PolarHBondContact O-N 3.21Å; L145-S149 PolarHBondContact O-OG 2.82Å; S146-S149 PolarHBondContact O-N 3.42Å; S149-A151 VanDerWaalsContact C-N 3.33Å; S149-A151 PolarHBondContact O-N 2.88Å; S149-T152 PolarHBondContact O-N 2.73Å; S149-G153 WeakPolarHBondContact O-CA 3.45Å; S149-G153 PolarHBondContact O-N 3.36Å; S149-V154 VanDerWaalsContact CA-O 3.31Å; S149-V154 WeakPolarHBondContact CA-O 3.48Å; S149-V154 WeakPolarHBondContact CB-O 3.42Å; S149-V154 PolarHBondContact OG-O 2.74Å; S149-S157 WeakPolarHBondContact OG-CB 3.3Å; S149-S157 PolarHBondContact OG-OG 3.13Å
150	L	94.8	Very high	93.5	Very high	125 Å²	125	49.5 Å²	49.5	65%	0.654	30%	0.3	S	S	*	.	H	α-helix	trans	-63.4	-37.8	177.7	-71.9	170.4	0	0	0	112.5	S146 E147	S146-L150 WeakPolarHBondContact O-CB 3.27Å; S146-L150 VanDerWaalsContact O-CG 3.3Å; S146-L150 WeakPolarHBondContact O-CG 3.05Å; S146-L150 PolarHBondContact O-N 3.37Å; E147-L150 PolarHBondContact O-N 3.47Å
151	A	93.8	Very high	94	Very high	48 Å²	48	52.8 Å²	52.8	40%	0.397	32%	0.318	S	S	.	.	H	α-helix	trans	-75.8	-29.1	-178.6	0	0	0	0	0	113.4	L37 L97 E147 A148 S149	L37-A151 VanDerWaalsContact CD2-O 3.25Å; L37-A151 WeakPolarHBondContact CD2-O 3.27Å; L97-A151 HydrophobicContact CD2-CB 4.02Å; E147-A151 WeakPolarHBondContact O-CB 3.41Å; E147-A151 PolarHBondContact O-N 2.76Å; A148-A151 PolarHBondContact O-N 3.41Å; S149-A151 VanDerWaalsContact C-N 3.33Å; S149-A151 PolarHBondContact O-N 2.88Å
152	T	96.3	Very high	94.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-108.6	-19.4	-173.5	64.4	0	0	0	0	114.5	R44 T95 L97 L126 A148 S149 V154	R44-T152 PolarHBondContact NH1-O 2.96Å; R44-T152 PolarHBondContact NH2-O 3.45Å; T95-T152 WeakPolarHBondContact O-CG2 3.46Å; L97-T152 HydrophobicContact CD1-CG2 3.46Å; L97-T152 VanDerWaalsContact CD1-CG2 3.46Å; L97-T152 HydrophobicContact CD2-CG2 3.8Å; L97-T152 HydrophobicContact CG-CG2 3.43Å; L97-T152 VanDerWaalsContact CG-CG2 3.43Å; L126-T152 HydrophobicContact CD2-CG2 3.84Å; A148-T152 WeakPolarHBondContact O-CB 3.34Å; A148-T152 VanDerWaalsContact O-CG2 3.3Å; A148-T152 WeakPolarHBondContact O-CG2 3Å; A148-T152 PolarHBondContact O-N 3.48Å; A148-T152 PolarHBondContact O-OG1 2.95Å; S149-T152 PolarHBondContact O-N 2.73Å; T152-V154 VanDerWaalsContact C-N 3.26Å; T152-V154 WeakPolarHBondContact OG1-CB 3.34Å; T152-V154 PolarHBondContact OG1-N 3.21Å
153	G	96.1	Very high	95.2	Very high	33 Å²	33	51.4 Å²	51.4	34%	0.34	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	25.5	-168.6	0	0	0	0	0	113.1	R44 S149	R44-G153 PolarHBondContact NH2-O 3.39Å; R44-G153 VanDerWaalsContact NH2-O 3.15Å; S149-G153 WeakPolarHBondContact O-CA 3.45Å; S149-G153 PolarHBondContact O-N 3.36Å
154	V	97.5	Very high	95.6	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.018	30%	0.299	C	S	.	.			trans	-101.5	113.3	172.6	178.6	0	0	0	0	108.7	L104 T124 L126 S149 T152	L104-V154 HydrophobicContact CD1-CG2 4.33Å; T124-V154 HydrophobicContact CG2-CG1 3.82Å; T124-V154 HydrophobicContact CG2-CG2 3.89Å; L126-V154 HydrophobicContact CB-CB 4.23Å; L126-V154 HydrophobicContact CB-CG1 3.84Å; S149-V154 VanDerWaalsContact CA-O 3.31Å; S149-V154 WeakPolarHBondContact CA-O 3.48Å; S149-V154 WeakPolarHBondContact CB-O 3.42Å; S149-V154 PolarHBondContact OG-O 2.74Å; T152-V154 VanDerWaalsContact C-N 3.26Å; T152-V154 WeakPolarHBondContact OG1-CB 3.34Å; T152-V154 PolarHBondContact OG1-N 3.21Å
155	D	92.8	Very high	95.8	Very high	145 Å²	145	54.6 Å²	54.6	78%	0.775	31%	0.31	S	S	*	.	S	Bend	trans	-71	-34.7	-174.8	-60.5	-43.9	0	0	0	112.8	S157	D155-S157 PolarHBondContact O-N 3.25Å; D155-S157 VanDerWaalsContact O-N 3.12Å
156	N	97.1	Very high	95.9	Very high	71 Å²	71	53.6 Å²	53.6	38%	0.38	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	74.2	-177.3	-54.6	-60.7	0	0	0	111.7	T124 H125 L126 H158	T124-N156 WeakPolarHBondContact O-CB 3.34Å; T124-N156 PolarHBondContact O-ND2 3.1Å; T124-N156 VanDerWaalsContact O-ND2 3.09Å; H125-N156 WeakPolarHBondContact CA-O 3.44Å; L126-N156 PolarHBondContact N-O 3.48Å; N156-H158 PolarHBondContact O-CD2 3.07Å; N156-H158 PolarHBondContact O-NE2 2.87Å
157	S	97.5	Very high	95.9	Very high	16 Å²	16	49.9 Å²	49.9	11%	0.112	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	135.2	173.2	-67.4	0	0	0	0	112.5	L126 L145 S149 D155	L126-S157 CarbonylContact O-C 3.51Å; L126-S157 VanDerWaalsContact O-CA 3.27Å; L126-S157 WeakPolarHBondContact O-CA 3.36Å; L145-S157 WeakPolarHBondContact O-CB 3.43Å; S149-S157 WeakPolarHBondContact OG-CB 3.3Å; S149-S157 PolarHBondContact OG-OG 3.13Å; D155-S157 PolarHBondContact O-N 3.25Å; D155-S157 VanDerWaalsContact O-N 3.12Å
158	H	97.9	Very high	95.9	Very high	44 Å²	44	48.7 Å²	48.7	20%	0.204	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152.4	-176.1	-54.5	-83.6	0	0	0	110.7	H125 L126 F127 V128 N156 E162	H125-H158 AromaticContact ND1-CD2 3.92Å; H125-H158 AromaticContact ND1-NE2 3.3Å; H125-H158 PolarHBondContact ND1-NE2 3.5Å; L126-H158 PolarHBondContact O-N 3.1Å; F127-H158 CarbonylContact C-O 3.5Å; F127-H158 VanDerWaalsContact CA-O 3.3Å; F127-H158 WeakPolarHBondContact CA-O 3.45Å; F127-H158 HydrophobicContact CD1-CB 3.62Å; F127-H158 HydrophobicContact CE1-CB 3.68Å; F127-H158 HydrophobicContact CG-CB 4.4Å; F127-H158 HydrophobicContact CZ-CB 4.5Å; V128-H158 PolarHBondContact N-O 2.96Å; N156-H158 PolarHBondContact O-CD2 3.07Å; N156-H158 PolarHBondContact O-NE2 2.87Å; H158-E162 IonicContact ND1-OE2 2.88Å
159	P	96.6	Very high	95.7	Very high	22 Å²	22	54.2 Å²	54.2	14%	0.143	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	140.9	167.4	-18.8	31.9	0	0	0	111.1	V128 T130 L145 S161 E162	V128-P159 CarbonylContact O-C 3.46Å; T130-P159 HydrophobicContact CG2-CB 4.48Å; L145-P159 HydrophobicContact CD1-CG 4.04Å; L145-P159 HydrophobicContact CD2-CG 4.4Å; P159-S161 PolarHBondContact O-N 3.46Å; P159-S161 VanDerWaalsContact O-N 3.1Å; P159-E162 HydrophobicContact CB-CG 4.3Å; P159-E162 HydrophobicContact CG-CG 4.27Å; P159-E162 WeakPolarHBondContact O-CB 3.45Å; P159-E162 PolarHBondContact O-N 2.94Å
160	L	96.6	Very high	95.2	Very high	21 Å²	21	53.7 Å²	53.7	11%	0.11	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-55.9	-30.9	177.8	-175.4	63.4	0	0	0	112.9	N101 I103 F127 V128 E129 E162 F163 F197	N101-L160 HydrophobicContact CB-CD2 3.82Å; I103-L160 HydrophobicContact CD1-CD1 3.66Å; I103-L160 HydrophobicContact CG1-CD1 3.8Å; F127-L160 HydrophobicContact CB-CD1 4.07Å; V128-L160 WeakPolarHBondContact O-CB 3.38Å; V128-L160 PolarHBondContact O-N 2.83Å; E129-L160 HydrophobicContact CB-CD2 4.3Å; L160-E162 PolarHBondContact O-N 3.48Å; L160-F163 VanDerWaalsContact O-CB 3.29Å; L160-F163 WeakPolarHBondContact O-CB 3.15Å; L160-F163 PolarHBondContact O-N 3.37Å; L160-F163 VanDerWaalsContact O-N 3.16Å; L160-F197 HydrophobicContact CD1-CD1 4.32Å; L160-F197 HydrophobicContact CD1-CE1 3.83Å; L160-F197 HydrophobicContact CD2-CE1 4.43Å; L160-F197 HydrophobicContact CG-CD1 4.44Å; L160-F197 HydrophobicContact CG-CE1 3.91Å; L160-F197 HydrophobicContact CG-CZ 4.49Å
161	S	95	Very high	94.7	Very high	94 Å²	94	48.3 Å²	48.3	66%	0.657	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-60.5	-24.6	175	53.3	0	0	0	0	113.7	P159 F163	P159-S161 PolarHBondContact O-N 3.46Å; P159-S161 VanDerWaalsContact O-N 3.1Å; S161-F163 VanDerWaalsContact C-N 3.33Å
162	E	97.5	Very high	94.2	Very high	90 Å²	90	52.8 Å²	52.8	42%	0.421	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-83.6	-9.5	179.9	-61.6	-167.3	167.6	0	0	113.3	H158 P159 L160 S164 K165 F166	H158-E162 IonicContact ND1-OE2 2.88Å; P159-E162 HydrophobicContact CB-CG 4.3Å; P159-E162 HydrophobicContact CG-CG 4.27Å; P159-E162 WeakPolarHBondContact O-CB 3.45Å; P159-E162 PolarHBondContact O-N 2.94Å; L160-E162 PolarHBondContact O-N 3.48Å; E162-S164 VanDerWaalsContact C-N 3.3Å; E162-S164 PolarHBondContact O-N 2.91Å; E162-K165 PolarHBondContact O-N 3.42Å; E162-K165 VanDerWaalsContact O-N 3.14Å; E162-F166 PolarHBondContact O-N 2.99Å
163	F	98.1	Very high	93.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.1	-40.3	-177.7	-179.2	-120.5	0	0	0	113.2	I103 L105 F127 L160 S161 F166 L167 F197 V198 K201 I202	I103-F163 HydrophobicContact CD1-CB 4.05Å; I103-F163 HydrophobicContact CD1-CD1 3.28Å; I103-F163 HydrophobicContact CD1-CD2 3.54Å; I103-F163 HydrophobicContact CD1-CE1 3.42Å; I103-F163 VanDerWaalsContact CD1-CE1 3.42Å; I103-F163 HydrophobicContact CD1-CE2 3.68Å; I103-F163 HydrophobicContact CD1-CG 3.33Å; I103-F163 HydrophobicContact CD1-CZ 3.6Å; I103-F163 HydrophobicContact CG2-CE2 4.18Å; I103-F163 HydrophobicContact CG2-CZ 4.37Å; L105-F163 HydrophobicContact CD1-CE2 3.8Å; F127-F163 HydrophobicContact CD1-CB 3.88Å; F127-F163 HydrophobicContact CD1-CD2 4.27Å; F127-F163 AromaticContact CD2-CD2 3.93Å; F127-F163 HydrophobicContact CD2-CD2 3.93Å; F127-F163 HydrophobicContact CE1-CB 4.18Å; F127-F163 HydrophobicContact CE1-CD2 4.23Å; F127-F163 AromaticContact CE2-CD2 3.88Å; F127-F163 HydrophobicContact CE2-CD2 3.88Å; F127-F163 HydrophobicContact CE2-CE2 4.43Å; F127-F163 HydrophobicContact CG-CB 4.25Å; F127-F163 HydrophobicContact CG-CD2 4.14Å; F127-F163 HydrophobicContact CZ-CD2 4.05Å; L160-F163 VanDerWaalsContact O-CB 3.29Å; L160-F163 WeakPolarHBondContact O-CB 3.15Å; L160-F163 PolarHBondContact O-N 3.37Å; L160-F163 VanDerWaalsContact O-N 3.16Å; S161-F163 VanDerWaalsContact C-N 3.33Å; F163-F166 WeakPolarHBondContact O-CB 3.38Å; F163-F166 PolarHBondContact O-N 3.2Å; F163-L167 HydrophobicContact CD1-CD1 4.17Å; F163-L167 HydrophobicContact CE1-CD1 3.59Å; F163-L167 HydrophobicContact CE1-CG 4.35Å; F163-L167 HydrophobicContact CE2-CD1 4.17Å; F163-L167 HydrophobicContact CE2-CD2 4.27Å; F163-L167 HydrophobicContact CE2-CG 4.09Å; F163-L167 HydrophobicContact CZ-CD1 3.6Å; F163-L167 HydrophobicContact CZ-CD2 4.26Å; F163-L167 HydrophobicContact CZ-CG 4.02Å; F163-L167 PolarHBondContact O-N 2.99Å; F163-F197 HydrophobicContact CD1-CE1 4.07Å; F163-V198 HydrophobicContact CE1-CG1 4.45Å; F163-K201 HydrophobicContact CD1-CB 4.04Å; F163-K201 HydrophobicContact CD1-CG 4.3Å; F163-K201 HydrophobicContact CE1-CB 3.87Å; F163-I202 HydrophobicContact CE1-CD1 4.4Å; F163-I202 HydrophobicContact CZ-CD1 3.96Å
164	S	95.9	Very high	92.4	Very high	24 Å²	24	58 Å²	58	17%	0.168	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-47	177.5	-58.3	0	0	0	0	111.2	E162 F166 L167 D168 K201	E162-S164 VanDerWaalsContact C-N 3.3Å; E162-S164 PolarHBondContact O-N 2.91Å; S164-F166 VanDerWaalsContact C-N 3.28Å; S164-F166 PolarHBondContact O-N 3.35Å; S164-L167 PolarHBondContact O-N 3.27Å; S164-L167 VanDerWaalsContact O-N 3.15Å; S164-D168 PolarHBondContact O-N 3.42Å; S164-K201 VanDerWaalsContact OG-CD 3.24Å; S164-K201 WeakPolarHBondContact OG-CD 3.17Å; S164-K201 WeakPolarHBondContact OG-CE 3.34Å; S164-K201 PolarHBondContact OG-NZ 3.14Å
165	K	96.7	Very high	91.6	Very high	158 Å²	158	58.7 Å²	58.7	69%	0.687	31%	0.314	S	S	*	.	H	α-helix	trans	-61.8	-37.6	177.7	-175.8	-177.9	177	-173.7	0	111.8	E162 D168 H169	E162-K165 PolarHBondContact O-N 3.42Å; E162-K165 VanDerWaalsContact O-N 3.14Å; K165-D168 PolarHBondContact O-N 2.89Å; K165-H169 PolarHBondContact O-N 2.88Å; K165-H169 VanDerWaalsContact O-N 3.09Å
166	F	96.2	Very high	91.4	Very high	36 Å²	36	53.7 Å²	53.7	16%	0.158	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-50.2	174.2	-177.9	-86.1	0	0	0	111	L105 H125 F127 E162 F163 S164 H169 Q170	L105-F166 HydrophobicContact CD1-CD1 4.28Å; L105-F166 HydrophobicContact CD1-CE1 3.9Å; L105-F166 HydrophobicContact CD2-CE1 3.73Å; L105-F166 HydrophobicContact CD2-CZ 3.85Å; H125-F166 AromaticContact CE1-CE2 3.96Å; H125-F166 AromaticContact ND1-CE2 3.99Å; F127-F166 HydrophobicContact CE1-CB 4.12Å; F127-F166 HydrophobicContact CE1-CG 4.45Å; F127-F166 HydrophobicContact CZ-CB 3.85Å; F127-F166 HydrophobicContact CZ-CD1 4.19Å; F127-F166 AromaticContact CZ-CD2 3.91Å; F127-F166 HydrophobicContact CZ-CD2 3.91Å; F127-F166 AromaticContact CZ-CG 3.71Å; F127-F166 HydrophobicContact CZ-CG 3.71Å; E162-F166 PolarHBondContact O-N 2.99Å; F163-F166 WeakPolarHBondContact O-CB 3.38Å; F163-F166 PolarHBondContact O-N 3.2Å; S164-F166 VanDerWaalsContact C-N 3.28Å; S164-F166 PolarHBondContact O-N 3.35Å; F166-H169 PolarHBondContact O-N 3.46Å; F166-Q170 HydrophobicContact CD1-CG 4.19Å; F166-Q170 HydrophobicContact CE1-CG 3.91Å; F166-Q170 VanDerWaalsContact CZ-NE2 3.34Å; F166-Q170 WeakPolarHBondContact O-CG 3.37Å; F166-Q170 PolarHBondContact O-N 2.94Å
167	L	94.8	Very high	91.2	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-42.6	177.7	-69.6	178.9	0	0	0	112.4	F163 S164 H169 Q170 A171 K201 I202 F205	F163-L167 HydrophobicContact CD1-CD1 4.17Å; F163-L167 HydrophobicContact CE1-CD1 3.59Å; F163-L167 HydrophobicContact CE1-CG 4.35Å; F163-L167 HydrophobicContact CE2-CD1 4.17Å; F163-L167 HydrophobicContact CE2-CD2 4.27Å; F163-L167 HydrophobicContact CE2-CG 4.09Å; F163-L167 HydrophobicContact CZ-CD1 3.6Å; F163-L167 HydrophobicContact CZ-CD2 4.26Å; F163-L167 HydrophobicContact CZ-CG 4.02Å; F163-L167 PolarHBondContact O-N 2.99Å; S164-L167 PolarHBondContact O-N 3.27Å; S164-L167 VanDerWaalsContact O-N 3.15Å; L167-H169 VanDerWaalsContact C-N 3.26Å; L167-H169 PolarHBondContact O-N 3.34Å; L167-Q170 CarbonylContact O-C 3.5Å; L167-Q170 WeakPolarHBondContact O-CA 3.27Å; L167-Q170 WeakPolarHBondContact O-CB 3.21Å; L167-Q170 PolarHBondContact O-N 3.06Å; L167-A171 PolarHBondContact O-N 3.01Å; L167-K201 HydrophobicContact CD1-CB 4.24Å; L167-I202 HydrophobicContact CD1-CD1 3.8Å; L167-I202 HydrophobicContact CD2-CD1 4.27Å; L167-F205 HydrophobicContact CB-CB 4.22Å; L167-F205 HydrophobicContact CB-CD2 3.79Å; L167-F205 HydrophobicContact CB-CE2 4.37Å; L167-F205 HydrophobicContact CB-CG 4.11Å; L167-F205 HydrophobicContact CD1-CB 4.02Å; L167-F205 HydrophobicContact CD1-CG 4.38Å; L167-F205 HydrophobicContact CD2-CD1 4.36Å; L167-F205 HydrophobicContact CD2-CD2 4.4Å; L167-F205 HydrophobicContact CD2-CG 4.28Å; L167-F205 HydrophobicContact CG-CG 4.5Å; L167-F205 WeakPolarHBondContact O-CD2 3.41Å; L167-F205 WeakPolarHBondContact O-CE2 3.45Å
168	D	92.4	Very high	91.1	Very high	67 Å²	67	49.5 Å²	49.5	36%	0.358	27%	0.267	S	S	.	.	H	α-helix	trans	-57.6	-41.1	177.4	-64	-26.4	0	0	0	110.9	S164 K165 Q170 A171 L172 Q208	S164-D168 PolarHBondContact O-N 3.42Å; K165-D168 PolarHBondContact O-N 2.89Å; D168-Q170 VanDerWaalsContact C-N 3.3Å; D168-Q170 PolarHBondContact O-N 2.95Å; D168-A171 WeakPolarHBondContact O-CB 3.42Å; D168-A171 PolarHBondContact O-N 3.37Å; D168-L172 PolarHBondContact O-N 3.42Å; D168-Q208 PolarHBondContact OD1-NE2 2.76Å; D168-Q208 PolarHBondContact OD1-OE1 3.22Å
169	H	90	Very high	90.9	Very high	115 Å²	115	47.4 Å²	47.4	53%	0.532	26%	0.257	S	S	.	.	H	α-helix	trans	-66	-30.1	174.3	-176.7	-96.3	0	0	0	113.1	K110 K165 F166 L167	K110-H169 PolarHBondContact NZ-O 3.17Å; K165-H169 PolarHBondContact O-N 2.88Å; K165-H169 VanDerWaalsContact O-N 3.09Å; F166-H169 PolarHBondContact O-N 3.46Å; L167-H169 VanDerWaalsContact C-N 3.26Å; L167-H169 PolarHBondContact O-N 3.34Å
170	Q	86.6	Confident	90.9	Very high	13 Å²	13	46.4 Å²	46.4	6%	0.061	25%	0.25	C	S	.	.	H	α-helix	trans	-72.8	-32.1	172.7	-53.2	-42.4	-23.5	0	0	112.4	Y64 I66 F166 L167 D168 L172 S173 F205	Y64-Q170 HydrophobicContact CE1-CB 4.09Å; Y64-Q170 HydrophobicContact CE1-CG 4.15Å; Y64-Q170 PolarHBondContact OH-OE1 3.34Å; Y64-Q170 VanDerWaalsContact OH-OE1 3.07Å; I66-Q170 HydrophobicContact CD1-CB 4.37Å; I66-Q170 HydrophobicContact CD1-CG 4.4Å; F166-Q170 HydrophobicContact CD1-CG 4.19Å; F166-Q170 HydrophobicContact CE1-CG 3.91Å; F166-Q170 VanDerWaalsContact CZ-NE2 3.34Å; F166-Q170 WeakPolarHBondContact O-CG 3.37Å; F166-Q170 PolarHBondContact O-N 2.94Å; L167-Q170 CarbonylContact O-C 3.5Å; L167-Q170 WeakPolarHBondContact O-CA 3.27Å; L167-Q170 WeakPolarHBondContact O-CB 3.21Å; L167-Q170 PolarHBondContact O-N 3.06Å; D168-Q170 VanDerWaalsContact C-N 3.3Å; D168-Q170 PolarHBondContact O-N 2.95Å; Q170-L172 PolarHBondContact O-N 3.42Å; Q170-S173 WeakPolarHBondContact O-CB 3.48Å; Q170-S173 PolarHBondContact O-N 3.18Å; Q170-S173 VanDerWaalsContact O-N 3.1Å; Q170-F205 HydrophobicContact CB-CE2 3.99Å; Q170-F205 HydrophobicContact CB-CZ 4.17Å
