A0A087X922_POEFO Loading...

GID complex subunit 4 homolog

AlphaFold DB (M3ZD65), UniProt , Accession A0A087X922, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 217 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	31.2	Very low	37.7	Very low	240 Å²	240	146.4 Å²	146.4	100%	1.182	83%	0.83	S	S	*	*				0	130	0	-73.1	-76	-147.6	0	0	107.9
2	P	42.2	Very low	37.9	Very low	107 Å²	107	143.6 Å²	143.6	70%	0.695	82%	0.822	S	S	*	*				-138.2	167	-122.9	41.9	-24.4	0	0	0	116.8
3	V	38.7	Very low	38.4	Very low	132 Å²	132	140.1 Å²	140.1	80%	0.8	82%	0.821	S	S	*	*			trans	56.9	163	155.9	-99.2	0	0	0	0	121.7
4	P	48	Very low	38.2	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	81%	0.805	S	S	*	*			cis	-140.5	152.5	-15.6	24.6	-1.7	0	0	0	117.9
5	A	39.9	Very low	38	Very low	96 Å²	96	138.9 Å²	138.9	79%	0.793	81%	0.807	S	S	*	*				23.5	138.4	126.6	0	0	0	0	0	122.7
6	G	32.9	Very low	38.4	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	81%	0.809	S	S	*	*			trans	-159.1	76.8	156.4	0	0	0	0	0	113.8
7	Y	33.8	Very low	38.6	Very low	228 Å²	228	137.1 Å²	137.1	89%	0.894	81%	0.807	S	S	*	*			trans	57.4	120.8	138.4	-77.6	-85	0	0	0	123
8	L	37.9	Very low	39	Very low	163 Å²	163	136.1 Å²	136.1	85%	0.853	81%	0.808	S	S	*	*			trans	-65.8	142.7	155.7	-73.5	156.6	0	0	0	111.5
9	S	32.8	Very low	39.5	Very low	113 Å²	113	133.3 Å²	133.3	79%	0.79	80%	0.802	S	S	*	*			trans	-157.1	102.8	140.8	62.8	0	0	0	0	110.4
10	D	38	Very low	40	Very low	145 Å²	145	131 Å²	131	78%	0.775	79%	0.792	S	S	*	*			trans	-54.9	143.4	151.7	-92.3	-40.3	0	0	0	109.8
11	F	39.3	Very low	40.2	Very low	204 Å²	204	132.6 Å²	132.6	90%	0.895	80%	0.796	S	S	*	*			trans	-171.1	159.8	141.6	-91	-50.6	0	0	0	110.1
12	P	40.1	Very low	41.1	Very low	113 Å²	113	127.6 Å²	127.6	73%	0.734	77%	0.772	S	S	*	*				-104.9	168.9	-126.2	38.8	-32.5	0	0	0	114.2
13	A	44.2	Very low	41.5	Very low	98 Å²	98	127.4 Å²	127.4	81%	0.81	77%	0.771	S	S	*	*			trans	-55.5	138.5	160.9	0	0	0	0	0	110.9
14	A	35.4	Very low	42	Very low	72 Å²	72	126.5 Å²	126.5	60%	0.595	77%	0.768	S	S	*	*				177.3	158.8	119.1	0	0	0	0	0	114.7
15	F	35.3	Very low	42	Very low	190 Å²	190	126.1 Å²	126.1	83%	0.833	77%	0.766	S	S	*	*			trans	89.2	86.1	154.4	-53.8	-61.4	0	0	0	118.8	S17	F15-S17 PolarHBondContact O-N 3.41Å
16	T	44.9	Very low	42.2	Very low	136 Å²	136	126.5 Å²	126.5	83%	0.834	76%	0.76	S	S	*	*			trans	1.9	105.2	130.2	55.1	0	0	0	0	115.4
17	S	40.9	Very low	42.8	Very low	112 Å²	112	131.6 Å²	131.6	78%	0.783	77%	0.768	S	S	*	*			trans	-92.6	119.6	155.2	65.3	0	0	0	0	108.4	F15 A19	F15-S17 PolarHBondContact O-N 3.41Å; S17-A19 VanDerWaalsContact C-N 3.34Å; S17-A19 PolarHBondContact O-N 2.62Å
18	S	46.8	Very low	43.2	Very low	118 Å²	118	127.5 Å²	127.5	83%	0.825	76%	0.762	S	S	*	*			trans	-63.1	96.3	165.9	52.6	0	0	0	0	107.8	S20	S18-S20 PolarHBondContact O-N 2.94Å
19	A	48.3	Very low	43.4	Very low	83 Å²	83	124.4 Å²	124.4	69%	0.686	75%	0.75	S	S	*	*			trans	-62.1	103.8	171.8	0	0	0	0	0	108	S17 L21	S17-A19 VanDerWaalsContact C-N 3.34Å; S17-A19 PolarHBondContact O-N 2.62Å; A19-L21 PolarHBondContact O-N 3.36Å; A19-L21 VanDerWaalsContact O-N 3.09Å
20	S	49.5	Very low	43.9	Very low	87 Å²	87	127.8 Å²	127.8	61%	0.608	75%	0.753	S	S	*	*			trans	-59.8	110	170.6	-174.1	0	0	0	0	108.1	S18 I22	S18-S20 PolarHBondContact O-N 2.94Å; S20-I22 PolarHBondContact O-N 3.3Å; S20-I22 VanDerWaalsContact OG-CD1 3.23Å; S20-I22 WeakPolarHBondContact OG-CD1 3.33Å; S20-I22 WeakPolarHBondContact OG-CG1 3.32Å
21	L	43.5	Very low	44	Very low	166 Å²	166	127.9 Å²	127.9	87%	0.869	75%	0.749	S	S	*	*			trans	-76.6	54.7	175.5	-69	170.8	0	0	0	110.4	A19 P23	A19-L21 PolarHBondContact O-N 3.36Å; A19-L21 VanDerWaalsContact O-N 3.09Å; L21-P23 WeakPolarHBondContact O-CD 3.41Å
22	I	50.2	Low	43.8	Very low	134 Å²	134	124.8 Å²	124.8	69%	0.687	75%	0.749	S	S	*	*			trans	-87.9	106.3	168.5	-60.9	165.3	0	0	0	105.9	S20	S20-I22 PolarHBondContact O-N 3.3Å; S20-I22 VanDerWaalsContact OG-CD1 3.23Å; S20-I22 WeakPolarHBondContact OG-CD1 3.33Å; S20-I22 WeakPolarHBondContact OG-CG1 3.32Å
23	P	52	Low	43.9	Very low	103 Å²	103	123 Å²	123	67%	0.669	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-61.1	139.7	174.9	25.7	-32.1	0	0	0	108.7	L21	L21-P23 WeakPolarHBondContact O-CD 3.41Å
24	P	48	Very low	43.7	Very low	113 Å²	113	122.1 Å²	122.1	73%	0.734	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-59.3	143.7	173.9	25.3	-32.3	0	0	0	109.1
25	P	47.6	Very low	44.2	Very low	104 Å²	104	123 Å²	123	68%	0.675	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-58.4	135.8	176	24.1	-31.5	0	0	0	109	I27	P25-I27 PolarHBondContact O-N 3.38Å
26	P	45.7	Very low	45.3	Very low	103 Å²	103	120.7 Å²	120.7	67%	0.669	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-59	138.4	-177.7	21	-30.2	0	0	0	110.6	N28	P26-N28 PolarHBondContact O-N 2.83Å
27	I	44	Very low	46.5	Very low	179 Å²	179	115.1 Å²	115.1	92%	0.918	70%	0.702	S	S	*	*	S	Bend	trans	-74.3	65.6	-177.7	-53.8	170.8	0	0	0	109.1	P25	P25-I27 PolarHBondContact O-N 3.38Å