171	A	84.1	Confident	90.9	Very high	13 Å²	13	45.4 Å²	45.4	11%	0.107	25%	0.245	C	C	.	.	H	α-helix	trans	-66.7	-24.2	-179.1	0	0	0	0	0	113.1	L167 D168 S173 F205 Q208 I209	L167-A171 PolarHBondContact O-N 3.01Å; D168-A171 WeakPolarHBondContact O-CB 3.42Å; D168-A171 PolarHBondContact O-N 3.37Å; A171-S173 PolarHBondContact O-N 3.31Å; A171-F205 HydrophobicContact CB-CD2 4.01Å; A171-F205 HydrophobicContact CB-CE2 3.83Å; A171-Q208 HydrophobicContact CB-CB 4.19Å; A171-I209 HydrophobicContact CB-CD1 4.49Å; A171-I209 HydrophobicContact CB-CG1 4.13Å
172	L	82.5	Confident	90.7	Very high	141 Å²	141	41 Å²	41	74%	0.738	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-14	174	-60.7	177.9	0	0	0	113.4	D168 Q170	D168-L172 PolarHBondContact O-N 3.42Å; Q170-L172 PolarHBondContact O-N 3.42Å
173	S	78.2	Confident	90.4	Very high	13 Å²	13	37.7 Å²	37.7	9%	0.091	20%	0.2	C	C	.	.			trans	-70.1	138.5	175.9	-172.1	0	0	0	0	111.8	Q170 A171 Q175 R213	Q170-S173 WeakPolarHBondContact O-CB 3.48Å; Q170-S173 PolarHBondContact O-N 3.18Å; Q170-S173 VanDerWaalsContact O-N 3.1Å; A171-S173 PolarHBondContact O-N 3.31Å; S173-Q175 VanDerWaalsContact C-N 3.25Å; S173-Q175 WeakPolarHBondContact OG-CB 3.32Å; S173-Q175 WeakPolarHBondContact OG-CG 3.43Å; S173-Q175 PolarHBondContact OG-N 3.2Å; S173-Q175 PolarHBondContact OG-OE1 2.73Å; S173-R213 PolarHBondContact O-NH1 3.4Å
174	T	76.9	Confident	90.1	Very high	129 Å²	129	40.1 Å²	40.1	79%	0.791	21%	0.213	S	C	*	.			trans	-78.7	-9.2	172.2	52.5	0	0	0	0	113
175	Q	80.4	Confident	89.6	Confident	19 Å²	19	39.5 Å²	39.5	9%	0.089	21%	0.209	C	C	.	.	S	Bend	trans	-66.2	159.2	-176.3	-69.9	162	-29.7	0	0	113.3	T111 S173 R213	T111-Q175 PolarHBondContact O-NE2 2.93Å; S173-Q175 VanDerWaalsContact C-N 3.25Å; S173-Q175 WeakPolarHBondContact OG-CB 3.32Å; S173-Q175 WeakPolarHBondContact OG-CG 3.43Å; S173-Q175 PolarHBondContact OG-N 3.2Å; S173-Q175 PolarHBondContact OG-OE1 2.73Å; Q175-R213 PolarHBondContact O-NH1 3.38Å
176	S	89.4	Confident	88.6	Confident	39 Å²	39	37.4 Å²	37.4	27%	0.273	21%	0.214	S	C	.	.			trans	-73.2	133.7	160.3	52.8	0	0	0	0	109.6	P62 S63 Y64 R213	P62-S176 WeakPolarHBondContact CA-OG 3.37Å; S63-S176 PolarHBondContact N-O 2.87Å; S63-S176 PolarHBondContact N-OG 3.35Å; Y64-S176 PolarHBondContact N-O 3.18Å; Y64-S176 VanDerWaalsContact N-O 3.1Å; S176-R213 CarbonylContact C-O 3.51Å; S176-R213 VanDerWaalsContact CA-O 3.31Å; S176-R213 WeakPolarHBondContact CA-O 3.37Å
177	I	92.5	Very high	87.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.3	-172.2	-56.4	174.8	0	0	0	108.9	Y64 I66 V179 F205 I209 R213 I214 S215	Y64-I177 HydrophobicContact CD1-CD1 4.33Å; Y64-I177 HydrophobicContact CD1-CG1 4.03Å; Y64-I177 HydrophobicContact CD1-CG2 4.05Å; Y64-I177 CarbonylContact O-C 3.57Å; Y64-I177 VanDerWaalsContact O-CA 3.32Å; Y64-I177 WeakPolarHBondContact O-CA 3.45Å; I66-I177 HydrophobicContact CD1-CG2 4.18Å; I66-I177 HydrophobicContact CG1-CG2 4.37Å; I177-V179 HydrophobicContact CG2-CG2 4.01Å; I177-F205 HydrophobicContact CD1-CZ 4.24Å; I177-I209 HydrophobicContact CD1-CD1 3.57Å; I177-I209 HydrophobicContact CD1-CG1 4.35Å; I177-R213 PolarHBondContact N-O 3.36Å; I177-I214 CarbonylContact O-C 3.59Å; I177-I214 WeakPolarHBondContact O-CA 3.3Å; I177-S215 PolarHBondContact O-N 2.64Å; I177-S215 PolarHBondContact O-OG 2.8Å
178	C	94.1	Very high	86.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.5	167.5	171.5	0	0	0	0	110.2	P62 Y64 H65 I66 S215	P62-C178 HydrophobicContact CB-CB 3.72Å; P62-C178 HydrophobicContact CG-CB 3.58Å; Y64-C178 PolarHBondContact O-N 2.89Å; H65-C178 WeakPolarHBondContact CA-O 3.31Å; I66-C178 PolarHBondContact N-O 3.37Å; C178-S215 WeakPolarHBondContact CA-O 3.4Å
179	V	95.4	Very high	85	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	111.7	177.7	-176.4	0	0	0	0	108.9	I66 V68 I177 Y181 I202 F205 I214 S215 F216 E217	I66-V179 CarbonylContact O-C 3.56Å; I66-V179 VanDerWaalsContact O-CA 3.31Å; I66-V179 WeakPolarHBondContact O-CA 3.49Å; V68-V179 HydrophobicContact CG2-CG1 4.3Å; I177-V179 HydrophobicContact CG2-CG2 4.01Å; V179-Y181 PolarHBondContact O-N 2.86Å; V179-I202 HydrophobicContact CG1-CG2 4.21Å; V179-F205 HydrophobicContact CG2-CE1 3.91Å; V179-I214 HydrophobicContact CG2-CD1 3.96Å; V179-I214 HydrophobicContact CG2-CG1 4.22Å; V179-S215 PolarHBondContact N-O 3.28Å; V179-F216 HydrophobicContact CB-CD1 3.77Å; V179-F216 HydrophobicContact CB-CE1 3.75Å; V179-F216 HydrophobicContact CG1-CD1 4.13Å; V179-F216 HydrophobicContact CG1-CE1 3.97Å; V179-F216 HydrophobicContact CG2-CE1 4.3Å; V179-F216 VanDerWaalsContact O-CA 3.28Å; V179-F216 WeakPolarHBondContact O-CA 3.49Å; V179-E217 PolarHBondContact O-N 2.9Å
180	W	96.5	Very high	84.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	94.2	172.6	-58.4	80.9	0	0	0	109.1	V51 C54 M58 H65 I66 V67 V68 E217 P219 Y221 L222	V51-W180 HydrophobicContact CG1-CD2 4.29Å; V51-W180 HydrophobicContact CG1-CH2 4.48Å; V51-W180 HydrophobicContact CG1-CZ2 3.69Å; C54-W180 HydrophobicContact CB-CH2 3.69Å; C54-W180 HydrophobicContact CB-CZ2 4.36Å; M58-W180 HydrophobicContact CE-CH2 3.36Å; M58-W180 HydrophobicContact CE-CZ2 3.08Å; M58-W180 HydrophobicContact CE-CZ3 4.32Å; H65-W180 AromaticContact ND1-NE1 3.31Å; H65-W180 PolarHBondContact ND1-NE1 3.13Å; I66-W180 PolarHBondContact O-N 2.88Å; V67-W180 HydrophobicContact CB-CB 4.12Å; V67-W180 HydrophobicContact CG1-CB 3.98Å; V67-W180 HydrophobicContact CG2-CB 3.84Å; V67-W180 HydrophobicContact CG2-CG 3.88Å; V68-W180 PolarHBondContact N-O 3.46Å; W180-E217 CarbonylContact C-O 3.55Å; W180-E217 VanDerWaalsContact CA-O 3.28Å; W180-E217 WeakPolarHBondContact CA-O 3.43Å; W180-E217 HydrophobicContact CD2-CB 3.87Å; W180-E217 HydrophobicContact CE3-CB 3.55Å; W180-E217 HydrophobicContact CH2-CB 4.4Å; W180-E217 HydrophobicContact CZ3-CB 3.83Å; W180-P219 HydrophobicContact CB-CB 4.17Å; W180-P219 HydrophobicContact CB-CG 4.25Å; W180-P219 HydrophobicContact CE3-CB 4.38Å; W180-Y221 HydrophobicContact CZ3-CE1 4.47Å; W180-L222 HydrophobicContact CH2-CD1 4.39Å; W180-L222 HydrophobicContact CZ3-CD1 4.08Å
181	Y	95.6	Very high	83.7	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	31%	0.307	C	S	.	.			trans	-147.7	103.1	-179	-175.3	-122.1	0	0	0	109.8	V68 P70 V179 P183 L184 S185 V198 L199 I202 E217	V68-Y181 HydrophobicContact CB-CD2 3.89Å; V68-Y181 HydrophobicContact CB-CG 4.43Å; V68-Y181 HydrophobicContact CG1-CD2 4.01Å; V68-Y181 HydrophobicContact CG1-CE2 4.23Å; P70-Y181 HydrophobicContact CG-CE2 4.04Å; V179-Y181 PolarHBondContact O-N 2.86Å; Y181-P183 VanDerWaalsContact C-CD 3.43Å; Y181-P183 VanDerWaalsContact C-N 3.35Å; Y181-P183 HydrophobicContact CD1-CB 4.34Å; Y181-P183 HydrophobicContact CD1-CG 4.32Å; Y181-P183 HydrophobicContact CE1-CB 3.83Å; Y181-P183 HydrophobicContact CE1-CG 3.78Å; Y181-P183 HydrophobicContact CE2-CG 3.99Å; Y181-P183 VanDerWaalsContact O-N 3.17Å; Y181-L184 HydrophobicContact CD1-CB 4.24Å; Y181-L184 HydrophobicContact CD1-CD1 3.99Å; Y181-L184 HydrophobicContact CD1-CG 3.89Å; Y181-L184 HydrophobicContact CE1-CD1 4.38Å; Y181-L184 HydrophobicContact CE1-CG 4.22Å; Y181-L184 PolarHBondContact O-N 2.89Å; Y181-S185 PolarHBondContact O-N 3.09Å; Y181-V198 HydrophobicContact CE2-CG1 4.08Å; Y181-L199 HydrophobicContact CE1-CD1 4Å; Y181-I202 HydrophobicContact CD1-CB 4.41Å; Y181-I202 HydrophobicContact CD1-CG1 4.42Å; Y181-I202 HydrophobicContact CD1-CG2 4.15Å; Y181-I202 HydrophobicContact CE1-CB 4.49Å; Y181-I202 HydrophobicContact CE1-CG1 4.48Å; Y181-E217 PolarHBondContact N-O 2.78Å
182	S	91.3	Very high	83.6	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.014	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-45.9	-46.4	-172.9	176.2	0	0	0	0	114.5	L184 S185 N218 D220	S182-L184 PolarHBondContact O-N 3.37Å; S182-L184 VanDerWaalsContact O-N 3.07Å; S182-S185 WeakPolarHBondContact O-CB 3.39Å; S182-S185 PolarHBondContact O-N 3.35Å; S182-N218 WeakPolarHBondContact CB-OD1 3.41Å; S182-N218 PolarHBondContact OG-OD1 3.05Å; S182-D220 WeakPolarHBondContact CB-OD2 3.48Å; S182-D220 PolarHBondContact OG-OD2 3.24Å
183	P	91.2	Very high	83.9	Confident	19 Å²	19	55.2 Å²	55.2	12%	0.123	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-62.8	-18.9	-178	-25.8	37.5	0	0	0	116	Y181 L194 L199	Y181-P183 VanDerWaalsContact C-CD 3.43Å; Y181-P183 VanDerWaalsContact C-N 3.35Å; Y181-P183 HydrophobicContact CD1-CB 4.34Å; Y181-P183 HydrophobicContact CD1-CG 4.32Å; Y181-P183 HydrophobicContact CE1-CB 3.83Å; Y181-P183 HydrophobicContact CE1-CG 3.78Å; Y181-P183 HydrophobicContact CE2-CG 3.99Å; Y181-P183 VanDerWaalsContact O-N 3.17Å; P183-L194 HydrophobicContact CB-CD2 3.8Å; P183-L194 HydrophobicContact CG-CD2 3.52Å; P183-L199 HydrophobicContact CB-CD1 4.39Å
184	L	90.6	Very high	84.5	Confident	51 Å²	51	57.1 Å²	57.1	27%	0.267	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-110.6	4.3	178	-64.2	-179.4	0	0	0	112.7	Y181 S182 L199 I202 V203 F216	Y181-L184 HydrophobicContact CD1-CB 4.24Å; Y181-L184 HydrophobicContact CD1-CD1 3.99Å; Y181-L184 HydrophobicContact CD1-CG 3.89Å; Y181-L184 HydrophobicContact CE1-CD1 4.38Å; Y181-L184 HydrophobicContact CE1-CG 4.22Å; Y181-L184 PolarHBondContact O-N 2.89Å; S182-L184 PolarHBondContact O-N 3.37Å; S182-L184 VanDerWaalsContact O-N 3.07Å; L184-L199 HydrophobicContact CD1-CD1 4.46Å; L184-L199 HydrophobicContact CD2-CD1 3.86Å; L184-L199 HydrophobicContact CG-CD1 4.09Å; L184-I202 HydrophobicContact CD1-CB 4.25Å; L184-I202 HydrophobicContact CD1-CG2 3.55Å; L184-V203 HydrophobicContact CD1-CG2 3.99Å; L184-V203 HydrophobicContact CD2-CG2 4.1Å; L184-F216 HydrophobicContact CB-CB 4.43Å; L184-F216 HydrophobicContact CB-CD1 3.61Å; L184-F216 HydrophobicContact CB-CD2 4.46Å; L184-F216 HydrophobicContact CB-CE1 3.9Å; L184-F216 HydrophobicContact CB-CG 3.91Å; L184-F216 HydrophobicContact CB-CZ 4.43Å; L184-F216 HydrophobicContact CD1-CD1 4.17Å; L184-F216 HydrophobicContact CD1-CE1 3.57Å; L184-F216 HydrophobicContact CD1-CZ 3.84Å; L184-F216 HydrophobicContact CG-CE1 4.41Å; L184-F216 VanDerWaalsContact O-CB 3.24Å; L184-F216 WeakPolarHBondContact O-CB 3.36Å
185	S	86.9	Confident	85.4	Confident	11 Å²	11	51.3 Å²	51.3	8%	0.077	28%	0.275	C	S	.	.			trans	-77.8	142.2	172.4	-173.4	0	0	0	0	110.7	Y181 S182 K187 N218	Y181-S185 PolarHBondContact O-N 3.09Å; S182-S185 WeakPolarHBondContact O-CB 3.39Å; S182-S185 PolarHBondContact O-N 3.35Å; S185-K187 PolarHBondContact O-N 2.86Å; S185-K187 PolarHBondContact OG-N 3.3Å; S185-N218 PolarHBondContact OG-N 2.87Å
186	S	75.2	Confident	86.1	Confident	115 Å²	115	57 Å²	57	80%	0.804	30%	0.3	S	S	*	.	S	Bend	trans	-73.7	-9.9	173	56.2	0	0	0	0	113.7
187	K	72.7	Confident	86.5	Confident	99 Å²	99	58.6 Å²	58.6	43%	0.43	30%	0.302	S	S	.	.	S	Bend	trans	-108	131.7	-172.5	-60.1	176	-167.7	151.8	0	111.6	S185 F189 E217 N218	S185-K187 PolarHBondContact O-N 2.86Å; S185-K187 PolarHBondContact OG-N 3.3Å; K187-F189 PolarHBondContact O-N 2.9Å; K187-E217 VanDerWaalsContact NZ-CD 3.28Å; K187-E217 IonicContact NZ-OE1 2.78Å; K187-E217 PolarHBondContact NZ-OE1 3.24Å; K187-E217 IonicContact NZ-OE2 2.8Å; K187-E217 PolarHBondContact NZ-OE2 3.41Å; K187-N218 PolarHBondContact O-ND2 3.16Å
188	N	67.2	Low	86.7	Confident	130 Å²	130	58.6 Å²	58.6	70%	0.695	30%	0.302	S	S	*	.			trans	52.9	48.5	166	-56.9	-33.7	0	0	0	113.6	V190	N188-V190 PolarHBondContact O-N 3.2Å; N188-V190 VanDerWaalsContact O-N 3.11Å
189	F	67.4	Low	86.8	Confident	120 Å²	120	60.7 Å²	60.7	53%	0.526	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-61.9	116.6	173.9	179.6	-98.6	0	0	0	109.5	K187 E191	K187-F189 PolarHBondContact O-N 2.9Å; F189-E191 HydrophobicContact CE1-CB 4.29Å
190	V	71.2	Confident	86.8	Confident	97 Å²	97	66.5 Å²	66.5	59%	0.588	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-101.1	124.4	169.9	179.9	0	0	0	0	107.1	N188 R192	N188-V190 PolarHBondContact O-N 3.2Å; N188-V190 VanDerWaalsContact O-N 3.11Å; V190-R192 PolarHBondContact O-N 3.09Å; V190-R192 VanDerWaalsContact O-N 3.16Å
191	E	79.2	Confident	86.9	Confident	179 Å²	179	68.6 Å²	68.6	84%	0.836	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-60.3	119.8	176.7	-171.5	173.9	-172.1	0	0	109.8	F189	F189-E191 HydrophobicContact CE1-CB 4.29Å
192	R	82	Confident	86.9	Confident	51 Å²	51	68.6 Å²	68.6	19%	0.192	35%	0.347	C	S	.	.			trans	-148.2	155.3	179.5	71	-174.6	-160.2	-168.6	7.1	110.6	V190 L194 D220	V190-R192 PolarHBondContact O-N 3.09Å; V190-R192 VanDerWaalsContact O-N 3.16Å; R192-L194 HydrophobicContact CG-CD2 4.29Å; R192-L194 PolarHBondContact O-N 3.29Å; R192-D220 IonicContact CZ-OD2 2.94Å; R192-D220 VanDerWaalsContact NH1-CG 3.29Å; R192-D220 IonicContact NH1-OD1 3.61Å; R192-D220 PolarHBondContact NH1-OD1 3Å; R192-D220 IonicContact NH1-OD2 2.78Å; R192-D220 PolarHBondContact NH1-OD2 3.35Å
193	P	87.7	Confident	87	Confident	85 Å²	85	70.1 Å²	70.1	55%	0.552	36%	0.356	S	S	*	.			trans	-50	130.3	167	-29.2	37.8	0	0	0	111.6
194	L	91.7	Very high	87.2	Confident	52 Å²	52	72.1 Å²	72.1	27%	0.272	36%	0.364	S	S	.	.			trans	-103.5	137	178.1	-58.9	179.4	0	0	0	109.5	P183 R192 K196 L199	P183-L194 HydrophobicContact CB-CD2 3.8Å; P183-L194 HydrophobicContact CG-CD2 3.52Å; R192-L194 HydrophobicContact CG-CD2 4.29Å; R192-L194 PolarHBondContact O-N 3.29Å; L194-K196 PolarHBondContact O-N 2.9Å; L194-L199 HydrophobicContact CD1-CD2 3.95Å
195	N	95.5	Very high	87.3	Confident	7 Å²	7	69.8 Å²	69.8	4%	0.037	35%	0.352	C	S	.	.			trans	-73.4	105.9	163	-173.4	-51.5	0	0	0	108.2	P70 A71 F197 V198 L199	P70-N195 HydrophobicContact CB-CB 3.94Å; A71-N195 PolarHBondContact O-ND2 2.88Å; N195-F197 VanDerWaalsContact C-N 3.31Å; N195-F197 PolarHBondContact O-N 2.95Å; N195-F197 WeakPolarHBondContact OD1-CB 3.43Å; N195-F197 PolarHBondContact OD1-N 2.85Å; N195-V198 HydrophobicContact CB-CB 4.18Å; N195-V198 HydrophobicContact CB-CG2 4.1Å; N195-V198 PolarHBondContact O-N 2.95Å; N195-V198 WeakPolarHBondContact OD1-CG2 3.45Å; N195-V198 PolarHBondContact OD1-N 2.86Å; N195-V198 VanDerWaalsContact OD1-N 3.09Å; N195-L199 PolarHBondContact O-N 3Å
196	K	95.5	Very high	87.6	Confident	139 Å²	139	70 Å²	70	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-66.8	-34.9	-171.4	-65.6	170	-171.5	127.5	0	112	E73 L194 K200	E73-K196 WeakPolarHBondContact OE1-CE 3.21Å; E73-K196 IonicContact OE1-NZ 2.81Å; E73-K196 PolarHBondContact OE1-NZ 3.28Å; E73-K196 PolarHBondContact OE2-N 3.32Å; L194-K196 PolarHBondContact O-N 2.9Å; K196-K200 VanDerWaalsContact O-CB 3.27Å; K196-K200 WeakPolarHBondContact O-CB 3.34Å; K196-K200 PolarHBondContact O-N 3Å
197	F	96.3	Very high	88.4	Confident	72 Å²	72	73.6 Å²	73.6	32%	0.316	35%	0.349	S	S	.	.	H	α-helix	trans	-60.8	-51.4	175.4	171.4	-98	0	0	0	110.4	L160 F163 N195 K200 K201	L160-F197 HydrophobicContact CD1-CD1 4.32Å; L160-F197 HydrophobicContact CD1-CE1 3.83Å; L160-F197 HydrophobicContact CD2-CE1 4.43Å; L160-F197 HydrophobicContact CG-CD1 4.44Å; L160-F197 HydrophobicContact CG-CE1 3.91Å; L160-F197 HydrophobicContact CG-CZ 4.49Å; F163-F197 HydrophobicContact CD1-CE1 4.07Å; N195-F197 VanDerWaalsContact C-N 3.31Å; N195-F197 PolarHBondContact O-N 2.95Å; N195-F197 WeakPolarHBondContact OD1-CB 3.43Å; N195-F197 PolarHBondContact OD1-N 2.85Å; F197-K200 PolarHBondContact O-N 3.35Å; F197-K201 HydrophobicContact CD2-CG 4.36Å; F197-K201 HydrophobicContact CE1-CG 4.2Å; F197-K201 HydrophobicContact CE2-CG 4.01Å; F197-K201 HydrophobicContact CZ-CG 3.93Å; F197-K201 WeakPolarHBondContact O-CG 3.5Å; F197-K201 PolarHBondContact O-N 2.69Å
198	V	97	Very high	89.2	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-48.1	-179.3	179.6	0	0	0	0	111.1	V68 P70 I103 F163 Y181 N195 K200 K201 I202	V68-V198 HydrophobicContact CG1-CG1 3.71Å; P70-V198 HydrophobicContact CB-CB 4.24Å; P70-V198 HydrophobicContact CB-CG1 4.22Å; P70-V198 HydrophobicContact CB-CG2 3.96Å; I103-V198 HydrophobicContact CD1-CG2 3.62Å; I103-V198 HydrophobicContact CG1-CG2 3.67Å; F163-V198 HydrophobicContact CE1-CG1 4.45Å; Y181-V198 HydrophobicContact CE2-CG1 4.08Å; N195-V198 HydrophobicContact CB-CB 4.18Å; N195-V198 HydrophobicContact CB-CG2 4.1Å; N195-V198 PolarHBondContact O-N 2.95Å; N195-V198 WeakPolarHBondContact OD1-CG2 3.45Å; N195-V198 PolarHBondContact OD1-N 2.86Å; N195-V198 VanDerWaalsContact OD1-N 3.09Å; V198-K200 VanDerWaalsContact C-N 3.32Å; V198-K200 PolarHBondContact O-N 2.81Å; V198-K201 PolarHBondContact O-N 3.38Å; V198-K201 VanDerWaalsContact O-N 3.13Å; V198-I202 HydrophobicContact CG1-CG1 4.18Å; V198-I202 WeakPolarHBondContact O-CG1 3.39Å; V198-I202 PolarHBondContact O-N 2.72Å
199	L	96.1	Very high	90.2	Very high	44 Å²	44	67.8 Å²	67.8	23%	0.23	32%	0.32	C	S	.	.	H	α-helix	trans	-55.1	-49	177.7	176.3	63.8	0	0	0	111.3	Y181 P183 L184 L194 N195 K201 I202 V203	Y181-L199 HydrophobicContact CE1-CD1 4Å; P183-L199 HydrophobicContact CB-CD1 4.39Å; L184-L199 HydrophobicContact CD1-CD1 4.46Å; L184-L199 HydrophobicContact CD2-CD1 3.86Å; L184-L199 HydrophobicContact CG-CD1 4.09Å; L194-L199 HydrophobicContact CD1-CD2 3.95Å; N195-L199 PolarHBondContact O-N 3Å; L199-K201 VanDerWaalsContact C-N 3.33Å; L199-K201 PolarHBondContact O-N 3.06Å; L199-I202 PolarHBondContact O-N 3.23Å; L199-V203 HydrophobicContact CD1-CG2 4.2Å; L199-V203 WeakPolarHBondContact O-CG2 3.23Å; L199-V203 PolarHBondContact O-N 2.78Å
200	K	97.1	Very high	90.6	Very high	122 Å²	122	66.9 Å²	66.9	53%	0.53	32%	0.32	S	S	.	.	H	α-helix	trans	-57.1	-46.5	177.7	177.3	177.6	173.2	178	0	111.3	K196 F197 V198 V203 E204	K196-K200 VanDerWaalsContact O-CB 3.27Å; K196-K200 WeakPolarHBondContact O-CB 3.34Å; K196-K200 PolarHBondContact O-N 3Å; F197-K200 PolarHBondContact O-N 3.35Å; V198-K200 VanDerWaalsContact C-N 3.32Å; V198-K200 PolarHBondContact O-N 2.81Å; K200-V203 PolarHBondContact O-N 3.47Å; K200-E204 WeakPolarHBondContact CE-OE1 3.34Å; K200-E204 HydrophobicContact CG-CG 4.49Å; K200-E204 IonicContact NZ-OE1 4Å; K200-E204 WeakPolarHBondContact O-CB 3.45Å; K200-E204 WeakPolarHBondContact O-CG 3.48Å; K200-E204 PolarHBondContact O-N 2.94Å
201	K	97	Very high	90.6	Very high	44 Å²	44	68.1 Å²	68.1	19%	0.191	32%	0.324	C	S	.	.	H	α-helix	trans	-67.1	-37.8	-178.7	-66.8	-44.8	-177	171	0	113.5	F163 S164 L167 F197 V198 L199 E204 F205	F163-K201 HydrophobicContact CD1-CB 4.04Å; F163-K201 HydrophobicContact CD1-CG 4.3Å; F163-K201 HydrophobicContact CE1-CB 3.87Å; S164-K201 VanDerWaalsContact OG-CD 3.24Å; S164-K201 WeakPolarHBondContact OG-CD 3.17Å; S164-K201 WeakPolarHBondContact OG-CE 3.34Å; S164-K201 PolarHBondContact OG-NZ 3.14Å; L167-K201 HydrophobicContact CD1-CB 4.24Å; F197-K201 HydrophobicContact CD2-CG 4.36Å; F197-K201 HydrophobicContact CE1-CG 4.2Å; F197-K201 HydrophobicContact CE2-CG 4.01Å; F197-K201 HydrophobicContact CZ-CG 3.93Å; F197-K201 WeakPolarHBondContact O-CG 3.5Å; F197-K201 PolarHBondContact O-N 2.69Å; V198-K201 PolarHBondContact O-N 3.38Å; V198-K201 VanDerWaalsContact O-N 3.13Å; L199-K201 VanDerWaalsContact C-N 3.33Å; L199-K201 PolarHBondContact O-N 3.06Å; K201-E204 WeakPolarHBondContact CD-OE2 3.49Å; K201-E204 IonicContact NZ-OE2 3.76Å; K201-E204 PolarHBondContact NZ-OE2 3.32Å; K201-E204 PolarHBondContact O-N 3.37Å; K201-F205 VanDerWaalsContact O-CB 3.3Å; K201-F205 WeakPolarHBondContact O-CB 3.12Å; K201-F205 PolarHBondContact O-N 3.16Å
202	I	95.6	Very high	90.4	Very high	1 Å²	1	69 Å²	69	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-69.5	-37.5	175.3	-60.6	-62.1	0	0	0	111.6	V68 F163 L167 V179 Y181 L184 V198 L199 F205 S206 F216	V68-I202 HydrophobicContact CG1-CD1 4.45Å; V68-I202 HydrophobicContact CG2-CD1 3.89Å; F163-I202 HydrophobicContact CE1-CD1 4.4Å; F163-I202 HydrophobicContact CZ-CD1 3.96Å; L167-I202 HydrophobicContact CD1-CD1 3.8Å; L167-I202 HydrophobicContact CD2-CD1 4.27Å; V179-I202 HydrophobicContact CG1-CG2 4.21Å; Y181-I202 HydrophobicContact CD1-CB 4.41Å; Y181-I202 HydrophobicContact CD1-CG1 4.42Å; Y181-I202 HydrophobicContact CD1-CG2 4.15Å; Y181-I202 HydrophobicContact CE1-CB 4.49Å; Y181-I202 HydrophobicContact CE1-CG1 4.48Å; L184-I202 HydrophobicContact CD1-CB 4.25Å; L184-I202 HydrophobicContact CD1-CG2 3.55Å; V198-I202 HydrophobicContact CG1-CG1 4.18Å; V198-I202 WeakPolarHBondContact O-CG1 3.39Å; V198-I202 PolarHBondContact O-N 2.72Å; L199-I202 PolarHBondContact O-N 3.23Å; I202-F205 PolarHBondContact O-N 2.92Å; I202-S206 WeakPolarHBondContact O-CB 3.15Å; I202-S206 PolarHBondContact O-N 3.37Å; I202-F216 HydrophobicContact CG2-CE1 3.77Å; I202-F216 HydrophobicContact CG2-CZ 4.37Å
203	V	94.7	Very high	90.7	Very high	34 Å²	34	69.8 Å²	69.8	21%	0.206	33%	0.328	C	S	.	.	H	α-helix	trans	-67.6	-38.4	174	171.5	0	0	0	0	111.8	L184 L199 K200 S206 R207	L184-V203 HydrophobicContact CD1-CG2 3.99Å; L184-V203 HydrophobicContact CD2-CG2 4.1Å; L199-V203 HydrophobicContact CD1-CG2 4.2Å; L199-V203 WeakPolarHBondContact O-CG2 3.23Å; L199-V203 PolarHBondContact O-N 2.78Å; K200-V203 PolarHBondContact O-N 3.47Å; V203-S206 PolarHBondContact O-N 3.28Å; V203-S206 PolarHBondContact O-OG 2.82Å; V203-R207 WeakPolarHBondContact O-CG 3.41Å; V203-R207 PolarHBondContact O-N 3.49Å
204	E	94.6	Very high	91	Very high	62 Å²	62	66.7 Å²	66.7	29%	0.29	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-46.9	173.3	-75.8	171.1	177.7	0	0	111	K200 K201 S206 R207 Q208	K200-E204 WeakPolarHBondContact CE-OE1 3.34Å; K200-E204 HydrophobicContact CG-CG 4.49Å; K200-E204 IonicContact NZ-OE1 4Å; K200-E204 WeakPolarHBondContact O-CB 3.45Å; K200-E204 WeakPolarHBondContact O-CG 3.48Å; K200-E204 PolarHBondContact O-N 2.94Å; K201-E204 WeakPolarHBondContact CD-OE2 3.49Å; K201-E204 IonicContact NZ-OE2 3.76Å; K201-E204 PolarHBondContact NZ-OE2 3.32Å; K201-E204 PolarHBondContact O-N 3.37Å; E204-S206 PolarHBondContact O-N 3.09Å; E204-R207 PolarHBondContact O-N 3.17Å; E204-Q208 WeakPolarHBondContact O-CG 3.38Å; E204-Q208 PolarHBondContact O-N 2.79Å
205	F	93.6	Very high	91	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.009	30%	0.303	C	S	.	.	H	α-helix	trans	-58.6	-44	175.3	170.6	-112.4	0	0	0	112.4	I66 L167 Q170 A171 I177 V179 K201 I202 R207 Q208 I209 I214	I66-F205 HydrophobicContact CD1-CE1 3.96Å; I66-F205 HydrophobicContact CD1-CZ 3.8Å; L167-F205 HydrophobicContact CB-CB 4.22Å; L167-F205 HydrophobicContact CB-CD2 3.79Å; L167-F205 HydrophobicContact CB-CE2 4.37Å; L167-F205 HydrophobicContact CB-CG 4.11Å; L167-F205 HydrophobicContact CD1-CB 4.02Å; L167-F205 HydrophobicContact CD1-CG 4.38Å; L167-F205 HydrophobicContact CD2-CD1 4.36Å; L167-F205 HydrophobicContact CD2-CD2 4.4Å; L167-F205 HydrophobicContact CD2-CG 4.28Å; L167-F205 HydrophobicContact CG-CG 4.5Å; L167-F205 WeakPolarHBondContact O-CD2 3.41Å; L167-F205 WeakPolarHBondContact O-CE2 3.45Å; Q170-F205 HydrophobicContact CB-CE2 3.99Å; Q170-F205 HydrophobicContact CB-CZ 4.17Å; A171-F205 HydrophobicContact CB-CD2 4.01Å; A171-F205 HydrophobicContact CB-CE2 3.83Å; I177-F205 HydrophobicContact CD1-CZ 4.24Å; V179-F205 HydrophobicContact CG2-CE1 3.91Å; K201-F205 VanDerWaalsContact O-CB 3.3Å; K201-F205 WeakPolarHBondContact O-CB 3.12Å; K201-F205 PolarHBondContact O-N 3.16Å; I202-F205 PolarHBondContact O-N 2.92Å; F205-R207 VanDerWaalsContact C-N 3.27Å; F205-R207 PolarHBondContact O-N 3.36Å; F205-Q208 PolarHBondContact O-N 3.31Å; F205-Q208 VanDerWaalsContact O-N 3.15Å; F205-I209 HydrophobicContact CD1-CD1 4.11Å; F205-I209 HydrophobicContact CD2-CD1 3.96Å; F205-I209 HydrophobicContact CE1-CD1 3.58Å; F205-I209 HydrophobicContact CE2-CD1 3.41Å; F205-I209 VanDerWaalsContact CE2-CD1 3.41Å; F205-I209 HydrophobicContact CE2-CG1 4.41Å; F205-I209 HydrophobicContact CG-CD1 4.3Å; F205-I209 HydrophobicContact CZ-CD1 3.21Å; F205-I209 PolarHBondContact O-N 3.14Å; F205-I214 HydrophobicContact CD1-CD1 4.26Å; F205-I214 HydrophobicContact CE1-CD1 4.09Å
206	S	92.3	Very high	90.9	Very high	16 Å²	16	67.4 Å²	67.4	11%	0.112	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-34.7	-179.9	80.9	0	0	0	0	112.5	I202 V203 E204 I209	I202-S206 WeakPolarHBondContact O-CB 3.15Å; I202-S206 PolarHBondContact O-N 3.37Å; V203-S206 PolarHBondContact O-N 3.28Å; V203-S206 PolarHBondContact O-OG 2.82Å; E204-S206 PolarHBondContact O-N 3.09Å; S206-I209 PolarHBondContact O-N 3.31Å
207	R	91.3	Very high	90.9	Very high	189 Å²	189	62.6 Å²	62.6	71%	0.713	29%	0.29	S	S	*	.	H	α-helix	trans	-72.8	-26.6	177	-71.3	172.1	180	160.3	1	113.6	V203 E204 F205 I209	V203-R207 WeakPolarHBondContact O-CG 3.41Å; V203-R207 PolarHBondContact O-N 3.49Å; E204-R207 PolarHBondContact O-N 3.17Å; F205-R207 VanDerWaalsContact C-N 3.27Å; F205-R207 PolarHBondContact O-N 3.36Å; R207-I209 VanDerWaalsContact C-N 3.25Å
208	Q	89.8	Confident	90.8	Very high	104 Å²	104	59.6 Å²	59.6	49%	0.486	28%	0.278	S	S	.	.	H	α-helix	trans	-72	-26	174.5	-66.2	-179.4	38.6	0	0	111.6	D168 A171 E204 F205	D168-Q208 PolarHBondContact OD1-NE2 2.76Å; D168-Q208 PolarHBondContact OD1-OE1 3.22Å; A171-Q208 HydrophobicContact CB-CB 4.19Å; E204-Q208 WeakPolarHBondContact O-CG 3.38Å; E204-Q208 PolarHBondContact O-N 2.79Å; F205-Q208 PolarHBondContact O-N 3.31Å; F205-Q208 VanDerWaalsContact O-N 3.15Å
209	I	87.8	Confident	90.7	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.015	28%	0.279	C	S	.	.	S	Bend	trans	-91.4	138	176.2	-63.9	159.6	0	0	0	108.3	A171 I177 F205 S206 R207 D211 R213 I214	A171-I209 HydrophobicContact CB-CD1 4.49Å; A171-I209 HydrophobicContact CB-CG1 4.13Å; I177-I209 HydrophobicContact CD1-CD1 3.57Å; I177-I209 HydrophobicContact CD1-CG1 4.35Å; F205-I209 HydrophobicContact CD1-CD1 4.11Å; F205-I209 HydrophobicContact CD2-CD1 3.96Å; F205-I209 HydrophobicContact CE1-CD1 3.58Å; F205-I209 HydrophobicContact CE2-CD1 3.41Å; F205-I209 VanDerWaalsContact CE2-CD1 3.41Å; F205-I209 HydrophobicContact CE2-CG1 4.41Å; F205-I209 HydrophobicContact CG-CD1 4.3Å; F205-I209 HydrophobicContact CZ-CD1 3.21Å; F205-I209 PolarHBondContact O-N 3.14Å; S206-I209 PolarHBondContact O-N 3.31Å; R207-I209 VanDerWaalsContact C-N 3.25Å; I209-D211 PolarHBondContact O-N 3.33Å; I209-R213 HydrophobicContact CG2-CB 3.91Å; I209-I214 HydrophobicContact CB-CB 4.42Å; I209-I214 HydrophobicContact CD1-CD1 3.98Å; I209-I214 HydrophobicContact CG2-CB 3.87Å; I209-I214 HydrophobicContact CG2-CG2 4.31Å
210	N	75.8	Confident	90.6	Very high	101 Å²	101	58.5 Å²	58.5	54%	0.54	27%	0.272	S	S	.	.			trans	-59.8	126.1	171.8	-177.7	-31.1	0	0	0	108.8	K212 R213	N210-K212 PolarHBondContact O-N 3.33Å; N210-K212 PolarHBondContact OD1-N 2.99Å; N210-R213 PolarHBondContact O-N 3.11Å
211	D	71.9	Confident	90.4	Very high	123 Å²	123	57.8 Å²	57.8	66%	0.658	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-48.6	-29.8	-175.7	-70.4	-25.5	0	0	0	113.6	I209 R213 I214	I209-D211 PolarHBondContact O-N 3.33Å; D211-R213 PolarHBondContact O-N 3.36Å; D211-I214 PolarHBondContact O-N 2.99Å
212	K	76.2	Confident	90.4	Very high	197 Å²	197	56.1 Å²	56.1	86%	0.857	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-67.4	-18.1	176.9	-65.4	-174.2	178.8	-178.7	0	114.5	N210	N210-K212 PolarHBondContact O-N 3.33Å; N210-K212 PolarHBondContact OD1-N 2.99Å
213	R	88.1	Confident	90.5	Very high	69 Å²	69	56.1 Å²	56.1	26%	0.26	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-101.6	-13.4	-178.8	-66.2	-166.7	-61.7	113	-7.2	113.3	S173 Q175 S176 I177 I209 N210 D211	S173-R213 PolarHBondContact O-NH1 3.4Å; Q175-R213 PolarHBondContact O-NH1 3.38Å; S176-R213 CarbonylContact C-O 3.51Å; S176-R213 VanDerWaalsContact CA-O 3.31Å; S176-R213 WeakPolarHBondContact CA-O 3.37Å; I177-R213 PolarHBondContact N-O 3.36Å; I209-R213 HydrophobicContact CG2-CB 3.91Å; N210-R213 PolarHBondContact O-N 3.11Å; D211-R213 PolarHBondContact O-N 3.36Å
214	I	92.3	Very high	90.5	Very high	20 Å²	20	58.8 Å²	58.8	10%	0.103	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.1	-178.7	-164.4	172.7	0	0	0	111	I177 V179 F205 I209 D211 F216	I177-I214 CarbonylContact O-C 3.59Å; I177-I214 WeakPolarHBondContact O-CA 3.3Å; V179-I214 HydrophobicContact CG2-CD1 3.96Å; V179-I214 HydrophobicContact CG2-CG1 4.22Å; F205-I214 HydrophobicContact CD1-CD1 4.26Å; F205-I214 HydrophobicContact CE1-CD1 4.09Å; I209-I214 HydrophobicContact CB-CB 4.42Å; I209-I214 HydrophobicContact CD1-CD1 3.98Å; I209-I214 HydrophobicContact CG2-CB 3.87Å; I209-I214 HydrophobicContact CG2-CG2 4.31Å; D211-I214 PolarHBondContact O-N 2.99Å; I214-F216 HydrophobicContact CD1-CE2 4.28Å; I214-F216 HydrophobicContact CD1-CZ 3.91Å; I214-F216 HydrophobicContact CG1-CE2 4.37Å; I214-F216 HydrophobicContact CG1-CZ 4.39Å
215	S	92.7	Very high	90.7	Very high	28 Å²	28	58.1 Å²	58.1	20%	0.196	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	157.5	173.9	54.1	0	0	0	0	110.2	N60 I177 C178 V179	N60-S215 PolarHBondContact ND2-OG 3.46Å; I177-S215 PolarHBondContact O-N 2.64Å; I177-S215 PolarHBondContact O-OG 2.8Å; C178-S215 WeakPolarHBondContact CA-O 3.4Å; V179-S215 PolarHBondContact N-O 3.28Å
216	F	93.8	Very high	90.9	Very high	45 Å²	45	59 Å²	59	20%	0.197	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.5	-179.1	-68.1	-83.8	0	0	0	111.5	V179 L184 I202 I214	V179-F216 HydrophobicContact CB-CD1 3.77Å; V179-F216 HydrophobicContact CB-CE1 3.75Å; V179-F216 HydrophobicContact CG1-CD1 4.13Å; V179-F216 HydrophobicContact CG1-CE1 3.97Å; V179-F216 HydrophobicContact CG2-CE1 4.3Å; V179-F216 VanDerWaalsContact O-CA 3.28Å; V179-F216 WeakPolarHBondContact O-CA 3.49Å; L184-F216 HydrophobicContact CB-CB 4.43Å; L184-F216 HydrophobicContact CB-CD1 3.61Å; L184-F216 HydrophobicContact CB-CD2 4.46Å; L184-F216 HydrophobicContact CB-CE1 3.9Å; L184-F216 HydrophobicContact CB-CG 3.91Å; L184-F216 HydrophobicContact CB-CZ 4.43Å; L184-F216 HydrophobicContact CD1-CD1 4.17Å; L184-F216 HydrophobicContact CD1-CE1 3.57Å; L184-F216 HydrophobicContact CD1-CZ 3.84Å; L184-F216 HydrophobicContact CG-CE1 4.41Å; L184-F216 VanDerWaalsContact O-CB 3.24Å; L184-F216 WeakPolarHBondContact O-CB 3.36Å; I202-F216 HydrophobicContact CG2-CE1 3.77Å; I202-F216 HydrophobicContact CG2-CZ 4.37Å; I214-F216 HydrophobicContact CD1-CE2 4.28Å; I214-F216 HydrophobicContact CD1-CZ 3.91Å; I214-F216 HydrophobicContact CG1-CE2 4.37Å; I214-F216 HydrophobicContact CG1-CZ 4.39Å
217	E	94.2	Very high	91.1	Very high	38 Å²	38	61.7 Å²	61.7	18%	0.178	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	159.8	175.3	-77.1	-69.6	178	0	0	111.5	M58 V179 W180 Y181 K187 P219	M58-E217 HydrophobicContact CE-CB 4.44Å; M58-E217 HydrophobicContact CE-CG 3.75Å; V179-E217 PolarHBondContact O-N 2.9Å; W180-E217 CarbonylContact C-O 3.55Å; W180-E217 VanDerWaalsContact CA-O 3.28Å; W180-E217 WeakPolarHBondContact CA-O 3.43Å; W180-E217 HydrophobicContact CD2-CB 3.87Å; W180-E217 HydrophobicContact CE3-CB 3.55Å; W180-E217 HydrophobicContact CH2-CB 4.4Å; W180-E217 HydrophobicContact CZ3-CB 3.83Å; Y181-E217 PolarHBondContact N-O 2.78Å; K187-E217 VanDerWaalsContact NZ-CD 3.28Å; K187-E217 IonicContact NZ-OE1 2.78Å; K187-E217 PolarHBondContact NZ-OE1 3.24Å; K187-E217 IonicContact NZ-OE2 2.8Å; K187-E217 PolarHBondContact NZ-OE2 3.41Å; E217-P219 WeakPolarHBondContact O-CD 3.47Å
218	N	94.3	Very high	91.4	Very high	10 Å²	10	58.5 Å²	58.5	5%	0.053	28%	0.284	C	S	.	.			trans	-97.6	113.7	-179.4	-174.9	-9.8	0	0	0	109.9	S182 S185 K187 D220 Y221	S182-N218 WeakPolarHBondContact CB-OD1 3.41Å; S182-N218 PolarHBondContact OG-OD1 3.05Å; S185-N218 PolarHBondContact OG-N 2.87Å; K187-N218 PolarHBondContact O-ND2 3.16Å; N218-D220 VanDerWaalsContact C-N 3.32Å; N218-D220 WeakPolarHBondContact OD1-CB 3.36Å; N218-D220 PolarHBondContact OD1-N 3.38Å; N218-D220 PolarHBondContact OD1-OD2 3.37Å; N218-Y221 WeakPolarHBondContact O-CD1 3.43Å; N218-Y221 WeakPolarHBondContact O-CE1 3.3Å
219	P	95.1	Very high	91.7	Very high	3 Å²	3	60 Å²	60	2%	0.019	29%	0.294	C	S	.	.			trans	-78.2	-13.6	177.1	31.4	-33.7	0	0	0	113.8	F47 V67 W180 E217 Y221 L222 I223	F47-P219 HydrophobicContact CE2-CB 4.23Å; F47-P219 HydrophobicContact CZ-CB 3.94Å; V67-P219 HydrophobicContact CG1-CB 4.31Å; W180-P219 HydrophobicContact CB-CB 4.17Å; W180-P219 HydrophobicContact CB-CG 4.25Å; W180-P219 HydrophobicContact CE3-CB 4.38Å; E217-P219 WeakPolarHBondContact O-CD 3.47Å; P219-Y221 VanDerWaalsContact C-N 3.34Å; P219-Y221 PolarHBondContact O-N 3Å; P219-L222 WeakPolarHBondContact O-CB 3.42Å; P219-L222 PolarHBondContact O-N 3.13Å; P219-I223 HydrophobicContact CB-CD1 4.3Å; P219-I223 WeakPolarHBondContact O-CG1 3.42Å; P219-I223 PolarHBondContact O-N 2.92Å
220	D	94.3	Very high	92.2	Very high	18 Å²	18	64 Å²	64	10%	0.096	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-41.2	-166.8	-65.5	-24.7	0	0	0	112.1	N90 S182 R192 N218 L222 I223 D224	N90-D220 PolarHBondContact ND2-OD1 3.04Å; S182-D220 WeakPolarHBondContact CB-OD2 3.48Å; S182-D220 PolarHBondContact OG-OD2 3.24Å; R192-D220 IonicContact CZ-OD2 2.94Å; R192-D220 VanDerWaalsContact NH1-CG 3.29Å; R192-D220 IonicContact NH1-OD1 3.61Å; R192-D220 PolarHBondContact NH1-OD1 3Å; R192-D220 IonicContact NH1-OD2 2.78Å; R192-D220 PolarHBondContact NH1-OD2 3.35Å; N218-D220 VanDerWaalsContact C-N 3.32Å; N218-D220 WeakPolarHBondContact OD1-CB 3.36Å; N218-D220 PolarHBondContact OD1-N 3.38Å; N218-D220 PolarHBondContact OD1-OD2 3.37Å; D220-L222 PolarHBondContact O-N 3.22Å; D220-I223 CarbonylContact O-C 3.51Å; D220-I223 WeakPolarHBondContact O-CA 3.16Å; D220-I223 WeakPolarHBondContact O-CB 3.35Å; D220-I223 PolarHBondContact O-N 2.91Å; D220-D224 VanDerWaalsContact O-CG 3.28Å; D220-D224 PolarHBondContact O-N 3.29Å