28	N	42.5	Very low	48.6	Very low	142 Å²	142	113 Å²	113	76%	0.759	68%	0.682	S	S	*	*			trans	178.8	64.2	157.4	-138.5	-6.8	0	0	0	111.5	P26 Q30	P26-N28 PolarHBondContact O-N 2.83Å; N28-Q30 PolarHBondContact O-N 3.02Å; N28-Q30 VanDerWaalsContact O-N 3.09Å
29	T	42.8	Very low	50.5	Low	98 Å²	98	108 Å²	108	60%	0.601	65%	0.645	S	S	*	*			trans	-82.4	31.6	-174.5	42.1	0	0	0	0	115.4	Q31	T29-Q31 VanDerWaalsContact C-N 3.3Å; T29-Q31 PolarHBondContact O-N 3.2Å
30	Q	42.8	Very low	52.4	Low	183 Å²	183	106.6 Å²	106.6	86%	0.855	62%	0.623	S	S	*	*			trans	-93.4	68.3	162.5	-65.8	-153.8	19.8	0	0	110.1	N28	N28-Q30 PolarHBondContact O-N 3.02Å; N28-Q30 VanDerWaalsContact O-N 3.09Å
31	Q	39.1	Very low	54.4	Low	147 Å²	147	105.2 Å²	105.2	69%	0.687	61%	0.613	S	S	*	*			trans	-83.6	127.2	162.8	-80.8	-174.4	-37	0	0	108.7	T29 G33 V34	T29-Q31 VanDerWaalsContact C-N 3.3Å; T29-Q31 PolarHBondContact O-N 3.2Å; Q31-G33 PolarHBondContact O-N 3.43Å; Q31-G33 VanDerWaalsContact O-N 3.1Å; Q31-V34 HydrophobicContact CB-CG2 3.99Å; Q31-V34 PolarHBondContact O-N 3.18Å
32	P	35.8	Very low	56.6	Low	139 Å²	139	98.8 Å²	98.8	90%	0.903	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	118	165.6	-18.2	29.6	0	0	0	108.3
33	G	43.4	Very low	58.6	Low	75 Å²	75	92.4 Å²	92.4	77%	0.773	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.6	0.6	-177.7	0	0	0	0	0	116.1	Q31 V35	Q31-G33 PolarHBondContact O-N 3.43Å; Q31-G33 VanDerWaalsContact O-N 3.1Å; G33-V35 PolarHBondContact O-N 2.91Å
34	V	38.3	Very low	60.6	Low	81 Å²	81	89.6 Å²	89.6	49%	0.491	53%	0.531	S	S	.	.			trans	-69.8	103.8	163.6	-179	0	0	0	0	107.8	Q31 T36	Q31-V34 HydrophobicContact CB-CG2 3.99Å; Q31-V34 PolarHBondContact O-N 3.18Å; V34-T36 PolarHBondContact O-N 2.91Å
35	V	47.1	Very low	63	Low	91 Å²	91	84.2 Å²	84.2	55%	0.552	50%	0.496	S	S	*	.			trans	-61.6	103.9	172.3	-124.9	0	0	0	0	107.5	G33 S37 Y40	G33-V35 PolarHBondContact O-N 2.91Å; V35-S37 WeakPolarHBondContact CG1-O 3.42Å; V35-S37 PolarHBondContact O-N 3.15Å; V35-Y40 HydrophobicContact CG1-CD1 4.38Å; V35-Y40 HydrophobicContact CG1-CG 4.38Å
36	T	57.6	Low	65.4	Low	141 Å²	141	85.4 Å²	85.4	87%	0.865	49%	0.487	S	S	*	.	S	Bend	trans	-71.5	-9.1	175.9	54.3	0	0	0	0	112	V34	V34-T36 PolarHBondContact O-N 2.91Å
37	S	70.7	Confident	67.9	Low	19 Å²	19	81.2 Å²	81.2	13%	0.133	46%	0.463	C	S	.	.	S	Bend	trans	-131.9	137.9	178.1	-173.9	0	0	0	0	110.3	V35 L39 F179	V35-S37 WeakPolarHBondContact CG1-O 3.42Å; V35-S37 PolarHBondContact O-N 3.15Å; S37-L39 PolarHBondContact O-N 2.81Å; S37-L39 WeakPolarHBondContact OG-CB 3.39Å; S37-L39 PolarHBondContact OG-N 2.84Å; S37-F179 WeakPolarHBondContact OG-CE1 3.31Å