221	Y	93.5	Very high	93.2	Very high	107 Å²	107	60.8 Å²	60.8	42%	0.42	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-29.2	179.8	77.5	-86.1	0	0	0	113.1	C54 W180 N218 P219 S225	C54-Y221 PolarHBondContact SG-OH 3Å; W180-Y221 HydrophobicContact CZ3-CE1 4.47Å; N218-Y221 WeakPolarHBondContact O-CD1 3.43Å; N218-Y221 WeakPolarHBondContact O-CE1 3.3Å; P219-Y221 VanDerWaalsContact C-N 3.34Å; P219-Y221 PolarHBondContact O-N 3Å; Y221-S225 PolarHBondContact O-N 3.1Å; Y221-S225 VanDerWaalsContact O-N 3.15Å
222	L	96.7	Very high	94.3	Very high	9 Å²	9	61.8 Å²	61.8	5%	0.047	30%	0.302	C	S	.	.	H	α-helix	trans	-72.6	-41.6	174	-60.8	-180	0	0	0	110.5	F47 K50 V51 W180 P219 D220 S225 I226	F47-L222 HydrophobicContact CD2-CB 4.31Å; F47-L222 HydrophobicContact CE2-CB 4.06Å; K50-L222 HydrophobicContact CB-CD1 4.39Å; K50-L222 HydrophobicContact CB-CD2 4.2Å; V51-L222 HydrophobicContact CB-CD1 4.5Å; V51-L222 HydrophobicContact CG2-CD1 3.77Å; W180-L222 HydrophobicContact CH2-CD1 4.39Å; W180-L222 HydrophobicContact CZ3-CD1 4.08Å; P219-L222 WeakPolarHBondContact O-CB 3.42Å; P219-L222 PolarHBondContact O-N 3.13Å; D220-L222 PolarHBondContact O-N 3.22Å; L222-S225 PolarHBondContact O-N 3.16Å; L222-S225 PolarHBondContact O-OG 2.89Å; L222-I226 PolarHBondContact O-N 2.8Å
223	I	97.1	Very high	95.2	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-41.3	177	-56.3	168.4	0	0	0	110.5	F47 I69 N90 F94 P219 D220 S225 I226 R227	F47-I223 HydrophobicContact CD2-CG1 3.83Å; F47-I223 HydrophobicContact CE2-CD1 4.15Å; F47-I223 HydrophobicContact CE2-CG1 3.45Å; F47-I223 VanDerWaalsContact CE2-CG1 3.45Å; F47-I223 HydrophobicContact CZ-CD1 4.39Å; F47-I223 HydrophobicContact CZ-CG1 4.16Å; I69-I223 HydrophobicContact CD1-CD1 3.98Å; N90-I223 HydrophobicContact CB-CD1 4.11Å; N90-I223 HydrophobicContact CB-CG2 4.23Å; N90-I223 VanDerWaalsContact OD1-CG2 3.32Å; N90-I223 WeakPolarHBondContact OD1-CG2 3.47Å; F94-I223 HydrophobicContact CE2-CD1 4Å; F94-I223 HydrophobicContact CE2-CG1 3.89Å; F94-I223 HydrophobicContact CE2-CG2 3.92Å; F94-I223 HydrophobicContact CZ-CG1 4.06Å; F94-I223 HydrophobicContact CZ-CG2 4.12Å; P219-I223 HydrophobicContact CB-CD1 4.3Å; P219-I223 WeakPolarHBondContact O-CG1 3.42Å; P219-I223 PolarHBondContact O-N 2.92Å; D220-I223 CarbonylContact O-C 3.51Å; D220-I223 WeakPolarHBondContact O-CA 3.16Å; D220-I223 WeakPolarHBondContact O-CB 3.35Å; D220-I223 PolarHBondContact O-N 2.91Å; I223-S225 VanDerWaalsContact C-N 3.3Å; I223-S225 PolarHBondContact O-N 3.23Å; I223-I226 WeakPolarHBondContact O-CG1 3.17Å; I223-I226 PolarHBondContact O-N 3.27Å; I223-R227 HydrophobicContact CG2-CG 4.31Å; I223-R227 WeakPolarHBondContact O-CB 3.19Å; I223-R227 VanDerWaalsContact O-CG 3.24Å; I223-R227 WeakPolarHBondContact O-CG 3.47Å; I223-R227 PolarHBondContact O-N 2.96Å
224	D	95.5	Very high	95.6	Very high	90 Å²	90	50.5 Å²	50.5	48%	0.481	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-39.5	176.2	-67.1	-22.3	0	0	0	111.1	D220 I226 R227 L228	D220-D224 VanDerWaalsContact O-CG 3.28Å; D220-D224 PolarHBondContact O-N 3.29Å; D224-I226 VanDerWaalsContact C-N 3.32Å; D224-I226 PolarHBondContact O-N 3.48Å; D224-R227 PolarHBondContact O-N 3.48Å; D224-L228 PolarHBondContact O-N 3.02Å
225	S	97.5	Very high	95.9	Very high	48 Å²	48	52.8 Å²	52.8	34%	0.336	27%	0.266	S	S	.	.	H	α-helix	trans	-63	-35.7	178.5	82.6	0	0	0	0	113.3	K50 Y221 L222 I223	K50-S225 VanDerWaalsContact CE-OG 3.27Å; K50-S225 WeakPolarHBondContact CE-OG 3.35Å; K50-S225 PolarHBondContact NZ-OG 2.8Å; Y221-S225 PolarHBondContact O-N 3.1Å; Y221-S225 VanDerWaalsContact O-N 3.15Å; L222-S225 PolarHBondContact O-N 3.16Å; L222-S225 PolarHBondContact O-OG 2.89Å; I223-S225 VanDerWaalsContact C-N 3.3Å; I223-S225 PolarHBondContact O-N 3.23Å
226	I	97.9	Very high	96	Very high	19 Å²	19	56.5 Å²	56.5	10%	0.097	28%	0.279	C	S	.	.	H	α-helix	trans	-79.6	-30.1	176.9	62	177.2	0	0	0	111.7	I46 F47 K50 Y93 F94 L222 I223 D224 L228	I46-I226 HydrophobicContact CG2-CG2 3.59Å; F47-I226 HydrophobicContact CB-CD1 3.99Å; F47-I226 HydrophobicContact CD2-CD1 4.48Å; K50-I226 HydrophobicContact CD-CG2 3.52Å; Y93-I226 HydrophobicContact CD1-CD1 4.43Å; Y93-I226 HydrophobicContact CE1-CD1 3.63Å; Y93-I226 HydrophobicContact CE1-CG1 3.99Å; F94-I226 HydrophobicContact CE1-CD1 3.63Å; F94-I226 HydrophobicContact CZ-CD1 3.53Å; L222-I226 PolarHBondContact O-N 2.8Å; I223-I226 WeakPolarHBondContact O-CG1 3.17Å; I223-I226 PolarHBondContact O-N 3.27Å; D224-I226 VanDerWaalsContact C-N 3.32Å; D224-I226 PolarHBondContact O-N 3.48Å; I226-L228 VanDerWaalsContact C-N 3.27Å; I226-L228 PolarHBondContact O-N 2.72Å
227	R	97.1	Very high	96	Very high	73 Å²	73	54.4 Å²	54.4	28%	0.275	27%	0.269	S	S	.	.	H	α-helix	trans	-79.1	-9.5	177.6	-70.3	175.6	71.6	-161.8	-4.5	112.6	N90 Y93 I223 D224 K230	N90-R227 PolarHBondContact OD1-NH1 2.86Å; Y93-R227 HydrophobicContact CD1-CG 3.99Å; Y93-R227 HydrophobicContact CD2-CG 3.9Å; Y93-R227 HydrophobicContact CE1-CG 3.8Å; Y93-R227 HydrophobicContact CE2-CG 3.7Å; Y93-R227 HydrophobicContact CG-CG 4.03Å; I223-R227 HydrophobicContact CG2-CG 4.31Å; I223-R227 WeakPolarHBondContact O-CB 3.19Å; I223-R227 VanDerWaalsContact O-CG 3.24Å; I223-R227 WeakPolarHBondContact O-CG 3.47Å; I223-R227 PolarHBondContact O-N 2.96Å; D224-R227 PolarHBondContact O-N 3.48Å; R227-K230 WeakPolarHBondContact O-CD 3.33Å; R227-K230 WeakPolarHBondContact O-CE 3.42Å; R227-K230 PolarHBondContact O-NZ 3.08Å
228	L	97.7	Very high	96.1	Very high	123 Å²	123	54.7 Å²	54.7	64%	0.644	27%	0.272	S	S	*	.	S	Bend	trans	-59.7	-50.8	179.4	-177.1	64	0	0	0	111.1	D224 I226 K230	D224-L228 PolarHBondContact O-N 3.02Å; I226-L228 VanDerWaalsContact C-N 3.27Å; I226-L228 PolarHBondContact O-N 2.72Å; L228-K230 WeakPolarHBondContact O-CD 3.3Å; L228-K230 PolarHBondContact O-NZ 3.09Å
229	I	97	Very high	96.1	Very high	135 Å²	135	60.6 Å²	60.6	69%	0.692	30%	0.297	S	S	*	.	S	Bend	trans	-92.2	117.5	179.1	-52.3	-56	0	0	0	109.2
230	K	97.3	Very high	96.1	Very high	88 Å²	88	61.3 Å²	61.3	38%	0.383	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-83.4	139.6	-175.4	-83.7	55.5	169.9	175.6	0	110.9	R227 L228 E234 I235 L238	R227-K230 WeakPolarHBondContact O-CD 3.33Å; R227-K230 WeakPolarHBondContact O-CE 3.42Å; R227-K230 PolarHBondContact O-NZ 3.08Å; L228-K230 WeakPolarHBondContact O-CD 3.3Å; L228-K230 PolarHBondContact O-NZ 3.09Å; K230-E234 VanDerWaalsContact CA-OE2 3.31Å; K230-E234 WeakPolarHBondContact CA-OE2 3.2Å; K230-E234 HydrophobicContact CB-CB 3.95Å; K230-E234 HydrophobicContact CG-CB 3.96Å; K230-I235 HydrophobicContact CB-CD1 4.47Å; K230-I235 HydrophobicContact CB-CG1 3.85Å; K230-L238 HydrophobicContact CG-CD1 3.83Å
231	S	96.6	Very high	96.2	Very high	32 Å²	32	60.5 Å²	60.5	22%	0.224	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-71.2	167.4	169.7	97.4	0	0	0	0	111.8	E39 Y233 E234 I235	E39-S231 VanDerWaalsContact CD-OG 3.23Å; E39-S231 VanDerWaalsContact OE1-CB 3.23Å; E39-S231 WeakPolarHBondContact OE1-CB 3.5Å; E39-S231 PolarHBondContact OE1-OG 2.89Å; E39-S231 PolarHBondContact OE2-OG 3.34Å; S231-Y233 PolarHBondContact O-N 3.41Å; S231-Y233 WeakPolarHBondContact OG-CB 3.37Å; S231-Y233 PolarHBondContact OG-N 2.76Å; S231-Y233 VanDerWaalsContact OG-N 3.09Å; S231-E234 PolarHBondContact N-OE2 3.31Å; S231-E234 PolarHBondContact O-N 2.76Å; S231-E234 VanDerWaalsContact O-N 3.16Å; S231-E234 WeakPolarHBondContact OG-CG 3.14Å; S231-E234 PolarHBondContact OG-N 2.9Å; S231-I235 WeakPolarHBondContact O-CG1 2.84Å; S231-I235 PolarHBondContact O-N 3.3Å
232	N	96	Very high	96.4	Very high	145 Å²	145	58.4 Å²	58.4	78%	0.775	30%	0.295	S	S	*	.	H	α-helix	trans	-58.6	-35.5	173.4	-73.1	-33.8	0	0	0	112.6	K236	N232-K236 PolarHBondContact O-N 2.95Å; N232-K236 VanDerWaalsContact O-N 3.17Å
233	Y	95.2	Very high	96.4	Very high	24 Å²	24	62.7 Å²	62.7	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-50.1	174.6	173.9	-89.4	0	0	0	110.6	S33 S34 V35 E39 S231 I235 K236 Q237 Y321	S33-Y233 WeakPolarHBondContact O-CE2 3.45Å; S33-Y233 PolarHBondContact O-OH 3.2Å; S34-Y233 WeakPolarHBondContact O-CE2 3.44Å; V35-Y233 HydrophobicContact CB-CE1 4.34Å; V35-Y233 HydrophobicContact CG2-CD1 4.08Å; V35-Y233 HydrophobicContact CG2-CE1 3.48Å; V35-Y233 VanDerWaalsContact CG2-CE1 3.48Å; V35-Y233 HydrophobicContact CG2-CE2 4.48Å; E39-Y233 WeakPolarHBondContact OE2-CB 3.38Å; S231-Y233 PolarHBondContact O-N 3.41Å; S231-Y233 WeakPolarHBondContact OG-CB 3.37Å; S231-Y233 PolarHBondContact OG-N 2.76Å; S231-Y233 VanDerWaalsContact OG-N 3.09Å; Y233-I235 PolarHBondContact O-N 3.36Å; Y233-K236 WeakPolarHBondContact O-CB 3.27Å; Y233-K236 PolarHBondContact O-N 2.91Å; Y233-K236 VanDerWaalsContact O-N 3.14Å; Y233-Q237 HydrophobicContact CD1-CG 4Å; Y233-Q237 HydrophobicContact CE1-CG 3.5Å; Y233-Q237 VanDerWaalsContact CE1-CG 3.5Å; Y233-Q237 WeakPolarHBondContact O-CG 3.32Å; Y233-Q237 PolarHBondContact O-N 3.39Å; Y233-Q237 VanDerWaalsContact O-N 3.09Å; Y233-Q237 PolarHBondContact O-NE2 3.19Å; Y233-Y321 HydrophobicContact CD1-CE2 4.5Å; Y233-Y321 AromaticContact CE1-CE2 3.99Å; Y233-Y321 HydrophobicContact CE1-CE2 3.99Å
234	E	96.5	Very high	96.3	Very high	5 Å²	5	62.8 Å²	62.8	2%	0.023	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-43.1	-177.3	-51.9	-166.8	94.3	0	0	111.6	R43 Y93 K230 S231 K236 Q237 L238 Y321	R43-E234 IonicContact NH2-OE1 2.65Å; Y93-E234 WeakPolarHBondContact CE2-OE1 3.36Å; K230-E234 VanDerWaalsContact CA-OE2 3.31Å; K230-E234 WeakPolarHBondContact CA-OE2 3.2Å; K230-E234 HydrophobicContact CB-CB 3.95Å; K230-E234 HydrophobicContact CG-CB 3.96Å; S231-E234 PolarHBondContact N-OE2 3.31Å; S231-E234 PolarHBondContact O-N 2.76Å; S231-E234 VanDerWaalsContact O-N 3.16Å; S231-E234 WeakPolarHBondContact OG-CG 3.14Å; S231-E234 PolarHBondContact OG-N 2.9Å; E234-K236 PolarHBondContact O-N 2.67Å; E234-Q237 PolarHBondContact O-N 2.58Å; E234-Q237 VanDerWaalsContact O-N 3.14Å; E234-L238 WeakPolarHBondContact O-CB 3.34Å; E234-L238 WeakPolarHBondContact O-CG 3.11Å; E234-L238 PolarHBondContact O-N 2.9Å; E234-Y321 HydrophobicContact CB-CD1 4.29Å; E234-Y321 HydrophobicContact CB-CE1 3.54Å; E234-Y321 HydrophobicContact CG-CE1 3.72Å; E234-Y321 WeakPolarHBondContact CG-OH 3.23Å; E234-Y321 WeakPolarHBondContact OE1-CE1 3.14Å; E234-Y321 PolarHBondContact OE1-OH 2.88Å
235	I	96.9	Very high	96.3	Very high	68 Å²	68	58.5 Å²	58.5	35%	0.349	30%	0.295	S	S	.	.	H	α-helix	trans	-58	-40	175.3	-68.9	167.7	0	0	0	110.5	K230 S231 Y233 K239	K230-I235 HydrophobicContact CB-CD1 4.47Å; K230-I235 HydrophobicContact CB-CG1 3.85Å; S231-I235 WeakPolarHBondContact O-CG1 2.84Å; S231-I235 PolarHBondContact O-N 3.3Å; Y233-I235 PolarHBondContact O-N 3.36Å; I235-K239 HydrophobicContact CG2-CD 4.18Å; I235-K239 HydrophobicContact CG2-CG 4.44Å; I235-K239 WeakPolarHBondContact O-CB 3.03Å; I235-K239 VanDerWaalsContact O-CG 3.3Å; I235-K239 WeakPolarHBondContact O-CG 3.24Å; I235-K239 PolarHBondContact O-N 2.88Å
236	K	95.2	Very high	96.3	Very high	106 Å²	106	58.4 Å²	58.4	46%	0.461	29%	0.292	S	S	.	.	H	α-helix	trans	-65.3	-42.3	176.8	-174.3	-177.3	176.4	-173	0	111.9	N232 Y233 E234 T240	N232-K236 PolarHBondContact O-N 2.95Å; N232-K236 VanDerWaalsContact O-N 3.17Å; Y233-K236 WeakPolarHBondContact O-CB 3.27Å; Y233-K236 PolarHBondContact O-N 2.91Å; Y233-K236 VanDerWaalsContact O-N 3.14Å; E234-K236 PolarHBondContact O-N 2.67Å; K236-T240 PolarHBondContact O-N 3.07Å; K236-T240 PolarHBondContact O-OG1 3.44Å
237	Q	94.2	Very high	96.3	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.8	-46.1	176.4	-52.5	-41.9	-64.8	0	0	111.2	Y233 E234 K239 T240 S241 F318 N319 Y321	Y233-Q237 HydrophobicContact CD1-CG 4Å; Y233-Q237 HydrophobicContact CE1-CG 3.5Å; Y233-Q237 VanDerWaalsContact CE1-CG 3.5Å; Y233-Q237 WeakPolarHBondContact O-CG 3.32Å; Y233-Q237 PolarHBondContact O-N 3.39Å; Y233-Q237 VanDerWaalsContact O-N 3.09Å; Y233-Q237 PolarHBondContact O-NE2 3.19Å; E234-Q237 PolarHBondContact O-N 2.58Å; E234-Q237 VanDerWaalsContact O-N 3.14Å; Q237-K239 PolarHBondContact O-N 3.26Å; Q237-T240 WeakPolarHBondContact O-CB 3.18Å; Q237-T240 PolarHBondContact O-N 3.43Å; Q237-S241 PolarHBondContact O-N 2.85Å; Q237-F318 HydrophobicContact CB-CD1 4.44Å; Q237-F318 VanDerWaalsContact OE1-CE1 3.25Å; Q237-N319 HydrophobicContact CG-CB 4.49Å; Q237-N319 PolarHBondContact OE1-ND2 3.12Å; Q237-Y321 HydrophobicContact CB-CD2 3.27Å; Q237-Y321 HydrophobicContact CB-CE2 4Å; Q237-Y321 HydrophobicContact CB-CG 3.61Å; Q237-Y321 HydrophobicContact CG-CD2 3.53Å; Q237-Y321 HydrophobicContact CG-CE2 3.77Å; Q237-Y321 HydrophobicContact CG-CG 4.33Å
238	L	95.7	Very high	96.3	Very high	44 Å²	44	57.1 Å²	57.1	23%	0.23	29%	0.289	C	S	.	.	H	α-helix	trans	-60.1	-44.6	177.3	-75.8	167.5	0	0	0	112	K230 E234 T240 S241 V242 Y321 T322	K230-L238 HydrophobicContact CG-CD1 3.83Å; E234-L238 WeakPolarHBondContact O-CB 3.34Å; E234-L238 WeakPolarHBondContact O-CG 3.11Å; E234-L238 PolarHBondContact O-N 2.9Å; L238-T240 VanDerWaalsContact C-N 3.28Å; L238-T240 PolarHBondContact O-N 3.39Å; L238-S241 WeakPolarHBondContact O-CB 3.36Å; L238-S241 PolarHBondContact O-N 3.42Å; L238-V242 WeakPolarHBondContact O-CB 3.38Å; L238-V242 VanDerWaalsContact O-CG2 3.31Å; L238-V242 WeakPolarHBondContact O-CG2 3.44Å; L238-V242 PolarHBondContact O-N 3.41Å; L238-Y321 HydrophobicContact CD1-CD1 4.41Å; L238-Y321 HydrophobicContact CD2-CD1 4.2Å; L238-Y321 HydrophobicContact CG-CD1 3.93Å; L238-Y321 HydrophobicContact CG-CG 4.34Å; L238-T322 WeakPolarHBondContact CD2-O 3.5Å
239	K	96.1	Very high	96.3	Very high	135 Å²	135	51.5 Å²	51.5	59%	0.587	26%	0.26	S	S	*	.	H	α-helix	trans	-57.9	-42.6	175.4	-79.7	179	177.8	-178	0	111.7	I235 Q237 V242 I243	I235-K239 HydrophobicContact CG2-CD 4.18Å; I235-K239 HydrophobicContact CG2-CG 4.44Å; I235-K239 WeakPolarHBondContact O-CB 3.03Å; I235-K239 VanDerWaalsContact O-CG 3.3Å; I235-K239 WeakPolarHBondContact O-CG 3.24Å; I235-K239 PolarHBondContact O-N 2.88Å; Q237-K239 PolarHBondContact O-N 3.26Å; K239-V242 PolarHBondContact O-N 2.87Å; K239-I243 WeakPolarHBondContact O-CB 3.49Å; K239-I243 WeakPolarHBondContact O-CD1 3.24Å; K239-I243 WeakPolarHBondContact O-CG1 3.15Å; K239-I243 PolarHBondContact O-N 3.34Å
240	T	94.4	Very high	96.3	Very high	18 Å²	18	48.4 Å²	48.4	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-61.4	-47.5	176.9	-54.5	0	0	0	0	110.9	L29 K236 Q237 L238 V242 I243 A244 F318	L29-T240 HydrophobicContact CD2-CG2 3.76Å; K236-T240 PolarHBondContact O-N 3.07Å; K236-T240 PolarHBondContact O-OG1 3.44Å; Q237-T240 WeakPolarHBondContact O-CB 3.18Å; Q237-T240 PolarHBondContact O-N 3.43Å; L238-T240 VanDerWaalsContact C-N 3.28Å; L238-T240 PolarHBondContact O-N 3.39Å; T240-V242 PolarHBondContact O-N 3.2Å; T240-I243 PolarHBondContact O-N 3.38Å; T240-A244 PolarHBondContact O-N 3.31Å; T240-F318 HydrophobicContact CG2-CD1 3.73Å; T240-F318 HydrophobicContact CG2-CD2 4.16Å; T240-F318 HydrophobicContact CG2-CE1 3.76Å; T240-F318 HydrophobicContact CG2-CE2 4.2Å; T240-F318 HydrophobicContact CG2-CG 3.93Å; T240-F318 HydrophobicContact CG2-CZ 4.01Å
241	S	95.6	Very high	96.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-45.3	175.7	-174.3	0	0	0	0	112.9	Q237 L238 A244 A245 C316 Y321 S323	Q237-S241 PolarHBondContact O-N 2.85Å; L238-S241 WeakPolarHBondContact O-CB 3.36Å; L238-S241 PolarHBondContact O-N 3.42Å; S241-A244 PolarHBondContact O-N 3.05Å; S241-A245 WeakPolarHBondContact O-CB 3.43Å; S241-A245 PolarHBondContact O-N 3.35Å; S241-C316 WeakPolarHBondContact O-CB 3.35Å; S241-C316 VanDerWaalsContact OG-C 3.23Å; S241-C316 WeakPolarHBondContact OG-CB 3.46Å; S241-C316 PolarHBondContact OG-O 3.1Å; S241-Y321 PolarHBondContact OG-O 3.43Å; S241-S323 PolarHBondContact O-OG 2.76Å; S241-S323 WeakPolarHBondContact OG-CB 3.34Å; S241-S323 PolarHBondContact OG-N 2.89Å; S241-S323 VanDerWaalsContact OG-N 3.13Å; S241-S323 PolarHBondContact OG-OG 3.25Å; S241-S323 VanDerWaalsContact OG-OG 3.1Å
242	V	97.4	Very high	96.3	Very high	63 Å²	63	43.1 Å²	43.1	38%	0.382	22%	0.216	S	C	.	.	H	α-helix	trans	-64.4	-45.6	179	169.3	0	0	0	0	111.1	L238 K239 T240 A244 A245 V246 I325	L238-V242 WeakPolarHBondContact O-CB 3.38Å; L238-V242 VanDerWaalsContact O-CG2 3.31Å; L238-V242 WeakPolarHBondContact O-CG2 3.44Å; L238-V242 PolarHBondContact O-N 3.41Å; K239-V242 PolarHBondContact O-N 2.87Å; T240-V242 PolarHBondContact O-N 3.2Å; V242-A244 VanDerWaalsContact C-N 3.33Å; V242-A244 PolarHBondContact O-N 3.36Å; V242-A245 PolarHBondContact O-N 2.89Å; V242-V246 HydrophobicContact CG1-CG2 4.19Å; V242-V246 WeakPolarHBondContact O-CB 3.49Å; V242-V246 VanDerWaalsContact O-CG2 3.3Å; V242-V246 WeakPolarHBondContact O-CG2 3.08Å; V242-V246 PolarHBondContact O-N 2.99Å; V242-I325 HydrophobicContact CG1-CD1 4.36Å
243	I	96.7	Very high	96.3	Very high	100 Å²	100	38 Å²	38	51%	0.513	19%	0.188	S	C	.	.	H	α-helix	trans	-59.8	-46.4	178.2	-70.6	164.3	0	0	0	110.1	K239 T240 A245 V246 E247	K239-I243 WeakPolarHBondContact O-CB 3.49Å; K239-I243 WeakPolarHBondContact O-CD1 3.24Å; K239-I243 WeakPolarHBondContact O-CG1 3.15Å; K239-I243 PolarHBondContact O-N 3.34Å; T240-I243 PolarHBondContact O-N 3.38Å; I243-A245 VanDerWaalsContact C-N 3.34Å; I243-A245 PolarHBondContact O-N 3.43Å; I243-V246 PolarHBondContact O-N 3.36Å; I243-E247 HydrophobicContact CG2-CG 4.47Å; I243-E247 WeakPolarHBondContact O-CB 3.3Å; I243-E247 WeakPolarHBondContact O-CG 3.32Å; I243-E247 PolarHBondContact O-N 2.86Å
244	A	94.9	Very high	96.3	Very high	3 Å²	3	43.2 Å²	43.2	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-41.6	178	0	0	0	0	0	112.4	T240 S241 V242 S248 R276 C278 C316	T240-A244 PolarHBondContact O-N 3.31Å; S241-A244 PolarHBondContact O-N 3.05Å; V242-A244 VanDerWaalsContact C-N 3.33Å; V242-A244 PolarHBondContact O-N 3.36Å; A244-S248 WeakPolarHBondContact O-CB 3.42Å; A244-S248 PolarHBondContact O-N 3.03Å; A244-S248 PolarHBondContact O-OG 3.03Å; A244-R276 HydrophobicContact CB-CB 4.12Å; A244-C278 HydrophobicContact CB-CB 4.28Å; A244-C278 WeakPolarHBondContact CB-SG 3.41Å; A244-C316 HydrophobicContact CB-CB 4.4Å
245	A	96.9	Very high	96.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.8	-45.9	177.9	0	0	0	0	0	111.8	S241 V242 I243 E247 S248 L249 C316 S323 I325	S241-A245 WeakPolarHBondContact O-CB 3.43Å; S241-A245 PolarHBondContact O-N 3.35Å; V242-A245 PolarHBondContact O-N 2.89Å; I243-A245 VanDerWaalsContact C-N 3.34Å; I243-A245 PolarHBondContact O-N 3.43Å; A245-E247 PolarHBondContact O-N 3.24Å; A245-S248 PolarHBondContact O-N 3.5Å; A245-L249 WeakPolarHBondContact O-CG 3.21Å; A245-L249 PolarHBondContact O-N 3.21Å; A245-C316 HydrophobicContact CB-CB 4.21Å; A245-C316 PolarHBondContact N-SG 3.21Å; A245-C316 VanDerWaalsContact N-SG 3.37Å; A245-S323 WeakPolarHBondContact CB-OG 3.38Å; A245-I325 HydrophobicContact CB-CD1 3.75Å
246	V	98	Very high	96.2	Very high	45 Å²	45	42.8 Å²	42.8	27%	0.273	21%	0.211	S	C	.	.	H	α-helix	trans	-58.8	-47.7	177.3	168	0	0	0	0	111.3	V242 I243 S248 L249 K250 I325	V242-V246 HydrophobicContact CG1-CG2 4.19Å; V242-V246 WeakPolarHBondContact O-CB 3.49Å; V242-V246 VanDerWaalsContact O-CG2 3.3Å; V242-V246 WeakPolarHBondContact O-CG2 3.08Å; V242-V246 PolarHBondContact O-N 2.99Å; I243-V246 PolarHBondContact O-N 3.36Å; V246-S248 VanDerWaalsContact C-N 3.3Å; V246-S248 PolarHBondContact O-N 3.07Å; V246-L249 PolarHBondContact O-N 3.05Å; V246-K250 HydrophobicContact CG1-CD 4.28Å; V246-K250 WeakPolarHBondContact O-CG 3.44Å; V246-K250 PolarHBondContact O-N 2.71Å; V246-I325 HydrophobicContact CG2-CD1 3.79Å
247	E	97.3	Very high	96.3	Very high	66 Å²	66	42.6 Å²	42.6	31%	0.308	21%	0.212	S	C	.	.	H	α-helix	trans	-68.5	-30.9	179.5	-67.3	-54.5	130.1	0	0	112.4	I243 A245 K250 S251 R276	I243-E247 HydrophobicContact CG2-CG 4.47Å; I243-E247 WeakPolarHBondContact O-CB 3.3Å; I243-E247 WeakPolarHBondContact O-CG 3.32Å; I243-E247 PolarHBondContact O-N 2.86Å; A245-E247 PolarHBondContact O-N 3.24Å; E247-K250 IonicContact OE1-NZ 2.99Å; E247-K250 PolarHBondContact OE1-NZ 3.17Å; E247-S251 WeakPolarHBondContact O-CB 3.31Å; E247-S251 PolarHBondContact O-N 3.15Å; E247-S251 PolarHBondContact O-OG 3.41Å; E247-R276 VanDerWaalsContact CB-NE 3.29Å; E247-R276 PolarHBondContact O-NH2 3.44Å
248	S	97.5	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-68.1	-43.4	173.1	-57.7	0	0	0	0	111.7	A244 A245 V246 S251 A252 Q272 M273	A244-S248 WeakPolarHBondContact O-CB 3.42Å; A244-S248 PolarHBondContact O-N 3.03Å; A244-S248 PolarHBondContact O-OG 3.03Å; A245-S248 PolarHBondContact O-N 3.5Å; V246-S248 VanDerWaalsContact C-N 3.3Å; V246-S248 PolarHBondContact O-N 3.07Å; S248-S251 WeakPolarHBondContact O-CB 3.44Å; S248-S251 PolarHBondContact O-N 2.86Å; S248-A252 WeakPolarHBondContact O-CB 3.3Å; S248-A252 PolarHBondContact O-N 2.78Å; S248-Q272 VanDerWaalsContact OG-C 3.28Å; S248-Q272 PolarHBondContact OG-O 2.9Å; S248-M273 PolarHBondContact OG-N 3.05Å
249	L	97.5	Very high	96.5	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-42.2	175.4	-71.5	173.7	0	0	0	112	A245 V246 S251 A252 M253 V312 A314 I325 R327	A245-L249 WeakPolarHBondContact O-CG 3.21Å; A245-L249 PolarHBondContact O-N 3.21Å; V246-L249 PolarHBondContact O-N 3.05Å; L249-S251 VanDerWaalsContact C-N 3.29Å; L249-S251 PolarHBondContact O-N 3.28Å; L249-A252 WeakPolarHBondContact O-CB 3.42Å; L249-A252 PolarHBondContact O-N 3.01Å; L249-A252 VanDerWaalsContact O-N 3.14Å; L249-M253 WeakPolarHBondContact O-CG 3.46Å; L249-M253 PolarHBondContact O-N 3.14Å; L249-V312 HydrophobicContact CD2-CB 4.28Å; L249-V312 HydrophobicContact CD2-CG1 3.61Å; L249-A314 HydrophobicContact CD2-CB 4.37Å; L249-I325 HydrophobicContact CD1-CB 4.03Å; L249-I325 HydrophobicContact CD1-CG2 3.65Å; L249-R327 HydrophobicContact CD1-CG 4.3Å
250	K	96.8	Very high	96.6	Very high	69 Å²	69	38.7 Å²	38.7	30%	0.3	21%	0.206	S	C	.	.	H	α-helix	trans	-58	-43.7	172.7	-75.5	175.4	-178.8	172.3	0	111.6	V246 E247 A252 M253 Q254	V246-K250 HydrophobicContact CG1-CD 4.28Å; V246-K250 WeakPolarHBondContact O-CG 3.44Å; V246-K250 PolarHBondContact O-N 2.71Å; E247-K250 IonicContact OE1-NZ 2.99Å; E247-K250 PolarHBondContact OE1-NZ 3.17Å; K250-A252 VanDerWaalsContact C-N 3.32Å; K250-A252 PolarHBondContact O-N 3.2Å; K250-M253 PolarHBondContact O-N 3.27Å; K250-Q254 WeakPolarHBondContact O-CG 3.4Å; K250-Q254 PolarHBondContact O-N 3.06Å
251	S	96.8	Very high	96.7	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.07	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-42.4	176.2	-54.1	0	0	0	0	110.7	E247 S248 L249 Q254 I255 Y268 R276	E247-S251 WeakPolarHBondContact O-CB 3.31Å; E247-S251 PolarHBondContact O-N 3.15Å; E247-S251 PolarHBondContact O-OG 3.41Å; S248-S251 WeakPolarHBondContact O-CB 3.44Å; S248-S251 PolarHBondContact O-N 2.86Å; L249-S251 VanDerWaalsContact C-N 3.29Å; L249-S251 PolarHBondContact O-N 3.28Å; S251-Q254 WeakPolarHBondContact O-CB 3.48Å; S251-Q254 PolarHBondContact O-N 3.34Å; S251-I255 PolarHBondContact O-N 3.31Å; S251-Y268 WeakPolarHBondContact O-CE1 3.33Å; S251-R276 PolarHBondContact OG-NH2 3.29Å; S251-R276 VanDerWaalsContact OG-NH2 3.13Å
252	A	96.4	Very high	96.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-42.9	177.8	0	0	0	0	0	112.4	S248 L249 K250 Q254 I255 T256 L265 Y268 I269	S248-A252 WeakPolarHBondContact O-CB 3.3Å; S248-A252 PolarHBondContact O-N 2.78Å; L249-A252 WeakPolarHBondContact O-CB 3.42Å; L249-A252 PolarHBondContact O-N 3.01Å; L249-A252 VanDerWaalsContact O-N 3.14Å; K250-A252 VanDerWaalsContact C-N 3.32Å; K250-A252 PolarHBondContact O-N 3.2Å; A252-Q254 VanDerWaalsContact C-N 3.26Å; A252-Q254 PolarHBondContact O-N 2.89Å; A252-I255 VanDerWaalsContact O-CG1 3.25Å; A252-I255 WeakPolarHBondContact O-CG1 3.23Å; A252-I255 PolarHBondContact O-N 3.25Å; A252-T256 PolarHBondContact O-N 2.84Å; A252-T256 PolarHBondContact O-OG1 3.2Å; A252-L265 HydrophobicContact CB-CD1 3.77Å; A252-Y268 HydrophobicContact CB-CD1 4.41Å; A252-I269 HydrophobicContact CB-CD1 4.14Å; A252-I269 HydrophobicContact CB-CG1 3.49Å; A252-I269 VanDerWaalsContact CB-CG1 3.49Å
253	M	96.9	Very high	96.9	Very high	38 Å²	38	40.1 Å²	40.1	19%	0.187	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-37.4	174	-69.2	169.2	-175.1	0	0	112	L249 K250 I255 T256 R327 W329	L249-M253 WeakPolarHBondContact O-CG 3.46Å; L249-M253 PolarHBondContact O-N 3.14Å; K250-M253 PolarHBondContact O-N 3.27Å; M253-I255 VanDerWaalsContact C-N 3.33Å; M253-I255 PolarHBondContact O-N 2.83Å; M253-T256 PolarHBondContact O-N 3.11Å; M253-R327 HydrophobicContact CE-CB 3.95Å; M253-R327 HydrophobicContact CE-CG 4.23Å; M253-W329 HydrophobicContact CE-CD2 4.14Å; M253-W329 HydrophobicContact CE-CE3 3.62Å; M253-W329 HydrophobicContact CE-CH2 4.5Å; M253-W329 HydrophobicContact CE-CZ3 3.83Å; M253-W329 HydrophobicContact CG-CD2 3.78Å; M253-W329 HydrophobicContact CG-CE3 4.12Å; M253-W329 HydrophobicContact CG-CG 4.21Å; M253-W329 HydrophobicContact CG-CH2 4.23Å; M253-W329 HydrophobicContact CG-CZ2 3.92Å; M253-W329 HydrophobicContact CG-CZ3 4.34Å
254	Q	94.9	Very high	97	Very high	133 Å²	133	39 Å²	39	62%	0.621	21%	0.212	S	C	*	.	H	α-helix	trans	-67.8	-29.4	-179.4	-71.2	169.9	8.1	0	0	113.8	K250 S251 A252	K250-Q254 WeakPolarHBondContact O-CG 3.4Å; K250-Q254 PolarHBondContact O-N 3.06Å; S251-Q254 WeakPolarHBondContact O-CB 3.48Å; S251-Q254 PolarHBondContact O-N 3.34Å; A252-Q254 VanDerWaalsContact C-N 3.26Å; A252-Q254 PolarHBondContact O-N 2.89Å
255	I	94.8	Very high	97.2	Very high	56 Å²	56	38.8 Å²	38.8	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-92.9	-8.2	178.1	68.4	150	0	0	0	113.2	S251 A252 M253 Q257 I260 L265 Y268	S251-I255 PolarHBondContact O-N 3.31Å; A252-I255 VanDerWaalsContact O-CG1 3.25Å; A252-I255 WeakPolarHBondContact O-CG1 3.23Å; A252-I255 PolarHBondContact O-N 3.25Å; M253-I255 VanDerWaalsContact C-N 3.33Å; M253-I255 PolarHBondContact O-N 2.83Å; I255-Q257 PolarHBondContact O-N 3.44Å; I255-I260 HydrophobicContact CD1-CD1 4.15Å; I255-L265 HydrophobicContact CD1-CD1 4.4Å; I255-L265 HydrophobicContact CG1-CD1 4.39Å; I255-Y268 HydrophobicContact CD1-CD1 3.4Å; I255-Y268 VanDerWaalsContact CD1-CD1 3.4Å; I255-Y268 HydrophobicContact CD1-CD2 3.8Å; I255-Y268 HydrophobicContact CD1-CE1 3.89Å; I255-Y268 HydrophobicContact CD1-CE2 4.25Å; I255-Y268 HydrophobicContact CD1-CG 3.33Å; I255-Y268 HydrophobicContact CG1-CD1 3.77Å; I255-Y268 HydrophobicContact CG1-CE1 3.87Å; I255-Y268 HydrophobicContact CG1-CG 4.21Å; I255-Y268 HydrophobicContact CG2-CE1 3.83Å; I255-Y268 HydrophobicContact CG2-CE2 4.19Å
256	T	96.7	Very high	97.2	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.049	22%	0.22	C	C	.	.			trans	-69.3	127.3	-176.4	-58.2	0	0	0	0	110	A252 M253 I260 V310 W329 V331	A252-T256 PolarHBondContact O-N 2.84Å; A252-T256 PolarHBondContact O-OG1 3.2Å; M253-T256 PolarHBondContact O-N 3.11Å; T256-I260 HydrophobicContact CG2-CG2 4.38Å; T256-V310 HydrophobicContact CG2-CG1 4.36Å; T256-W329 PolarHBondContact OG1-NE1 3.25Å; T256-W329 VanDerWaalsContact OG1-NE1 3.11Å; T256-V331 HydrophobicContact CG2-CB 4.23Å; T256-V331 HydrophobicContact CG2-CG2 3.55Å
257	Q	96.3	Very high	97.2	Very high	102 Å²	102	41.7 Å²	41.7	48%	0.477	23%	0.229	S	C	.	.			trans	-148	154.4	175.5	-67.1	-64.5	-33.2	0	0	109	I255 G259 I260 V331	I255-Q257 PolarHBondContact O-N 3.44Å; Q257-G259 PolarHBondContact O-N 3.09Å; Q257-I260 WeakPolarHBondContact O-CB 3.25Å; Q257-I260 VanDerWaalsContact O-CG2 3.27Å; Q257-I260 WeakPolarHBondContact O-CG2 3.3Å; Q257-I260 PolarHBondContact O-N 2.79Å; Q257-I260 VanDerWaalsContact O-N 3.08Å; Q257-V331 CarbonylContact C-O 3.55Å; Q257-V331 WeakPolarHBondContact CA-O 3.33Å
258	P	97.3	Very high	97.3	Very high	51 Å²	51	41.5 Å²	41.5	33%	0.331	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	135.2	174.9	-26.7	36	0	0	0	112.2	N306 V331 N332	P258-N306 HydrophobicContact CB-CB 3.72Å; P258-N306 HydrophobicContact CG-CB 4Å; P258-V331 HydrophobicContact CB-CG1 4.43Å; P258-V331 HydrophobicContact CG-CG1 4.23Å; P258-N332 HydrophobicContact CG-CB 3.83Å
259	G	97.1	Very high	97.3	Very high	24 Å²	24	41.5 Å²	41.5	25%	0.247	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	-2.7	-177	0	0	0	0	0	114.9	Q257 I304	Q257-G259 PolarHBondContact O-N 3.09Å; G259-I304 WeakPolarHBondContact CA-O 3.19Å; G259-I304 PolarHBondContact N-O 3.15Å
260	I	97.6	Very high	97.3	Very high	22 Å²	22	43 Å²	43	11%	0.113	23%	0.233	C	C	.	.			trans	-60.2	147.2	167.1	-163.8	168	0	0	0	109.9	I255 T256 Q257 T264 L265 I304 V331	I255-I260 HydrophobicContact CD1-CD1 4.15Å; T256-I260 HydrophobicContact CG2-CG2 4.38Å; Q257-I260 WeakPolarHBondContact O-CB 3.25Å; Q257-I260 VanDerWaalsContact O-CG2 3.27Å; Q257-I260 WeakPolarHBondContact O-CG2 3.3Å; Q257-I260 PolarHBondContact O-N 2.79Å; Q257-I260 VanDerWaalsContact O-N 3.08Å; I260-T264 HydrophobicContact CD1-CG2 4.31Å; I260-T264 HydrophobicContact CG1-CG2 4.13Å; I260-L265 HydrophobicContact CD1-CB 4.13Å; I260-L265 HydrophobicContact CD1-CD1 4.16Å; I260-I304 HydrophobicContact CG2-CB 4.36Å; I260-I304 HydrophobicContact CG2-CD1 4.39Å; I260-I304 PolarHBondContact O-N 2.89Å; I260-V331 HydrophobicContact CG2-CG2 3.95Å
261	T	98.4	Very high	97.4	Very high	47 Å²	47	45.8 Å²	45.8	29%	0.288	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-93.5	148.6	172.4	71	0	0	0	0	110.5	T263 T264 L265 M302	T261-T263 PolarHBondContact O-N 2.98Å; T261-T264 PolarHBondContact O-N 2.94Å; T261-T264 VanDerWaalsContact O-N 3.11Å; T261-T264 WeakPolarHBondContact OG1-CB 3.45Å; T261-T264 PolarHBondContact OG1-N 3.26Å; T261-T264 PolarHBondContact OG1-OG1 2.9Å; T261-L265 PolarHBondContact O-N 3.12Å; T261-M302 WeakPolarHBondContact CA-O 3.48Å
262	E	98.6	Very high	97.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-53	-40.5	171.5	-67.3	166.6	171.7	0	0	111	T264 L265 Q266 V286 G288 R291 Y297 N300 N301 M302 I304	E262-T264 PolarHBondContact O-N 2.9Å; E262-L265 PolarHBondContact O-N 2.73Å; E262-Q266 WeakPolarHBondContact O-CB 3.3Å; E262-Q266 PolarHBondContact O-N 2.97Å; E262-V286 HydrophobicContact CB-CB 4.3Å; E262-V286 HydrophobicContact CB-CG1 3.95Å; E262-V286 WeakPolarHBondContact CB-O 3.24Å; E262-V286 HydrophobicContact CG-CG1 4.19Å; E262-V286 WeakPolarHBondContact CG-O 3.34Å; E262-G288 PolarHBondContact OE1-N 2.85Å; E262-R291 IonicContact OE1-CZ 2.78Å; E262-R291 IonicContact OE1-NE 3.18Å; E262-R291 PolarHBondContact OE1-NE 3.32Å; E262-R291 IonicContact OE1-NH2 3.93Å; E262-R291 PolarHBondContact OE1-NH2 3.36Å; E262-R291 IonicContact OE2-NE 2.67Å; E262-Y297 VanDerWaalsContact OE2-CE1 3.26Å; E262-Y297 WeakPolarHBondContact OE2-CE1 3.49Å; E262-Y297 PolarHBondContact OE2-OH 3.45Å; E262-N300 CarbonylContact C-O 3.5Å; E262-N300 VanDerWaalsContact CB-C 3.46Å; E262-N300 HydrophobicContact CB-CB 4.14Å; E262-N300 WeakPolarHBondContact OE2-CA 3.41Å; E262-N301 PolarHBondContact OE2-N 3.15Å; E262-N301 VanDerWaalsContact OE2-N 3.14Å; E262-M302 WeakPolarHBondContact CG-O 3.33Å; E262-M302 PolarHBondContact N-O 3.17Å; E262-M302 WeakPolarHBondContact OE2-CB 3.4Å; E262-M302 PolarHBondContact OE2-N 2.95Å; E262-I304 HydrophobicContact CG-CD1 3.92Å; E262-I304 HydrophobicContact CG-CG1 3.89Å
263	T	98.4	Very high	97.4	Very high	64 Å²	64	46 Å²	46	39%	0.393	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-44	177.5	-45.5	0	0	0	0	112.1	T261 L265 S267 N300	T261-T263 PolarHBondContact O-N 2.98Å; T263-L265 VanDerWaalsContact C-N 3.33Å; T263-S267 VanDerWaalsContact O-CB 3.32Å; T263-S267 WeakPolarHBondContact O-CB 3.49Å; T263-S267 PolarHBondContact O-N 2.95Å; T263-S267 PolarHBondContact O-OG 2.71Å; T263-N300 VanDerWaalsContact CA-O 3.27Å; T263-N300 WeakPolarHBondContact CA-O 3.37Å; T263-N300 WeakPolarHBondContact CB-O 3.28Å; T263-N300 PolarHBondContact N-O 3.22Å; T263-N300 PolarHBondContact OG1-O 3Å
264	T	98.3	Very high	97.3	Very high	75 Å²	75	50.6 Å²	50.6	46%	0.46	26%	0.257	S	S	.	.	H	α-helix	trans	-62.2	-44.6	177.5	-60.9	0	0	0	0	110.5	I260 T261 E262 S267 Y268	I260-T264 HydrophobicContact CD1-CG2 4.31Å; I260-T264 HydrophobicContact CG1-CG2 4.13Å; T261-T264 PolarHBondContact O-N 2.94Å; T261-T264 VanDerWaalsContact O-N 3.11Å; T261-T264 WeakPolarHBondContact OG1-CB 3.45Å; T261-T264 PolarHBondContact OG1-N 3.26Å; T261-T264 PolarHBondContact OG1-OG1 2.9Å; E262-T264 PolarHBondContact O-N 2.9Å; T264-S267 PolarHBondContact O-N 3.11Å; T264-Y268 WeakPolarHBondContact O-CB 3.14Å; T264-Y268 PolarHBondContact O-N 3.46Å