38	L	85.1	Confident	70.4	Confident	68 Å²	68	76.4 Å²	76.4	36%	0.356	44%	0.437	S	S	.	.	S	Bend	trans	-77.3	9.8	172.3	-66.7	175.4	0	0	0	113	Y40 S43 A184	L38-Y40 HydrophobicContact CB-CE1 4.46Å; L38-Y40 HydrophobicContact CD2-CE1 3.97Å; L38-Y40 WeakPolarHBondContact O-CD1 3.49Å; L38-Y40 PolarHBondContact O-N 2.91Å; L38-S43 WeakPolarHBondContact O-CB 3.47Å; L38-A184 HydrophobicContact CB-CB 3.69Å; L38-A184 HydrophobicContact CD1-CB 3.41Å; L38-A184 VanDerWaalsContact CD1-CB 3.41Å; L38-A184 HydrophobicContact CG-CB 4.1Å
39	L	86.9	Confident	73	Confident	11 Å²	11	70.1 Å²	70.1	6%	0.058	40%	0.402	C	S	.	.			trans	-89.4	84.3	168.7	-164	80.3	0	0	0	110	S37 L62 V65 M67 I148 M150 F179	S37-L39 PolarHBondContact O-N 2.81Å; S37-L39 WeakPolarHBondContact OG-CB 3.39Å; S37-L39 PolarHBondContact OG-N 2.84Å; L39-L62 HydrophobicContact CD1-CD1 3.48Å; L39-L62 VanDerWaalsContact CD1-CD1 3.48Å; L39-L62 HydrophobicContact CG-CD1 4.09Å; L39-V65 HydrophobicContact CD2-CG1 4.36Å; L39-V65 HydrophobicContact CG-CG1 4.35Å; L39-M67 HydrophobicContact CD2-SD 4.48Å; L39-I148 HydrophobicContact CD2-CD1 3.8Å; L39-I148 HydrophobicContact CD2-CG2 4.39Å; L39-M150 HydrophobicContact CD1-CE 4.25Å; L39-M150 HydrophobicContact CD1-SD 4.48Å; L39-M150 HydrophobicContact CD2-SD 4.2Å; L39-F179 HydrophobicContact CB-CD1 4.3Å; L39-F179 HydrophobicContact CB-CE1 3.81Å; L39-F179 HydrophobicContact CB-CZ 3.95Å; L39-F179 HydrophobicContact CD1-CD1 4.4Å; L39-F179 HydrophobicContact CD1-CD2 4.26Å; L39-F179 HydrophobicContact CD1-CE2 4.42Å; L39-F179 HydrophobicContact CD1-CG 4.23Å
40	Y	88.2	Confident	75.5	Confident	55 Å²	55	70.5 Å²	70.5	22%	0.216	40%	0.396	C	S	.	.	S	Bend	trans	-140.3	162.3	-179.1	63.7	-86.7	0	0	0	112.5	V35 L38 G42 S43	V35-Y40 HydrophobicContact CG1-CD1 4.38Å; V35-Y40 HydrophobicContact CG1-CG 4.38Å; L38-Y40 HydrophobicContact CB-CE1 4.46Å; L38-Y40 HydrophobicContact CD2-CE1 3.97Å; L38-Y40 WeakPolarHBondContact O-CD1 3.49Å; L38-Y40 PolarHBondContact O-N 2.91Å; Y40-G42 PolarHBondContact O-N 3.13Å; Y40-S43 VanDerWaalsContact O-CB 3.27Å; Y40-S43 WeakPolarHBondContact O-CB 3.46Å; Y40-S43 PolarHBondContact O-N 2.88Å; Y40-S43 PolarHBondContact O-OG 2.91Å