265	L	98.2	Very high	97.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-44.1	-179.6	-172	62.5	0	0	0	111.5	A252 I255 I260 T261 E262 T263 Y268 I269 V286 V310 V312 W329	A252-L265 HydrophobicContact CB-CD1 3.77Å; I255-L265 HydrophobicContact CD1-CD1 4.4Å; I255-L265 HydrophobicContact CG1-CD1 4.39Å; I260-L265 HydrophobicContact CD1-CB 4.13Å; I260-L265 HydrophobicContact CD1-CD1 4.16Å; T261-L265 PolarHBondContact O-N 3.12Å; E262-L265 PolarHBondContact O-N 2.73Å; T263-L265 VanDerWaalsContact C-N 3.33Å; L265-Y268 PolarHBondContact O-N 3.46Å; L265-I269 HydrophobicContact CG-CD1 4.13Å; L265-I269 WeakPolarHBondContact O-CD1 3.08Å; L265-I269 VanDerWaalsContact O-CG1 3.29Å; L265-I269 WeakPolarHBondContact O-CG1 3.18Å; L265-I269 PolarHBondContact O-N 3.4Å; L265-V286 HydrophobicContact CB-CG1 4.07Å; L265-V286 HydrophobicContact CD2-CG1 3.83Å; L265-V286 HydrophobicContact CG-CG1 4.2Å; L265-V310 HydrophobicContact CD2-CG2 3.81Å; L265-V312 HydrophobicContact CD2-CG2 4.09Å; L265-W329 HydrophobicContact CD2-CZ2 4.02Å
266	Q	98.3	Very high	97.3	Very high	39 Å²	39	45.1 Å²	45.1	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-54.7	-53.9	171.7	178.5	-172.7	-18	0	0	110.8	E262 Y268 I269 E270 P284 V286 N300	E262-Q266 WeakPolarHBondContact O-CB 3.3Å; E262-Q266 PolarHBondContact O-N 2.97Å; Q266-Y268 PolarHBondContact O-N 2.82Å; Q266-I269 PolarHBondContact O-N 3.34Å; Q266-I269 VanDerWaalsContact O-N 3.16Å; Q266-E270 HydrophobicContact CG-CG 4.36Å; Q266-E270 PolarHBondContact NE2-OE1 3.36Å; Q266-E270 VanDerWaalsContact O-CB 3.3Å; Q266-E270 WeakPolarHBondContact O-CB 3.46Å; Q266-E270 WeakPolarHBondContact O-CG 3.41Å; Q266-E270 PolarHBondContact O-N 3.35Å; Q266-P284 HydrophobicContact CG-CB 4.32Å; Q266-P284 HydrophobicContact CG-CG 4.24Å; Q266-V286 HydrophobicContact CB-CG2 3.89Å; Q266-N300 VanDerWaalsContact OE1-CB 3.26Å; Q266-N300 PolarHBondContact OE1-ND2 3.37Å
267	S	98.1	Very high	97	Very high	66 Å²	66	47.1 Å²	47.1	46%	0.462	26%	0.258	S	S	.	.	H	α-helix	trans	-58.4	-37.1	-178.1	-58.8	0	0	0	0	111.8	T263 T264 Y271	T263-S267 VanDerWaalsContact O-CB 3.32Å; T263-S267 WeakPolarHBondContact O-CB 3.49Å; T263-S267 PolarHBondContact O-N 2.95Å; T263-S267 PolarHBondContact O-OG 2.71Å; T264-S267 PolarHBondContact O-N 3.11Å; S267-Y271 WeakPolarHBondContact O-CB 3.27Å; S267-Y271 PolarHBondContact O-N 3.25Å
268	Y	98.3	Very high	96.8	Very high	63 Å²	63	42.5 Å²	42.5	25%	0.247	24%	0.237	C	C	.	.	H	α-helix	trans	-70.8	-44	177.9	-170.1	-100.8	0	0	0	112.5	S251 A252 I255 T264 L265 Q266 E270 Y271 Q272	S251-Y268 WeakPolarHBondContact O-CE1 3.33Å; A252-Y268 HydrophobicContact CB-CD1 4.41Å; I255-Y268 HydrophobicContact CD1-CD1 3.4Å; I255-Y268 VanDerWaalsContact CD1-CD1 3.4Å; I255-Y268 HydrophobicContact CD1-CD2 3.8Å; I255-Y268 HydrophobicContact CD1-CE1 3.89Å; I255-Y268 HydrophobicContact CD1-CE2 4.25Å; I255-Y268 HydrophobicContact CD1-CG 3.33Å; I255-Y268 HydrophobicContact CG1-CD1 3.77Å; I255-Y268 HydrophobicContact CG1-CE1 3.87Å; I255-Y268 HydrophobicContact CG1-CG 4.21Å; I255-Y268 HydrophobicContact CG2-CE1 3.83Å; I255-Y268 HydrophobicContact CG2-CE2 4.19Å; T264-Y268 WeakPolarHBondContact O-CB 3.14Å; T264-Y268 PolarHBondContact O-N 3.46Å; L265-Y268 PolarHBondContact O-N 3.46Å; Q266-Y268 PolarHBondContact O-N 2.82Å; Y268-E270 VanDerWaalsContact C-N 3.31Å; Y268-E270 PolarHBondContact O-N 3.38Å; Y268-Y271 PolarHBondContact O-N 2.94Å; Y268-Q272 HydrophobicContact CD1-CG 4.02Å; Y268-Q272 HydrophobicContact CE1-CG 3.79Å; Y268-Q272 WeakPolarHBondContact O-CB 3.46Å; Y268-Q272 WeakPolarHBondContact O-CG 3.45Å; Y268-Q272 PolarHBondContact O-N 2.78Å; Y268-Q272 PolarHBondContact OH-NE2 3.15Å
269	I	98.2	Very high	96.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.8	-50	173.3	-68.2	157.3	0	0	0	109.6	A252 L265 Q266 Y271 Q272 M273 V286 V312 A314	A252-I269 HydrophobicContact CB-CD1 4.14Å; A252-I269 HydrophobicContact CB-CG1 3.49Å; A252-I269 VanDerWaalsContact CB-CG1 3.49Å; L265-I269 HydrophobicContact CG-CD1 4.13Å; L265-I269 WeakPolarHBondContact O-CD1 3.08Å; L265-I269 VanDerWaalsContact O-CG1 3.29Å; L265-I269 WeakPolarHBondContact O-CG1 3.18Å; L265-I269 PolarHBondContact O-N 3.4Å; Q266-I269 PolarHBondContact O-N 3.34Å; Q266-I269 VanDerWaalsContact O-N 3.16Å; I269-Y271 VanDerWaalsContact C-N 3.34Å; I269-Y271 PolarHBondContact O-N 3.27Å; I269-Q272 WeakPolarHBondContact O-CB 3.47Å; I269-Q272 PolarHBondContact O-N 3.32Å; I269-Q272 VanDerWaalsContact O-N 3.09Å; I269-M273 HydrophobicContact CG2-CE 3.6Å; I269-M273 HydrophobicContact CG2-CG 4.36Å; I269-M273 HydrophobicContact CG2-SD 4.01Å; I269-M273 VanDerWaalsContact O-CG 3.28Å; I269-M273 WeakPolarHBondContact O-CG 3.29Å; I269-M273 PolarHBondContact O-N 3.28Å; I269-V286 HydrophobicContact CD1-CG2 4.26Å; I269-V312 HydrophobicContact CD1-CG1 3.6Å; I269-V312 HydrophobicContact CD1-CG2 4.24Å; I269-A314 HydrophobicContact CG2-CB 4.05Å
270	E	97.9	Very high	96.6	Very high	37 Å²	37	42.2 Å²	42.2	17%	0.173	23%	0.232	C	C	.	.	H	α-helix	trans	-59.2	-39.8	179	-84.9	-154.9	-140.3	0	0	113.9	Q266 Y268 R274 V280 P284	Q266-E270 HydrophobicContact CG-CG 4.36Å; Q266-E270 PolarHBondContact NE2-OE1 3.36Å; Q266-E270 VanDerWaalsContact O-CB 3.3Å; Q266-E270 WeakPolarHBondContact O-CB 3.46Å; Q266-E270 WeakPolarHBondContact O-CG 3.41Å; Q266-E270 PolarHBondContact O-N 3.35Å; Y268-E270 VanDerWaalsContact C-N 3.31Å; Y268-E270 PolarHBondContact O-N 3.38Å; E270-R274 VanDerWaalsContact CB-NH1 3.27Å; E270-R274 WeakPolarHBondContact O-CG 3.49Å; E270-R274 PolarHBondContact O-N 2.84Å; E270-R274 PolarHBondContact O-NH1 2.92Å; E270-R274 VanDerWaalsContact O-NH1 3.12Å; E270-R274 IonicContact OE2-CZ 2.79Å; E270-R274 IonicContact OE2-NH1 3.39Å; E270-R274 PolarHBondContact OE2-NH1 3.31Å; E270-R274 IonicContact OE2-NH2 2.72Å; E270-R274 PolarHBondContact OE2-NH2 3.15Å; E270-V280 HydrophobicContact CB-CG2 4.34Å; E270-V280 HydrophobicContact CG-CG2 3.72Å; E270-P284 HydrophobicContact CG-CG 4.18Å
271	Y	97.8	Very high	96.4	Very high	127 Å²	127	41.6 Å²	41.6	50%	0.498	23%	0.23	S	C	.	.	H	α-helix	trans	-62.9	-47.5	171.7	164.1	-102.4	0	0	0	111.2	S267 Y268 I269 M273 R274 S275	S267-Y271 WeakPolarHBondContact O-CB 3.27Å; S267-Y271 PolarHBondContact O-N 3.25Å; Y268-Y271 PolarHBondContact O-N 2.94Å; I269-Y271 VanDerWaalsContact C-N 3.34Å; I269-Y271 PolarHBondContact O-N 3.27Å; Y271-M273 VanDerWaalsContact C-N 3.33Å; Y271-M273 PolarHBondContact O-N 2.9Å; Y271-R274 PolarHBondContact O-N 2.76Å; Y271-S275 WeakPolarHBondContact O-CB 3Å; Y271-S275 PolarHBondContact O-N 3.46Å; Y271-S275 PolarHBondContact O-OG 3.35Å
272	Q	97.8	Very high	96.2	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-36.7	-178.6	-71.4	-68.2	-8.7	0	0	112.2	S248 Y268 I269 S275 R276	S248-Q272 VanDerWaalsContact OG-C 3.28Å; S248-Q272 PolarHBondContact OG-O 2.9Å; Y268-Q272 HydrophobicContact CD1-CG 4.02Å; Y268-Q272 HydrophobicContact CE1-CG 3.79Å; Y268-Q272 WeakPolarHBondContact O-CB 3.46Å; Y268-Q272 WeakPolarHBondContact O-CG 3.45Å; Y268-Q272 PolarHBondContact O-N 2.78Å; Y268-Q272 PolarHBondContact OH-NE2 3.15Å; I269-Q272 WeakPolarHBondContact O-CB 3.47Å; I269-Q272 PolarHBondContact O-N 3.32Å; I269-Q272 VanDerWaalsContact O-N 3.09Å; Q272-S275 WeakPolarHBondContact CA-OG 3.48Å; Q272-S275 PolarHBondContact O-OG 2.85Å; Q272-R276 VanDerWaalsContact C-NH1 3.33Å; Q272-R276 VanDerWaalsContact CB-NH1 3.3Å; Q272-R276 VanDerWaalsContact O-CG 3.29Å; Q272-R276 WeakPolarHBondContact O-CG 3.44Å; Q272-R276 PolarHBondContact O-N 3.18Å; Q272-R276 PolarHBondContact O-NH1 3.32Å
273	M	95.8	Very high	96	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65	-49.5	175.1	-65.9	177	162.2	0	0	111	S248 I269 Y271 R276 C278 V280 A314 G315 C316	S248-M273 PolarHBondContact OG-N 3.05Å; I269-M273 HydrophobicContact CG2-CE 3.6Å; I269-M273 HydrophobicContact CG2-CG 4.36Å; I269-M273 HydrophobicContact CG2-SD 4.01Å; I269-M273 VanDerWaalsContact O-CG 3.28Å; I269-M273 WeakPolarHBondContact O-CG 3.29Å; I269-M273 PolarHBondContact O-N 3.28Å; Y271-M273 VanDerWaalsContact C-N 3.33Å; Y271-M273 PolarHBondContact O-N 2.9Å; M273-R276 CarbonylContact O-C 3.54Å; M273-R276 WeakPolarHBondContact O-CA 3.44Å; M273-R276 PolarHBondContact O-N 3.2Å; M273-R276 VanDerWaalsContact O-N 3.08Å; M273-C278 CarbonylContact C-O 3.58Å; M273-C278 PolarHBondContact O-N 3.42Å; M273-C278 VanDerWaalsContact O-N 3.13Å; M273-V280 HydrophobicContact SD-CG2 4.31Å; M273-A314 HydrophobicContact CE-CB 3.76Å; M273-G315 WeakPolarHBondContact CE-O 3.4Å; M273-C316 WeakPolarHBondContact CG-SG 3.33Å
274	R	95.1	Very high	96	Very high	133 Å²	133	42.6 Å²	42.6	50%	0.502	23%	0.232	S	C	.	.	H	α-helix	trans	-66	-38.8	-179.5	-69.7	-177.7	-176	88.2	-10.5	112.6	E270 Y271 R276 G277 C278	E270-R274 VanDerWaalsContact CB-NH1 3.27Å; E270-R274 WeakPolarHBondContact O-CG 3.49Å; E270-R274 PolarHBondContact O-N 2.84Å; E270-R274 PolarHBondContact O-NH1 2.92Å; E270-R274 VanDerWaalsContact O-NH1 3.12Å; E270-R274 IonicContact OE2-CZ 2.79Å; E270-R274 IonicContact OE2-NH1 3.39Å; E270-R274 PolarHBondContact OE2-NH1 3.31Å; E270-R274 IonicContact OE2-NH2 2.72Å; E270-R274 PolarHBondContact OE2-NH2 3.15Å; Y271-R274 PolarHBondContact O-N 2.76Å; R274-R276 PolarHBondContact O-N 3.19Å; R274-G277 PolarHBondContact O-N 2.87Å; R274-C278 WeakPolarHBondContact CA-O 3.24Å; R274-C278 PolarHBondContact N-O 3.48Å
275	S	95.5	Very high	96	Very high	56 Å²	56	39.4 Å²	39.4	39%	0.392	21%	0.213	S	C	.	.	H	α-helix	trans	-65.5	-17.2	175	72.1	0	0	0	0	112.9	Y271 Q272	Y271-S275 WeakPolarHBondContact O-CB 3Å; Y271-S275 PolarHBondContact O-N 3.46Å; Y271-S275 PolarHBondContact O-OG 3.35Å; Q272-S275 WeakPolarHBondContact CA-OG 3.48Å; Q272-S275 PolarHBondContact O-OG 2.85Å
276	R	92.8	Very high	96	Very high	19 Å²	19	39.4 Å²	39.4	7%	0.072	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	21.3	172.9	-65.5	177	178.7	70.5	-2.7	112.7	L26 L29 A244 E247 S251 Q272 M273 R274 C278	L26-R276 HydrophobicContact CD1-CB 4.15Å; L26-R276 HydrophobicContact CD1-CG 4.03Å; L29-R276 WeakPolarHBondContact CD1-O 3.33Å; L29-R276 WeakPolarHBondContact CD2-O 3.27Å; A244-R276 HydrophobicContact CB-CB 4.12Å; E247-R276 VanDerWaalsContact CB-NE 3.29Å; E247-R276 PolarHBondContact O-NH2 3.44Å; S251-R276 PolarHBondContact OG-NH2 3.29Å; S251-R276 VanDerWaalsContact OG-NH2 3.13Å; Q272-R276 VanDerWaalsContact C-NH1 3.33Å; Q272-R276 VanDerWaalsContact CB-NH1 3.3Å; Q272-R276 VanDerWaalsContact O-CG 3.29Å; Q272-R276 WeakPolarHBondContact O-CG 3.44Å; Q272-R276 PolarHBondContact O-N 3.18Å; Q272-R276 PolarHBondContact O-NH1 3.32Å; M273-R276 CarbonylContact O-C 3.54Å; M273-R276 WeakPolarHBondContact O-CA 3.44Å; M273-R276 PolarHBondContact O-N 3.2Å; M273-R276 VanDerWaalsContact O-N 3.08Å; R274-R276 PolarHBondContact O-N 3.19Å; R276-C278 PolarHBondContact O-N 3.35Å
277	G	90.9	Very high	96	Very high	49 Å²	49	37.5 Å²	37.5	51%	0.505	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	16.2	175.8	0	0	0	0	0	114.8	R274	R274-G277 PolarHBondContact O-N 2.87Å
278	C	93.3	Very high	95.9	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.034	18%	0.182	C	C	.	.			trans	-107.9	144.4	176.2	-66.3	0	0	0	0	110.6	A244 M273 R274 R276 C316	A244-C278 HydrophobicContact CB-CB 4.28Å; A244-C278 WeakPolarHBondContact CB-SG 3.41Å; M273-C278 CarbonylContact C-O 3.58Å; M273-C278 PolarHBondContact O-N 3.42Å; M273-C278 VanDerWaalsContact O-N 3.13Å; R274-C278 WeakPolarHBondContact CA-O 3.24Å; R274-C278 PolarHBondContact N-O 3.48Å; R276-C278 PolarHBondContact O-N 3.35Å; C278-C316 HydrophobicContact CB-CB 3.8Å
279	S	93.2	Very high	95.8	Very high	52 Å²	52	32 Å²	32	36%	0.364	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	164.8	163.8	66.3	0	0	0	0	109.9	C316 R317	S279-C316 CarbonylContact O-C 3.49Å; S279-C316 WeakPolarHBondContact O-CA 3.44Å; S279-R317 PolarHBondContact N-O 2.9Å; S279-R317 PolarHBondContact O-N 3.09Å; S279-R317 VanDerWaalsContact OG-CB 3.32Å; S279-R317 WeakPolarHBondContact OG-CB 3.43Å; S279-R317 WeakPolarHBondContact OG-CG 3.21Å; S279-R317 PolarHBondContact OG-NE 2.85Å; S279-R317 PolarHBondContact OG-O 2.77Å; S279-R317 VanDerWaalsContact OG-O 3.07Å
280	V	95.5	Very high	95.6	Very high	18 Å²	18	38.8 Å²	38.8	11%	0.109	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	130.3	168.5	-177.4	0	0	0	0	107.8	E270 M273 Y282 P284 R317	E270-V280 HydrophobicContact CB-CG2 4.34Å; E270-V280 HydrophobicContact CG-CG2 3.72Å; M273-V280 HydrophobicContact SD-CG2 4.31Å; V280-Y282 WeakPolarHBondContact CG1-O 3.31Å; V280-P284 HydrophobicContact CG1-CG 4.17Å; V280-R317 PolarHBondContact O-NH2 3.01Å
281	G	94.6	Very high	95.6	Very high	8 Å²	8	39.2 Å²	39.2	8%	0.082	21%	0.213	C	C	.	.	S	Bend	trans	-73	-43.5	-178.5	0	0	0	0	0	113	G315 R317	G281-G315 PolarHBondContact N-O 3.31Å; G281-R317 VanDerWaalsContact O-CZ 3.28Å; G281-R317 PolarHBondContact O-NH1 2.91Å; G281-R317 PolarHBondContact O-NH2 3.37Å
282	Y	94.8	Very high	95.4	Very high	51 Å²	51	34.9 Å²	34.9	20%	0.2	20%	0.2	C	C	.	.	S	Bend	trans	-151.7	154.9	175.6	48.5	-90.4	0	0	0	108.4	V280 P284 D313 A314 G315 T322 D324 I325	V280-Y282 WeakPolarHBondContact CG1-O 3.31Å; Y282-P284 WeakPolarHBondContact O-CD 3.35Å; Y282-P284 VanDerWaalsContact O-N 3.11Å; Y282-D313 PolarHBondContact OH-OD1 3.5Å; Y282-A314 VanDerWaalsContact OH-C 3.28Å; Y282-G315 PolarHBondContact OH-N 2.92Å; Y282-T322 HydrophobicContact CD1-CG2 4Å; Y282-T322 HydrophobicContact CE1-CG2 4.11Å; Y282-D324 HydrophobicContact CE1-CB 4.12Å; Y282-D324 VanDerWaalsContact OH-CA 3.27Å; Y282-D324 WeakPolarHBondContact OH-CA 3.44Å; Y282-D324 VanDerWaalsContact OH-CG 3.25Å; Y282-D324 PolarHBondContact OH-OD1 3.14Å; Y282-I325 PolarHBondContact OH-N 3.29Å
283	P	94.2	Very high	95.2	Very high	81 Å²	81	40.1 Å²	40.1	53%	0.526	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-50.6	119.2	176.6	-29	38.4	0	0	0	111	V285 M298	P283-V285 PolarHBondContact O-N 2.97Å; P283-M298 HydrophobicContact CB-CE 3.19Å; P283-M298 HydrophobicContact CB-SD 4.17Å; P283-M298 HydrophobicContact CG-CE 4.29Å
284	P	97.1	Very high	95.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-62.5	140.5	-176.2	-24.5	35	0	0	0	111.2	Q266 E270 V280 Y282 V286 N300 D313 A314	Q266-P284 HydrophobicContact CG-CB 4.32Å; Q266-P284 HydrophobicContact CG-CG 4.24Å; E270-P284 HydrophobicContact CG-CG 4.18Å; V280-P284 HydrophobicContact CG1-CG 4.17Å; Y282-P284 WeakPolarHBondContact O-CD 3.35Å; Y282-P284 VanDerWaalsContact O-N 3.11Å; P284-V286 HydrophobicContact CB-CG2 4.29Å; P284-N300 PolarHBondContact O-ND2 3.28Å; P284-D313 CarbonylContact C-O 3.44Å; P284-D313 VanDerWaalsContact CA-O 3.27Å; P284-D313 WeakPolarHBondContact CA-O 3.33Å; P284-A314 HydrophobicContact CB-CB 3.98Å; P284-A314 HydrophobicContact CG-CB 4.35Å
285	V	98.1	Very high	94.8	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.048	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.9	164.6	174.1	0	0	0	0	107.2	P283 Y297 M298 L311 V312 D313	P283-V285 PolarHBondContact O-N 2.97Å; V285-Y297 WeakPolarHBondContact CG1-O 3.31Å; V285-M298 HydrophobicContact CG2-SD 4.34Å; V285-L311 HydrophobicContact CG1-CD2 4.28Å; V285-V312 CarbonylContact O-C 3.53Å; V285-V312 VanDerWaalsContact O-CA 3.25Å; V285-V312 WeakPolarHBondContact O-CA 3.49Å; V285-D313 HydrophobicContact CB-CB 4.01Å; V285-D313 HydrophobicContact CG2-CB 4.45Å; V285-D313 PolarHBondContact N-O 3.39Å; V285-D313 PolarHBondContact O-N 3.1Å
286	V	98.2	Very high	94.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	101.7	176	-178.1	0	0	0	0	108.5	E262 L265 Q266 I269 P284 Y297 N300 V310 V312	E262-V286 HydrophobicContact CB-CB 4.3Å; E262-V286 HydrophobicContact CB-CG1 3.95Å; E262-V286 WeakPolarHBondContact CB-O 3.24Å; E262-V286 HydrophobicContact CG-CG1 4.19Å; E262-V286 WeakPolarHBondContact CG-O 3.34Å; L265-V286 HydrophobicContact CB-CG1 4.07Å; L265-V286 HydrophobicContact CD2-CG1 3.83Å; L265-V286 HydrophobicContact CG-CG1 4.2Å; Q266-V286 HydrophobicContact CB-CG2 3.89Å; I269-V286 HydrophobicContact CD1-CG2 4.26Å; P284-V286 HydrophobicContact CB-CG2 4.29Å; V286-Y297 VanDerWaalsContact O-CE1 3.28Å; V286-Y297 WeakPolarHBondContact O-CE1 3.44Å; V286-N300 PolarHBondContact N-OD1 3.49Å; V286-N300 PolarHBondContact O-OD1 3.22Å; V286-N300 VanDerWaalsContact O-OD1 3.06Å; V286-V310 HydrophobicContact CG1-CG2 4.29Å; V286-V312 HydrophobicContact CG1-CG2 4.12Å; V286-V312 HydrophobicContact CG2-CG1 4.37Å; V286-V312 HydrophobicContact CG2-CG2 4.19Å
287	A	98.2	Very high	94.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.7	-172	0	0	0	0	0	111.7	R291 T292 Y297 V310 L311	A287-R291 HydrophobicContact CB-CB 4.1Å; A287-T292 HydrophobicContact CB-CG2 4.2Å; A287-T292 VanDerWaalsContact O-CG2 3.29Å; A287-T292 WeakPolarHBondContact O-CG2 3.28Å; A287-Y297 HydrophobicContact CB-CD1 3.7Å; A287-Y297 HydrophobicContact CB-CE1 4.22Å; A287-Y297 HydrophobicContact CB-CG 4.23Å; A287-V310 CarbonylContact O-C 3.54Å; A287-V310 VanDerWaalsContact O-CA 3.3Å; A287-V310 WeakPolarHBondContact O-CA 3.38Å; A287-L311 PolarHBondContact N-O 3.08Å; A287-L311 PolarHBondContact O-N 3.3Å
288	G	97.5	Very high	94.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	148.8	170.8	0	0	0	0	0	113.4	E262 R291 L309	E262-G288 PolarHBondContact OE1-N 2.85Å; G288-R291 WeakPolarHBondContact O-CB 3.28Å; G288-R291 PolarHBondContact O-N 2.93Å; G288-R291 PolarHBondContact O-NE 3.33Å; G288-R291 PolarHBondContact O-NH1 2.96Å; G288-R291 PolarHBondContact O-NH2 3.09Å; G288-L309 WeakPolarHBondContact CA-O 3.34Å
289	G	95.4	Very high	94.9	Very high	14 Å²	14	59.2 Å²	59.2	14%	0.144	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	57.9	-138.4	173.2	0	0	0	0	0	112.7	R291 T292 L309	G289-R291 PolarHBondContact O-N 3.39Å; G289-T292 VanDerWaalsContact O-CG2 3.25Å; G289-T292 WeakPolarHBondContact O-CG2 3.44Å; G289-T292 PolarHBondContact O-N 3.34Å; G289-T292 VanDerWaalsContact O-N 3.1Å; G289-T292 PolarHBondContact O-OG1 2.78Å; G289-L309 PolarHBondContact N-O 3.25Å
290	D	94.7	Very high	95.1	Very high	142 Å²	142	56.8 Å²	56.8	76%	0.759	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-60.1	-20.2	-177.1	-69.4	-19.3	0	0	0	114.4	T292 N293	D290-T292 PolarHBondContact O-N 3.01Å; D290-N293 WeakPolarHBondContact O-CB 3.49Å; D290-N293 PolarHBondContact O-N 3.24Å; D290-N293 PolarHBondContact O-ND2 3.22Å
291	R	97	Very high	95.1	Very high	46 Å²	46	60.6 Å²	60.6	17%	0.174	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-67.6	-18	179.7	-58.5	178.2	-62.7	-75.6	3.8	112.1	E262 A287 G288 G289 N293 I294 Y297 R303	E262-R291 IonicContact OE1-CZ 2.78Å; E262-R291 IonicContact OE1-NE 3.18Å; E262-R291 PolarHBondContact OE1-NE 3.32Å; E262-R291 IonicContact OE1-NH2 3.93Å; E262-R291 PolarHBondContact OE1-NH2 3.36Å; E262-R291 IonicContact OE2-NE 2.67Å; A287-R291 HydrophobicContact CB-CB 4.1Å; G288-R291 WeakPolarHBondContact O-CB 3.28Å; G288-R291 PolarHBondContact O-N 2.93Å; G288-R291 PolarHBondContact O-NE 3.33Å; G288-R291 PolarHBondContact O-NH1 2.96Å; G288-R291 PolarHBondContact O-NH2 3.09Å; G289-R291 PolarHBondContact O-N 3.39Å; R291-N293 PolarHBondContact O-N 3.43Å; R291-N293 VanDerWaalsContact O-N 3.09Å; R291-I294 WeakPolarHBondContact O-CB 3.17Å; R291-I294 PolarHBondContact O-N 2.9Å; R291-Y297 HydrophobicContact CB-CD2 4.42Å; R291-Y297 HydrophobicContact CB-CE2 4.28Å; R291-Y297 HydrophobicContact CG-CE2 4.4Å; R291-R303 PolarHBondContact NH2-O 3.1Å
292	T	93.7	Very high	95.3	Very high	35 Å²	35	64.6 Å²	64.6	22%	0.215	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-60.9	-16.7	174.2	64.1	0	0	0	0	112.8	A287 G289 D290 I294 L311	A287-T292 HydrophobicContact CB-CG2 4.2Å; A287-T292 VanDerWaalsContact O-CG2 3.29Å; A287-T292 WeakPolarHBondContact O-CG2 3.28Å; G289-T292 VanDerWaalsContact O-CG2 3.25Å; G289-T292 WeakPolarHBondContact O-CG2 3.44Å; G289-T292 PolarHBondContact O-N 3.34Å; G289-T292 VanDerWaalsContact O-N 3.1Å; G289-T292 PolarHBondContact O-OG1 2.78Å; D290-T292 PolarHBondContact O-N 3.01Å; T292-I294 VanDerWaalsContact C-N 3.31Å; T292-L311 HydrophobicContact CG2-CB 3.58Å
293	N	93.5	Very high	95.5	Very high	126 Å²	126	68.9 Å²	68.9	67%	0.674	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-85.1	-0.9	177.1	-57.7	-58	0	0	0	113.5	D290 R291	D290-N293 WeakPolarHBondContact O-CB 3.49Å; D290-N293 PolarHBondContact O-N 3.24Å; D290-N293 PolarHBondContact O-ND2 3.22Å; R291-N293 PolarHBondContact O-N 3.43Å; R291-N293 VanDerWaalsContact O-N 3.09Å
294	I	94.5	Very high	95.6	Very high	88 Å²	88	65 Å²	65	45%	0.451	32%	0.318	S	S	.	.			trans	-96.9	105.7	176.7	-57.7	168.6	0	0	0	108.3	R291 T292 H296 Y297	R291-I294 WeakPolarHBondContact O-CB 3.17Å; R291-I294 PolarHBondContact O-N 2.9Å; T292-I294 VanDerWaalsContact C-N 3.31Å; I294-H296 PolarHBondContact O-N 3.2Å; I294-Y297 HydrophobicContact CB-CD2 4.44Å; I294-Y297 HydrophobicContact CD1-CD2 4Å; I294-Y297 HydrophobicContact CG2-CD2 4.41Å; I294-Y297 WeakPolarHBondContact O-CB 3.35Å; I294-Y297 PolarHBondContact O-N 3.27Å
295	I	89.2	Confident	95.6	Very high	149 Å²	149	68.2 Å²	68.2	76%	0.764	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-47.1	-171	-58.8	175	0	0	0	112.6
296	H	89.2	Confident	95.5	Very high	162 Å²	162	73.1 Å²	73.1	75%	0.75	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	50.1	176.7	-67.1	172.9	0	0	0	111.7	I294 M298	I294-H296 PolarHBondContact O-N 3.2Å; H296-M298 PolarHBondContact O-N 2.79Å; H296-M298 VanDerWaalsContact O-N 3.13Å
297	Y	95.3	Very high	95.3	Very high	13 Å²	13	75.9 Å²	75.9	5%	0.051	39%	0.39	C	S	.	.			trans	-68.5	110	177.7	-179.3	-104.4	0	0	0	111.5	E262 V285 V286 A287 R291 I294 K299 N300	E262-Y297 VanDerWaalsContact OE2-CE1 3.26Å; E262-Y297 WeakPolarHBondContact OE2-CE1 3.49Å; E262-Y297 PolarHBondContact OE2-OH 3.45Å; V285-Y297 WeakPolarHBondContact CG1-O 3.31Å; V286-Y297 VanDerWaalsContact O-CE1 3.28Å; V286-Y297 WeakPolarHBondContact O-CE1 3.44Å; A287-Y297 HydrophobicContact CB-CD1 3.7Å; A287-Y297 HydrophobicContact CB-CE1 4.22Å; A287-Y297 HydrophobicContact CB-CG 4.23Å; R291-Y297 HydrophobicContact CB-CD2 4.42Å; R291-Y297 HydrophobicContact CB-CE2 4.28Å; R291-Y297 HydrophobicContact CG-CE2 4.4Å; I294-Y297 HydrophobicContact CB-CD2 4.44Å; I294-Y297 HydrophobicContact CD1-CD2 4Å; I294-Y297 HydrophobicContact CG2-CD2 4.41Å; I294-Y297 WeakPolarHBondContact O-CB 3.35Å; I294-Y297 PolarHBondContact O-N 3.27Å; Y297-K299 HydrophobicContact CE2-CB 3.95Å; Y297-N300 WeakPolarHBondContact CD1-OD1 3.41Å; Y297-N300 WeakPolarHBondContact CE1-OD1 3.38Å
298	M	92.6	Very high	95.2	Very high	91 Å²	91	78.2 Å²	78.2	45%	0.448	40%	0.401	S	S	.	.			trans	-111.8	-9.3	-174.6	-72.8	-50.5	-42.7	0	0	115.2	P283 V285 H296 N300	P283-M298 HydrophobicContact CB-CE 3.19Å; P283-M298 HydrophobicContact CB-SD 4.17Å; P283-M298 HydrophobicContact CG-CE 4.29Å; V285-M298 HydrophobicContact CG2-SD 4.34Å; H296-M298 PolarHBondContact O-N 2.79Å; H296-M298 VanDerWaalsContact O-N 3.13Å; M298-N300 PolarHBondContact O-N 2.9Å
299	K	96.1	Very high	95.1	Very high	160 Å²	160	82.5 Å²	82.5	70%	0.696	42%	0.423	S	S	*	.			trans	-68.5	-38.4	-173.2	-69.5	-174.8	179.1	178.9	0	112.1	Y297 N301	Y297-K299 HydrophobicContact CE2-CB 3.95Å; K299-N301 WeakPolarHBondContact O-CB 3.45Å; K299-N301 PolarHBondContact O-N 3.32Å
300	N	96.9	Very high	95.2	Very high	1 Å²	1	81.8 Å²	81.8	1%	0.005	42%	0.416	C	S	.	.			trans	40.6	42.5	176.7	-60.9	-16.9	0	0	0	113.7	E262 T263 Q266 P284 V286 Y297 M298	E262-N300 CarbonylContact C-O 3.5Å; E262-N300 VanDerWaalsContact CB-C 3.46Å; E262-N300 HydrophobicContact CB-CB 4.14Å; E262-N300 WeakPolarHBondContact OE2-CA 3.41Å; T263-N300 VanDerWaalsContact CA-O 3.27Å; T263-N300 WeakPolarHBondContact CA-O 3.37Å; T263-N300 WeakPolarHBondContact CB-O 3.28Å; T263-N300 PolarHBondContact N-O 3.22Å; T263-N300 PolarHBondContact OG1-O 3Å; Q266-N300 VanDerWaalsContact OE1-CB 3.26Å; Q266-N300 PolarHBondContact OE1-ND2 3.37Å; P284-N300 PolarHBondContact O-ND2 3.28Å; V286-N300 PolarHBondContact N-OD1 3.49Å; V286-N300 PolarHBondContact O-OD1 3.22Å; V286-N300 VanDerWaalsContact O-OD1 3.06Å; Y297-N300 WeakPolarHBondContact CD1-OD1 3.41Å; Y297-N300 WeakPolarHBondContact CE1-OD1 3.38Å; M298-N300 PolarHBondContact O-N 2.9Å
301	N	96.9	Very high	95.3	Very high	97 Å²	97	76.7 Å²	76.7	52%	0.519	39%	0.389	S	S	.	.			trans	-126.9	8.9	-170.1	66.8	-8.6	0	0	0	113.7	E262 K299	E262-N301 PolarHBondContact OE2-N 3.15Å; E262-N301 VanDerWaalsContact OE2-N 3.14Å; K299-N301 WeakPolarHBondContact O-CB 3.45Å; K299-N301 PolarHBondContact O-N 3.32Å
302	M	98.2	Very high	95.4	Very high	92 Å²	92	74.5 Å²	74.5	45%	0.453	38%	0.38	S	S	.	.	S	Bend	trans	-101.3	157.2	-179.8	-62.1	-60	-67.7	0	0	111.7	T261 E262	T261-M302 WeakPolarHBondContact CA-O 3.48Å; E262-M302 WeakPolarHBondContact CG-O 3.33Å; E262-M302 PolarHBondContact N-O 3.17Å; E262-M302 WeakPolarHBondContact OE2-CB 3.4Å; E262-M302 PolarHBondContact OE2-N 2.95Å
303	R	98.1	Very high	95.6	Very high	142 Å²	142	74.4 Å²	74.4	54%	0.536	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-75.8	148.4	168	-177.1	171.1	133.2	155.2	1.3	109.8	R291 D305	R291-R303 PolarHBondContact NH2-O 3.1Å; R303-D305 IonicContact CZ-OD1 3.18Å; R303-D305 IonicContact NE-OD1 2.72Å; R303-D305 PolarHBondContact NE-OD1 2.94Å; R303-D305 IonicContact NH2-OD1 3.45Å; R303-D305 PolarHBondContact NH2-OD1 2.79Å
304	I	98	Very high	95.8	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.346	C	S	.	.			trans	-108.6	113.1	174.1	-46.5	-177.4	0	0	0	107.9	G259 I260 E262 E308 V310 V331	G259-I304 WeakPolarHBondContact CA-O 3.19Å; G259-I304 PolarHBondContact N-O 3.15Å; I260-I304 HydrophobicContact CG2-CB 4.36Å; I260-I304 HydrophobicContact CG2-CD1 4.39Å; I260-I304 PolarHBondContact O-N 2.89Å; E262-I304 HydrophobicContact CG-CD1 3.92Å; E262-I304 HydrophobicContact CG-CG1 3.89Å; I304-E308 WeakPolarHBondContact CA-OE2 3.37Å; I304-E308 HydrophobicContact CG2-CB 3.98Å; I304-V310 HydrophobicContact CD1-CB 3.8Å; I304-V310 HydrophobicContact CD1-CG2 3.48Å; I304-V310 VanDerWaalsContact CD1-CG2 3.48Å; I304-V310 HydrophobicContact CG2-CB 4.46Å; I304-V331 HydrophobicContact CB-CG2 3.99Å; I304-V331 HydrophobicContact CG2-CB 3.79Å; I304-V331 HydrophobicContact CG2-CG1 4.18Å; I304-V331 HydrophobicContact CG2-CG2 3.65Å
305	D	97	Very high	95.9	Very high	66 Å²	66	64.2 Å²	64.2	35%	0.353	33%	0.325	S	S	.	.			trans	-89.9	158.7	-169.9	-80.6	-44.9	0	0	0	113.6	R303 G307 E308 V331	R303-D305 IonicContact CZ-OD1 3.18Å; R303-D305 IonicContact NE-OD1 2.72Å; R303-D305 PolarHBondContact NE-OD1 2.94Å; R303-D305 IonicContact NH2-OD1 3.45Å; R303-D305 PolarHBondContact NH2-OD1 2.79Å; D305-G307 PolarHBondContact O-N 3.11Å; D305-E308 HydrophobicContact CB-CG 4.37Å; D305-E308 PolarHBondContact N-OE2 3.46Å; D305-E308 VanDerWaalsContact O-CB 3.28Å; D305-E308 WeakPolarHBondContact O-CB 3.36Å; D305-E308 WeakPolarHBondContact O-CG 3.34Å; D305-E308 PolarHBondContact O-N 3.31Å; D305-V331 WeakPolarHBondContact O-CG1 3.47Å
306	N	95.8	Very high	96.2	Very high	112 Å²	112	57.1 Å²	57.1	60%	0.599	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	131.2	-179.6	-174.2	33.4	0	0	0	111.1	P258 N332	P258-N306 HydrophobicContact CB-CB 3.72Å; P258-N306 HydrophobicContact CG-CB 4Å; N306-N332 WeakPolarHBondContact OD1-CB 3.43Å; N306-N332 PolarHBondContact OD1-ND2 3.31Å
307	G	93	Very high	96.5	Very high	58 Å²	58	51.9 Å²	51.9	60%	0.598	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.7	-12.4	-175.9	0	0	0	0	0	114	D305	D305-G307 PolarHBondContact O-N 3.11Å
308	E	95.7	Very high	96.4	Very high	48 Å²	48	51.9 Å²	51.9	22%	0.224	26%	0.262	C	S	.	.			trans	-79.5	152.6	174.9	-62.5	-172.1	140.5	0	0	112.4	I304 D305 V331	I304-E308 WeakPolarHBondContact CA-OE2 3.37Å; I304-E308 HydrophobicContact CG2-CB 3.98Å; D305-E308 HydrophobicContact CB-CG 4.37Å; D305-E308 PolarHBondContact N-OE2 3.46Å; D305-E308 VanDerWaalsContact O-CB 3.28Å; D305-E308 WeakPolarHBondContact O-CB 3.36Å; D305-E308 WeakPolarHBondContact O-CG 3.34Å; D305-E308 PolarHBondContact O-N 3.31Å; E308-V331 WeakPolarHBondContact O-CG1 3.42Å; E308-V331 PolarHBondContact O-N 2.86Å
309	L	95.9	Very high	96.3	Very high	90 Å²	90	50.1 Å²	50.1	47%	0.471	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	151.8	161	-59.5	-178.6	0	0	0	109.5	G288 G289 T328 W329 P330	G288-L309 WeakPolarHBondContact CA-O 3.34Å; G289-L309 PolarHBondContact N-O 3.25Å; L309-T328 HydrophobicContact CB-CG2 3.93Å; L309-T328 HydrophobicContact CD1-CG2 4.06Å; L309-T328 HydrophobicContact CG-CG2 4.49Å; L309-W329 WeakPolarHBondContact CA-O 3.31Å; L309-P330 HydrophobicContact CD2-CB 3.94Å
310	V	97.5	Very high	96.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	131	163.6	58.1	0	0	0	0	109.2	T256 L265 V286 A287 I304 V312 T328 W329	T256-V310 HydrophobicContact CG2-CG1 4.36Å; L265-V310 HydrophobicContact CD2-CG2 3.81Å; V286-V310 HydrophobicContact CG1-CG2 4.29Å; A287-V310 CarbonylContact O-C 3.54Å; A287-V310 VanDerWaalsContact O-CA 3.3Å; A287-V310 WeakPolarHBondContact O-CA 3.38Å; I304-V310 HydrophobicContact CD1-CB 3.8Å; I304-V310 HydrophobicContact CD1-CG2 3.48Å; I304-V310 VanDerWaalsContact CD1-CG2 3.48Å; I304-V310 HydrophobicContact CG2-CB 4.46Å; V310-V312 HydrophobicContact CG2-CG2 4Å; V310-T328 CarbonylContact O-C 3.58Å; V310-T328 WeakPolarHBondContact O-CA 3.48Å; V310-T328 WeakPolarHBondContact O-CG2 3.21Å; V310-W329 HydrophobicContact CG1-CD2 3.67Å; V310-W329 HydrophobicContact CG1-CE3 4.37Å; V310-W329 HydrophobicContact CG1-CG 3.9Å; V310-W329 HydrophobicContact CG1-CZ2 3.86Å; V310-W329 VanDerWaalsContact CG1-NE1 3.35Å; V310-W329 WeakPolarHBondContact CG1-O 3.47Å; V310-W329 PolarHBondContact N-O 3.1Å; V310-W329 PolarHBondContact O-N 3.46Å
311	L	98	Very high	96	Very high	35 Å²	35	45.7 Å²	45.7	18%	0.183	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.8	167.4	-177.2	151.2	0	0	0	108.3	V285 A287 T292 T326	V285-L311 HydrophobicContact CG1-CD2 4.28Å; A287-L311 PolarHBondContact N-O 3.08Å; A287-L311 PolarHBondContact O-N 3.3Å; T292-L311 HydrophobicContact CG2-CB 3.58Å; L311-T326 HydrophobicContact CD1-CG2 4.21Å; L311-T326 HydrophobicContact CD2-CG2 4.11Å; L311-T326 HydrophobicContact CG-CG2 4.02Å
312	V	98.2	Very high	95.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123	171	176.1	0	0	0	0	109.4	L249 L265 I269 V285 V286 V310 A314 T326 R327 W329	L249-V312 HydrophobicContact CD2-CB 4.28Å; L249-V312 HydrophobicContact CD2-CG1 3.61Å; L265-V312 HydrophobicContact CD2-CG2 4.09Å; I269-V312 HydrophobicContact CD1-CG1 3.6Å; I269-V312 HydrophobicContact CD1-CG2 4.24Å; V285-V312 CarbonylContact O-C 3.53Å; V285-V312 VanDerWaalsContact O-CA 3.25Å; V285-V312 WeakPolarHBondContact O-CA 3.49Å; V286-V312 HydrophobicContact CG1-CG2 4.12Å; V286-V312 HydrophobicContact CG2-CG1 4.37Å; V286-V312 HydrophobicContact CG2-CG2 4.19Å; V310-V312 HydrophobicContact CG2-CG2 4Å; V312-A314 HydrophobicContact CG1-CB 3.86Å; V312-T326 CarbonylContact O-C 3.6Å; V312-T326 VanDerWaalsContact O-CA 3.27Å; V312-T326 WeakPolarHBondContact O-CA 3.36Å; V312-R327 PolarHBondContact N-O 3.33Å; V312-R327 PolarHBondContact O-N 3.45Å; V312-W329 HydrophobicContact CB-CH2 3.71Å; V312-W329 HydrophobicContact CB-CZ3 3.79Å; V312-W329 HydrophobicContact CG2-CH2 3.29Å; V312-W329 HydrophobicContact CG2-CZ2 4.08Å; V312-W329 HydrophobicContact CG2-CZ3 3.78Å
313	D	98	Very high	95.9	Very high	32 Å²	32	39.4 Å²	39.4	17%	0.171	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114.2	163.5	-179.8	11.2	0	0	0	108.3	Y282 P284 V285 T326	Y282-D313 PolarHBondContact OH-OD1 3.5Å; P284-D313 CarbonylContact C-O 3.44Å; P284-D313 VanDerWaalsContact CA-O 3.27Å; P284-D313 WeakPolarHBondContact CA-O 3.33Å; V285-D313 HydrophobicContact CB-CB 4.01Å; V285-D313 HydrophobicContact CG2-CB 4.45Å; V285-D313 PolarHBondContact N-O 3.39Å; V285-D313 PolarHBondContact O-N 3.1Å; D313-T326 WeakPolarHBondContact CB-OG1 3.44Å; D313-T326 VanDerWaalsContact CG-OG1 3.31Å; D313-T326 PolarHBondContact OD1-OG1 3.25Å
314	A	97.5	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	141.6	-176	0	0	0	0	0	112	L249 I269 M273 Y282 P284 V312 I325	L249-A314 HydrophobicContact CD2-CB 4.37Å; I269-A314 HydrophobicContact CG2-CB 4.05Å; M273-A314 HydrophobicContact CE-CB 3.76Å; Y282-A314 VanDerWaalsContact OH-C 3.28Å; P284-A314 HydrophobicContact CB-CB 3.98Å; P284-A314 HydrophobicContact CG-CB 4.35Å; V312-A314 HydrophobicContact CG1-CB 3.86Å; A314-I325 PolarHBondContact N-O 3.4Å; A314-I325 PolarHBondContact O-N 3.24Å
315	G	96.5	Very high	95.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.225	C	C	.	.			trans	-131.3	143.3	-178.3	0	0	0	0	0	113	M273 G281 Y282 S323	M273-G315 WeakPolarHBondContact CE-O 3.4Å; G281-G315 PolarHBondContact N-O 3.31Å; Y282-G315 PolarHBondContact OH-N 2.92Å; G315-S323 WeakPolarHBondContact CA-O 3.49Å
316	C	95.5	Very high	95.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	155.6	165.1	-77.2	0	0	0	0	109.8	S241 A244 A245 M273 C278 S279 T322 S323	S241-C316 WeakPolarHBondContact O-CB 3.35Å; S241-C316 VanDerWaalsContact OG-C 3.23Å; S241-C316 WeakPolarHBondContact OG-CB 3.46Å; S241-C316 PolarHBondContact OG-O 3.1Å; A244-C316 HydrophobicContact CB-CB 4.4Å; A245-C316 HydrophobicContact CB-CB 4.21Å; A245-C316 PolarHBondContact N-SG 3.21Å; A245-C316 VanDerWaalsContact N-SG 3.37Å; M273-C316 WeakPolarHBondContact CG-SG 3.33Å; C278-C316 HydrophobicContact CB-CB 3.8Å; S279-C316 CarbonylContact O-C 3.49Å; S279-C316 WeakPolarHBondContact O-CA 3.44Å; C316-T322 CarbonylContact O-C 3.34Å; C316-T322 WeakPolarHBondContact O-CA 3.46Å; C316-S323 PolarHBondContact N-OG 3.07Å; C316-S323 PolarHBondContact O-N 3.44Å; C316-S323 PolarHBondContact O-OG 2.72Å