41	S	90.4	Very high	77.8	Confident	58 Å²	58	63 Å²	63	41%	0.406	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	121.5	176.1	-53.4	0	0	0	0	111	Q63 H64 V65	S41-Q63 WeakPolarHBondContact CB-O 3.43Å; S41-H64 WeakPolarHBondContact OG-CA 3.43Å; S41-V65 PolarHBondContact OG-N 3.42Å; S41-V65 VanDerWaalsContact OG-N 3.15Å
42	G	89.4	Confident	80	Confident	31 Å²	31	65 Å²	65	32%	0.32	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.6	-14.9	-174.7	0	0	0	0	0	114.4	Y40 L62	Y40-G42 PolarHBondContact O-N 3.13Å; G42-L62 WeakPolarHBondContact CA-O 3.47Å; G42-L62 PolarHBondContact N-O 2.8Å
43	S	92.2	Very high	82.4	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	36%	0.36	C	S	.	.			trans	-61.4	140.4	179.7	59.9	0	0	0	0	112.1	L38 Y40 F45 V61 L62	L38-S43 WeakPolarHBondContact O-CB 3.47Å; Y40-S43 VanDerWaalsContact O-CB 3.27Å; Y40-S43 WeakPolarHBondContact O-CB 3.46Å; Y40-S43 PolarHBondContact O-N 2.88Å; Y40-S43 PolarHBondContact O-OG 2.91Å; S43-F45 WeakPolarHBondContact OG-CE2 3.29Å; S43-V61 WeakPolarHBondContact O-CA 3.08Å; S43-L62 PolarHBondContact O-N 2.86Å; S43-L62 WeakPolarHBondContact OG-CD1 3.28Å
44	K	95.7	Very high	84.7	Confident	43 Å²	43	62.1 Å²	62.1	19%	0.187	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	138	-176.9	-176	175.1	-71.3	133.3	0	110.5	E59 V60 V61 V206 E208	K44-E59 HydrophobicContact CD-CG 4.38Å; K44-E59 HydrophobicContact CG-CG 4.2Å; K44-V60 CarbonylContact C-O 3.52Å; K44-V60 WeakPolarHBondContact CA-O 3.34Å; K44-V61 HydrophobicContact CG-CG2 4.15Å; K44-V206 HydrophobicContact CB-CB 4.49Å; K44-V206 HydrophobicContact CG-CB 4.41Å; K44-V206 PolarHBondContact O-N 3.25Å; K44-E208 IonicContact NZ-OE1 2.71Å; K44-E208 PolarHBondContact NZ-OE1 3.16Å
45	F	97.3	Very high	87.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.8	178.2	-62.6	-96.7	0	0	0	109.9	S43 E59 V60 L62 F179 I186 L203 T204 H205	S43-F45 WeakPolarHBondContact OG-CE2 3.29Å; F45-E59 CarbonylContact O-C 3.54Å; F45-E59 WeakPolarHBondContact O-CA 3.31Å; F45-V60 HydrophobicContact CB-CB 4.37Å; F45-V60 PolarHBondContact N-O 2.95Å; F45-V60 PolarHBondContact O-N 3.28Å; F45-L62 HydrophobicContact CE2-CD1 4.06Å; F45-L62 HydrophobicContact CE2-CG 4.24Å; F45-F179 HydrophobicContact CE1-CD2 4.4Å; F45-F179 AromaticContact CE1-CE2 3.88Å; F45-F179 HydrophobicContact CE1-CE2 3.88Å; F45-F179 AromaticContact CZ-CE2 3.92Å; F45-F179 HydrophobicContact CZ-CE2 3.92Å; F45-I186 HydrophobicContact CB-CD1 4.28Å; F45-I186 HydrophobicContact CD1-CD1 3.57Å; F45-I186 HydrophobicContact CD1-CG1 3.99Å; F45-I186 HydrophobicContact CD2-CD1 3.93Å; F45-I186 HydrophobicContact CE1-CD1 3.81Å; F45-I186 