317	R	94.8	Very high	95.9	Very high	53 Å²	53	39.6 Å²	39.6	20%	0.2	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.4	163.5	163	171.6	45.4	-135.7	-13.7	110.1	H86 S279 V280 G281 Y321	H86-R317 PolarHBondContact CD2-NH1 3.4Å; H86-R317 PolarHBondContact NE2-NH1 3.13Å; S279-R317 PolarHBondContact N-O 2.9Å; S279-R317 PolarHBondContact O-N 3.09Å; S279-R317 VanDerWaalsContact OG-CB 3.32Å; S279-R317 WeakPolarHBondContact OG-CB 3.43Å; S279-R317 WeakPolarHBondContact OG-CG 3.21Å; S279-R317 PolarHBondContact OG-NE 2.85Å; S279-R317 PolarHBondContact OG-O 2.77Å; S279-R317 VanDerWaalsContact OG-O 3.07Å; V280-R317 PolarHBondContact O-NH2 3.01Å; G281-R317 VanDerWaalsContact O-CZ 3.28Å; G281-R317 PolarHBondContact O-NH1 2.91Å; G281-R317 PolarHBondContact O-NH2 3.37Å; R317-Y321 WeakPolarHBondContact CA-O 3.39Å
318	F	93.6	Very high	96	Very high	12 Å²	12	40.3 Å²	40.3	5%	0.053	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	120.9	178.6	-175	-103.4	0	0	0	109	L29 Q237 T240 G320 Y321	L29-F318 HydrophobicContact CD2-CD2 4.14Å; L29-F318 HydrophobicContact CD2-CE2 3.62Å; L29-F318 HydrophobicContact CD2-CZ 4.19Å; Q237-F318 HydrophobicContact CB-CD1 4.44Å; Q237-F318 VanDerWaalsContact OE1-CE1 3.25Å; T240-F318 HydrophobicContact CG2-CD1 3.73Å; T240-F318 HydrophobicContact CG2-CD2 4.16Å; T240-F318 HydrophobicContact CG2-CE1 3.76Å; T240-F318 HydrophobicContact CG2-CE2 4.2Å; T240-F318 HydrophobicContact CG2-CG 3.93Å; T240-F318 HydrophobicContact CG2-CZ 4.01Å; F318-G320 VanDerWaalsContact C-N 3.26Å; F318-G320 PolarHBondContact O-N 3.42Å; F318-Y321 PolarHBondContact N-O 3.08Å; F318-Y321 WeakPolarHBondContact O-CB 3.4Å; F318-Y321 PolarHBondContact O-N 2.82Å
319	N	90.9	Very high	96.1	Very high	54 Å²	54	38.7 Å²	38.7	29%	0.289	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	42.1	-178.9	-65.1	-14.8	0	0	0	114.2	F92 Q237 Y321	F92-N319 WeakPolarHBondContact CE1-O 3.32Å; Q237-N319 HydrophobicContact CG-CB 4.49Å; Q237-N319 PolarHBondContact OE1-ND2 3.12Å; N319-Y321 VanDerWaalsContact C-N 3.26Å; N319-Y321 WeakPolarHBondContact O-CD2 3.01Å; N319-Y321 WeakPolarHBondContact O-CE2 3.3Å; N319-Y321 PolarHBondContact O-N 3.4Å
320	G	91.3	Very high	96.1	Very high	43 Å²	43	35.3 Å²	35.3	44%	0.443	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-4.4	-178.2	0	0	0	0	0	115.4	F318	F318-G320 VanDerWaalsContact C-N 3.26Å; F318-G320 PolarHBondContact O-N 3.42Å
321	Y	94.8	Very high	96	Very high	25 Å²	25	35.3 Å²	35.3	10%	0.098	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.5	178.2	-66.2	-86.8	0	0	0	111.5	R43 Y233 E234 Q237 L238 S241 R317 F318 N319	R43-Y321 PolarHBondContact NH2-OH 3.38Å; Y233-Y321 HydrophobicContact CD1-CE2 4.5Å; Y233-Y321 AromaticContact CE1-CE2 3.99Å; Y233-Y321 HydrophobicContact CE1-CE2 3.99Å; E234-Y321 HydrophobicContact CB-CD1 4.29Å; E234-Y321 HydrophobicContact CB-CE1 3.54Å; E234-Y321 HydrophobicContact CG-CE1 3.72Å; E234-Y321 WeakPolarHBondContact CG-OH 3.23Å; E234-Y321 WeakPolarHBondContact OE1-CE1 3.14Å; E234-Y321 PolarHBondContact OE1-OH 2.88Å; Q237-Y321 HydrophobicContact CB-CD2 3.27Å; Q237-Y321 HydrophobicContact CB-CE2 4Å; Q237-Y321 HydrophobicContact CB-CG 3.61Å; Q237-Y321 HydrophobicContact CG-CD2 3.53Å; Q237-Y321 HydrophobicContact CG-CE2 3.77Å; Q237-Y321 HydrophobicContact CG-CG 4.33Å; L238-Y321 HydrophobicContact CD1-CD1 4.41Å; L238-Y321 HydrophobicContact CD2-CD1 4.2Å; L238-Y321 HydrophobicContact CG-CD1 3.93Å; L238-Y321 HydrophobicContact CG-CG 4.34Å; S241-Y321 PolarHBondContact OG-O 3.43Å; R317-Y321 WeakPolarHBondContact CA-O 3.39Å; F318-Y321 PolarHBondContact N-O 3.08Å; F318-Y321 WeakPolarHBondContact O-CB 3.4Å; F318-Y321 PolarHBondContact O-N 2.82Å; N319-Y321 VanDerWaalsContact C-N 3.26Å; N319-Y321 WeakPolarHBondContact O-CD2 3.01Å; N319-Y321 WeakPolarHBondContact O-CE2 3.3Å; N319-Y321 PolarHBondContact O-N 3.4Å
322	T	96.4	Very high	95.6	Very high	53 Å²	53	36 Å²	36	33%	0.325	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.8	-174.4	-59.9	0	0	0	0	111	L238 Y282 C316	L238-T322 WeakPolarHBondContact CD2-O 3.5Å; Y282-T322 HydrophobicContact CD1-CG2 4Å; Y282-T322 HydrophobicContact CE1-CG2 4.11Å; C316-T322 CarbonylContact O-C 3.34Å; C316-T322 WeakPolarHBondContact O-CA 3.46Å
323	S	97.5	Very high	94.8	Very high	4 Å²	4	37 Å²	37	3%	0.028	20%	0.204	C	C	.	.			trans	-89.5	153.8	164.3	57.7	0	0	0	0	109.3	S241 A245 G315 C316	S241-S323 PolarHBondContact O-OG 2.76Å; S241-S323 WeakPolarHBondContact OG-CB 3.34Å; S241-S323 PolarHBondContact OG-N 2.89Å; S241-S323 VanDerWaalsContact OG-N 3.13Å; S241-S323 PolarHBondContact OG-OG 3.25Å; S241-S323 VanDerWaalsContact OG-OG 3.1Å; A245-S323 WeakPolarHBondContact CB-OG 3.38Å; G315-S323 WeakPolarHBondContact CA-O 3.49Å; C316-S323 PolarHBondContact N-OG 3.07Å; C316-S323 PolarHBondContact O-N 3.44Å; C316-S323 PolarHBondContact O-OG 2.72Å
324	D	97.1	Very high	93.4	Very high	114 Å²	114	37 Å²	37	61%	0.61	21%	0.206	S	C	*	.			trans	-138	115.5	177.4	-176.4	-29.1	0	0	0	107.9	Y282	Y282-D324 HydrophobicContact CE1-CB 4.12Å; Y282-D324 VanDerWaalsContact OH-CA 3.27Å; Y282-D324 WeakPolarHBondContact OH-CA 3.44Å; Y282-D324 VanDerWaalsContact OH-CG 3.25Å; Y282-D324 PolarHBondContact OH-OD1 3.14Å
325	I	97.3	Very high	91.5	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.072	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	114.1	-170.7	-51.2	-178.6	0	0	0	110	V242 A245 V246 L249 Y282 A314 R327	V242-I325 HydrophobicContact CG1-CD1 4.36Å; A245-I325 HydrophobicContact CB-CD1 3.75Å; V246-I325 HydrophobicContact CG2-CD1 3.79Å; L249-I325 HydrophobicContact CD1-CB 4.03Å; L249-I325 HydrophobicContact CD1-CG2 3.65Å; Y282-I325 PolarHBondContact OH-N 3.29Å; A314-I325 PolarHBondContact N-O 3.4Å; A314-I325 PolarHBondContact O-N 3.24Å; I325-R327 HydrophobicContact CG2-CG 4.21Å
326	T	96.8	Very high	89.3	Confident	63 Å²	63	47.9 Å²	47.9	39%	0.387	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.6	167.3	-60.9	0	0	0	0	111.9	L311 V312 D313	L311-T326 HydrophobicContact CD1-CG2 4.21Å; L311-T326 HydrophobicContact CD2-CG2 4.11Å; L311-T326 HydrophobicContact CG-CG2 4.02Å; V312-T326 CarbonylContact O-C 3.6Å; V312-T326 VanDerWaalsContact O-CA 3.27Å; V312-T326 WeakPolarHBondContact O-CA 3.36Å; D313-T326 WeakPolarHBondContact CB-OG1 3.44Å; D313-T326 VanDerWaalsContact CG-OG1 3.31Å; D313-T326 PolarHBondContact OD1-OG1 3.25Å
327	R	97.1	Very high	86.9	Confident	133 Å²	133	51.4 Å²	51.4	50%	0.502	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.8	170.3	-68.3	-63.9	-179.4	-86.6	0.6	110.6	L249 M253 V312 I325 W329	L249-R327 HydrophobicContact CD1-CG 4.3Å; M253-R327 HydrophobicContact CE-CB 3.95Å; M253-R327 HydrophobicContact CE-CG 4.23Å; V312-R327 PolarHBondContact N-O 3.33Å; V312-R327 PolarHBondContact O-N 3.45Å; I325-R327 HydrophobicContact CG2-CG 4.21Å; R327-W329 HydrophobicContact CB-CE3 4.15Å; R327-W329 HydrophobicContact CB-CZ3 4.01Å
328	T	96.3	Very high	84.1	Confident	73 Å²	73	55.6 Å²	55.6	45%	0.448	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.1	174.7	-54.3	0	0	0	0	109.7	L309 V310	L309-T328 HydrophobicContact CB-CG2 3.93Å; L309-T328 HydrophobicContact CD1-CG2 4.06Å; L309-T328 HydrophobicContact CG-CG2 4.49Å; V310-T328 CarbonylContact O-C 3.58Å; V310-T328 WeakPolarHBondContact O-CA 3.48Å; V310-T328 WeakPolarHBondContact O-CG2 3.21Å
329	W	96.1	Very high	81.4	Confident	14 Å²	14	59.8 Å²	59.8	5%	0.053	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	156.1	176.1	63.8	96.6	0	0	0	111.9	M253 T256 L265 L309 V310 V312 R327	M253-W329 HydrophobicContact CE-CD2 4.14Å; M253-W329 HydrophobicContact CE-CE3 3.62Å; M253-W329 HydrophobicContact CE-CH2 4.5Å; M253-W329 HydrophobicContact CE-CZ3 3.83Å; M253-W329 HydrophobicContact CG-CD2 3.78Å; M253-W329 HydrophobicContact CG-CE3 4.12Å; M253-W329 HydrophobicContact CG-CG 4.21Å; M253-W329 HydrophobicContact CG-CH2 4.23Å; M253-W329 HydrophobicContact CG-CZ2 3.92Å; M253-W329 HydrophobicContact CG-CZ3 4.34Å; T256-W329 PolarHBondContact OG1-NE1 3.25Å; T256-W329 VanDerWaalsContact OG1-NE1 3.11Å; L265-W329 HydrophobicContact CD2-CZ2 4.02Å; L309-W329 WeakPolarHBondContact CA-O 3.31Å; V310-W329 HydrophobicContact CG1-CD2 3.67Å; V310-W329 HydrophobicContact CG1-CE3 4.37Å; V310-W329 HydrophobicContact CG1-CG 3.9Å; V310-W329 HydrophobicContact CG1-CZ2 3.86Å; V310-W329 VanDerWaalsContact CG1-NE1 3.35Å; V310-W329 WeakPolarHBondContact CG1-O 3.47Å; V310-W329 PolarHBondContact N-O 3.1Å; V310-W329 PolarHBondContact O-N 3.46Å; V312-W329 HydrophobicContact CB-CH2 3.71Å; V312-W329 HydrophobicContact CB-CZ3 3.79Å; V312-W329 HydrophobicContact CG2-CH2 3.29Å; V312-W329 HydrophobicContact CG2-CZ2 4.08Å; V312-W329 HydrophobicContact CG2-CZ3 3.78Å; R327-W329 HydrophobicContact CB-CE3 4.15Å; R327-W329 HydrophobicContact CB-CZ3 4.01Å
330	P	96.6	Very high	78.9	Confident	20 Å²	20	64 Å²	64	13%	0.13	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	135	174.9	28	-35	0	0	0	111.4	L309 N332 G333 C334	L309-P330 HydrophobicContact CD2-CB 3.94Å; P330-N332 PolarHBondContact O-N 3.1Å; P330-G333 PolarHBondContact O-N 2.99Å; P330-C334 WeakPolarHBondContact CB-O 3.45Å; P330-C334 VanDerWaalsContact CG-C 3.41Å; P330-C334 VanDerWaalsContact CG-O 3.27Å; P330-C334 WeakPolarHBondContact CG-O 3.38Å
331	V	94.8	Very high	76.4	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.2	-176	78.1	0	0	0	0	113	T256 Q257 P258 I260 I304 D305 E308 G333	T256-V331 HydrophobicContact CG2-CB 4.23Å; T256-V331 HydrophobicContact CG2-CG2 3.55Å; Q257-V331 CarbonylContact C-O 3.55Å; Q257-V331 WeakPolarHBondContact CA-O 3.33Å; P258-V331 HydrophobicContact CB-CG1 4.43Å; P258-V331 HydrophobicContact CG-CG1 4.23Å; I260-V331 HydrophobicContact CG2-CG2 3.95Å; I304-V331 HydrophobicContact CB-CG2 3.99Å; I304-V331 HydrophobicContact CG2-CB 3.79Å; I304-V331 HydrophobicContact CG2-CG1 4.18Å; I304-V331 HydrophobicContact CG2-CG2 3.65Å; D305-V331 WeakPolarHBondContact O-CG1 3.47Å; E308-V331 WeakPolarHBondContact O-CG1 3.42Å; E308-V331 PolarHBondContact O-N 2.86Å; V331-G333 VanDerWaalsContact C-N 3.31Å
332	N	90.5	Very high	73.7	Confident	48 Å²	48	67.3 Å²	67.3	26%	0.257	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	0.7	174.5	63.2	11	0	0	0	113.4	P258 N306 P330 C334	P258-N332 HydrophobicContact CG-CB 3.83Å; N306-N332 WeakPolarHBondContact OD1-CB 3.43Å; N306-N332 PolarHBondContact OD1-ND2 3.31Å; P330-N332 PolarHBondContact O-N 3.1Å; N332-C334 PolarHBondContact O-N 3.22Å; N332-C334 PolarHBondContact O-SG 3.21Å; N332-C334 PolarHBondContact OD1-N 3.2Å; N332-C334 PolarHBondContact OD1-O 3.37Å
333	G	81.1	Confident	70.8	Confident	22 Å²	22	75 Å²	75	23%	0.227	44%	0.436	C	S	.	.	S	Bend	trans	76.5	1.9	-177.6	0	0	0	0	0	114.9	P330 V331 C342	P330-G333 PolarHBondContact O-N 2.99Å; V331-G333 VanDerWaalsContact C-N 3.31Å; G333-C342 PolarHBondContact O-SG 2.88Å; G333-C342 VanDerWaalsContact O-SG 3.36Å
334	C	69.1	Low	67.8	Low	32 Å²	32	79.6 Å²	79.6	22%	0.216	47%	0.465	C	S	.	.			trans	-114.2	119.6	-173.7	-39.4	0	0	0	0	110.4	P330 N332 C342	P330-C334 WeakPolarHBondContact CB-O 3.45Å; P330-C334 VanDerWaalsContact CG-C 3.41Å; P330-C334 VanDerWaalsContact CG-O 3.27Å; P330-C334 WeakPolarHBondContact CG-O 3.38Å; N332-C334 PolarHBondContact O-N 3.22Å; N332-C334 PolarHBondContact O-SG 3.21Å; N332-C334 PolarHBondContact OD1-N 3.2Å; N332-C334 PolarHBondContact OD1-O 3.37Å; C334-C342 WeakPolarHBondContact CA-SG 3.38Å; C334-C342 HydrophobicContact CB-CB 3.91Å; C334-C342 WeakPolarHBondContact CB-SG 3.16Å; C334-C342 PolarHBondContact N-SG 2.75Å; C334-C342 VanDerWaalsContact N-SG 3.35Å; C334-C342 WeakPolarHBondContact SG-CB 3.42Å; C334-C342 CovalentContact SG-SG 2.01Å; C334-C342 PolarHBondContact SG-SG 2.75Å
335	S	56.8	Low	64.9	Low	66 Å²	66	78.3 Å²	78.3	46%	0.462	46%	0.457	S	S	.	.			trans	-70.2	146.4	168	58	0	0	0	0	109.3	G337 M338	S335-G337 PolarHBondContact O-N 3.29Å; S335-M338 PolarHBondContact O-N 2.65Å
336	T	51.1	Low	61.8	Low	163 Å²	163	81.4 Å²	81.4	100%	1	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	1.4	-177	43.6	0	0	0	0	114.6
337	G	44.2	Very low	58.7	Low	73 Å²	73	86.2 Å²	86.2	75%	0.753	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-5.8	170.7	0	0	0	0	0	115.3	S335 S339	S335-G337 PolarHBondContact O-N 3.29Å; G337-S339 PolarHBondContact O-N 2.78Å
338	M	36.8	Very low	55.6	Low	142 Å²	142	88.3 Å²	88.3	70%	0.7	50%	0.504	S	S	*	.	S	Bend	trans	-101.6	78.6	-173.7	-144.6	133.3	156.1	0	0	110	S335 T340	S335-M338 PolarHBondContact O-N 2.65Å; M338-T340 PolarHBondContact O-N 2.91Å
339	S	35.9	Very low	52.3	Low	100 Å²	100	96 Å²	96	70%	0.699	53%	0.525	S	S	*	.			trans	-65.2	133.5	-175	89.6	0	0	0	0	112.3	G337 S341	G337-S339 PolarHBondContact O-N 2.78Å; S339-S341 PolarHBondContact O-N 3.44Å
340	T	38.7	Very low	49.2	Very low	142 Å²	142	103.7 Å²	103.7	87%	0.871	56%	0.562	S	S	*	*	S	Bend	trans	77.2	-9.9	152.5	69.5	0	0	0	0	122.3	M338	M338-T340 PolarHBondContact O-N 2.91Å
341	S	39.3	Very low	46.3	Very low	81 Å²	81	112 Å²	112	57%	0.566	62%	0.616	S	S	*	*			trans	-144.8	79.5	164.9	88.2	0	0	0	0	111.6	S339 R343	S339-S341 PolarHBondContact O-N 3.44Å; S341-R343 PolarHBondContact O-N 3.48Å
342	C	37.9	Very low	43.9	Very low	56 Å²	56	117.7 Å²	117.7	38%	0.378	65%	0.647	S	S	.	*			trans	-75.2	75.7	178.2	-164	0	0	0	0	109.5	G333 C334 T344	G333-C342 PolarHBondContact O-SG 2.88Å; G333-C342 VanDerWaalsContact O-SG 3.36Å; C334-C342 WeakPolarHBondContact CA-SG 3.38Å; C334-C342 HydrophobicContact CB-CB 3.91Å; C334-C342 WeakPolarHBondContact CB-SG 3.16Å; C334-C342 PolarHBondContact N-SG 2.75Å; C334-C342 VanDerWaalsContact N-SG 3.35Å; C334-C342 WeakPolarHBondContact SG-CB 3.42Å; C334-C342 CovalentContact SG-SG 2.01Å; C334-C342 PolarHBondContact SG-SG 2.75Å; C342-T344 PolarHBondContact O-N 3.49Å
343	R	35.6	Very low	41.4	Very low	214 Å²	214	121.3 Å²	121.3	81%	0.808	67%	0.667	S	S	*	*			trans	-65.2	113.7	163.5	-62.8	-178.2	-169.3	-127.6	1.3	104.4	S341 L345	S341-R343 PolarHBondContact O-N 3.48Å; R343-L345 PolarHBondContact O-N 3.32Å
344	T	35.8	Very low	39.2	Very low	101 Å²	101	126.8 Å²	126.8	62%	0.62	69%	0.692	S	S	*	*			trans	-16.9	121.7	164.2	23.8	0	0	0	0	110.5	C342 S346	C342-T344 PolarHBondContact O-N 3.49Å; T344-S346 WeakPolarHBondContact O-CA 3.41Å; T344-S346 WeakPolarHBondContact O-CB 3.43Å; T344-S346 PolarHBondContact O-N 3.47Å
345	L	34.9	Very low	37.5	Very low	88 Å²	88	132.4 Å²	132.4	46%	0.461	72%	0.72	S	S	.	*			trans	-40.6	86.1	171.9	-85.4	151.8	0	0	0	110.1	R343 W347	R343-L345 PolarHBondContact O-N 3.32Å; L345-W347 VanDerWaalsContact C-N 3.27Å; L345-W347 PolarHBondContact O-N 3.05Å
346	S	32	Very low	36.3	Very low	79 Å²	79	136.6 Å²	136.6	55%	0.552	74%	0.736	S	S	*	*			trans	-86	83.2	-178.5	155.1	0	0	0	0	103.8	T344 F348	T344-S346 WeakPolarHBondContact O-CA 3.41Å; T344-S346 WeakPolarHBondContact O-CB 3.43Å; T344-S346 PolarHBondContact O-N 3.47Å; S346-F348 WeakPolarHBondContact O-CD2 3.36Å; S346-F348 PolarHBondContact O-N 3.44Å
347	W	33.3	Very low	35.3	Very low	163 Å²	163	134.8 Å²	134.8	62%	0.617	72%	0.718	S	S	*	*			trans	-57.3	107.1	166.5	-70.6	97.8	0	0	0	107.1	L345	L345-W347 VanDerWaalsContact C-N 3.27Å; L345-W347 PolarHBondContact O-N 3.05Å
348	F	30.9	Very low	34.6	Very low	177 Å²	177	139.2 Å²	139.2	78%	0.776	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-55.5	136.8	-170.3	-79.9	-94.6	0	0	0	111.4	S346 H350	S346-F348 WeakPolarHBondContact O-CD2 3.36Å; S346-F348 PolarHBondContact O-N 3.44Å; F348-H350 PolarHBondContact O-N 3.32Å
349	R	28.1	Very low	34.5	Very low	234 Å²	234	139 Å²	139	88%	0.883	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-50.7	117	153.2	-77	174.1	166.1	-178.9	-5.1	108.1
350	H	29.2	Very low	34.3	Very low	177 Å²	177	142.3 Å²	142.3	82%	0.819	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-83.8	133.2	143.9	-78.8	-59.4	0	0	0	107.2	F348	F348-H350 PolarHBondContact O-N 3.32Å
351	P	36.5	Very low	33.9	Very low	195 Å²	195	142.3 Å²	142.3	100%	1.266	70%	0.704	S	S	*	*			trans	-62.1	0	177.2	27.6	-33.9	0	0	0	112.5

Retrieved 351 of 351 residues in 406 ms (Link to these results)

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