HydrophobicContact CE1-CG1 4.08Å; F45-I186 HydrophobicContact CE2-CD1 4.14Å; F45-I186 HydrophobicContact CG-CD1 3.65Å; F45-I186 HydrophobicContact CZ-CD1 4.1Å; F45-L203 HydrophobicContact CB-CB 3.89Å; F45-L203 HydrophobicContact CB-CD1 4.21Å; F45-T204 CarbonylContact C-O 3.42Å; F45-T204 VanDerWaalsContact CA-O 3.27Å; F45-T204 WeakPolarHBondContact CA-O 3.21Å; F45-H205 HydrophobicContact CD1-CB 3.98Å; F45-H205 HydrophobicContact CE1-CB 3.68Å; F45-H205 HydrophobicContact CZ-CB 4.37Å; F45-H205 AromaticContact CZ-CD2 4Å
46	R	98.2	Very high	89.8	Confident	129 Å²	129	58.9 Å²	58.9	49%	0.487	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.3	176.6	-76.4	-176.6	179.1	168.9	-0.3	111.4	V58 E59 L203 T204 V206	R46-V58 WeakPolarHBondContact CA-O 3.39Å; R46-E59 HydrophobicContact CG-CB 4.19Å; R46-E59 HydrophobicContact CG-CG 4Å; R46-E59 IonicContact CZ-OE2 3.8Å; R46-E59 IonicContact NE-OE2 3.43Å; R46-E59 PolarHBondContact NE-OE2 2.75Å; R46-E59 IonicContact NH2-OE2 3.38Å; R46-E59 PolarHBondContact NH2-OE2 2.71Å; R46-L203 CarbonylContact O-C 3.44Å; R46-L203 VanDerWaalsContact O-CA 3.3Å; R46-L203 WeakPolarHBondContact O-CA 3.32Å; R46-T204 PolarHBondContact N-O 2.93Å; R46-T204 PolarHBondContact O-N 3.09Å; R46-T204 PolarHBondContact O-OG1 2.74Å; R46-V206 HydrophobicContact CB-CG2 3.81Å; R46-V206 HydrophobicContact CG-CG2 3.73Å
47	G	98	Very high	91.7	Very high	15 Å²	15	56 Å²	56	16%	0.155	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.8	-136.3	173.7	0	0	0	0	0	110.1	V58 N202	G47-V58 PolarHBondContact N-O 2.76Å; G47-V58 PolarHBondContact O-N 2.93Å; G47-N202 CarbonylContact C-O 3.45Å; G47-N202 VanDerWaalsContact CA-O 3.28Å; G47-N202 WeakPolarHBondContact CA-O 3.47Å
48	H	97.8	Very high	93	Very high	79 Å²	79	55.3 Å²	55.3	37%	0.366	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.3	-169.3	-48.4	84.1	0	0	0	112.7	K50 Y56 D57 N202	H48-K50 HydrophobicContact CB-CG 4.4Å; H48-Y56 CarbonylContact C-O 3.57Å; H48-Y56 WeakPolarHBondContact CA-O 3.43Å; H48-D57 IonicContact CD2-OD1 3.4Å; H48-D57 PolarHBondContact CD2-OD1 2.9Å; H48-D57 IonicContact NE2-OD1 3.57Å; H48-N202 PolarHBondContact N-O 3.44Å; H48-N202 PolarHBondContact O-N 2.8Å
49	Q	96.6	Very high	93.6	Very high	9 Å²	9	53.5 Å²	53.5	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.6	159.7	178.8	167.8	-36.6	0	0	109.1	S55 Y56 V58 I78 Y175 S200 L201	Q49-S55 WeakPolarHBondContact O-CA 3.29Å; Q49-Y56 PolarHBondContact N-O 3.35Å; Q49-Y56 PolarHBondContact O-N 2.71Å; Q49-V58 HydrophobicContact CB-CG2 3.73Å; Q49-I78 HydrophobicContact CB-CD1 4.27Å; Q49-Y175 PolarHBondContact OE1-OH 3.14Å; Q49-S200 CarbonylContact C-O 3.44Å; Q49-S200 WeakPolarHBondContact CA-O 3.31Å; Q49-L201 HydrophobicContact CB-CD1 4.15Å
50	K	95.6	Very high	94.1	Very high	106 Å²	106	53 Å²	53	46%	0.461	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.7	-177.7	-61	-179.2	178.8	179.7	0	111.6	H48 N54 Q199 S200	H48-K50 HydrophobicContact CB-CG 4.4Å; K50-N54 WeakPolarHBondContact CA-O 3.29Å; K50-Q199 CarbonylContact O-C 3.53Å; K50-Q199 VanDerWaalsContact O-CA 3.29Å; K50-Q199 WeakPolarHBondContact O-CA 3.47Å; K50-S200 PolarHBondContact N-O 3.29Å; K50-S200 PolarHBondContact O-N 3.05Å
51	S	90.1	Very high	94.5	Very high	25 Å²	25	51.7 Å²	51.7	18%	0.175	28%	0.284	C	S	.	.			trans	-102.8	-177.2	163.3	67.6	0	0	0	0	109.9	G53 N54	S51-G53 PolarHBondContact O-N 3.27Å; S51-N54 PolarHBondContact N-O 2.73Å; S51-N54 PolarHBondContact OG-N 3.25Å
52	K	85.3	Confident	94.8	Very high	190 Å²	190	49 Å²	49	83%	0.826	27%	0.265	S	S	*	.	S	Bend	trans	-54.8	-25.1	-179.7	-86.6	166.4	-168.2	178.9	0	115.8	E196	K52-E196 VanDerWaalsContact CB-OE1 3.29Å; K52-E196 WeakPolarHBondContact CB-OE1 3.46Å; K52-E196 WeakPolarHBondContact CD-OE1 3.21Å; K52-E196 WeakPolarHBondContact CG-OE1 3.36Å; K52-E196 PolarHBondContact N-OE1 2.84Å
53	G	87.3	Confident	95	Very high	67 Å²	67	51.7 Å²	51.7	69%	0.691	27%	0.269	S	S	*	.	S	Bend	trans	-131.7	-11.5	-175.8	0	0	0	0	0	115.3	S51	S51-G53 PolarHBondContact O-N 3.27Å
54	N	91.4	Very high	95.1	Very high	86 Å²	86	56 Å²	56	46%	0.46	29%	0.289	S	S	.	.			trans	-126.4	150.5	-172.9	-58.4	-44.8	0	0	0	111.3	K50 S51 Y56	K50-N54 WeakPolarHBondContact CA-O 3.29Å; S51-N54 PolarHBondContact N-O 2.73Å; S51-N54 PolarHBondContact OG-N 3.25Å; N54-Y56 HydrophobicContact CB-CD2 4.48Å; N54-Y56 HydrophobicContact CB-CE1 4.15Å; N54-Y56 HydrophobicContact CB-CE2 3.6Å; N54-Y56 VanDerWaalsContact CB-CZ 3.42Å; N54-Y56 VanDerWaalsContact CB-OH 3.27Å; N54-Y56 WeakPolarHBondContact CB-OH 3.47Å; N54-Y56 PolarHBondContact ND2-OH 2.8Å; N54-Y56 VanDerWaalsContact ND2-OH 3.09Å
55	S	95.5	Very high	95	Very high	68 Å²	68	55.1 Å²	55.1	48%	0.476	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.8	173.2	-176.3	0	0	0	0	108.1	Q49	Q49-S55 WeakPolarHBondContact O-CA 3.29Å
56	Y	95.6	Very high	94.9	Very high	36 Å²	36	56.6 Å²	56.6	14%	0.141	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.6	-176.3	-54	-74.1	0	0	0	109.7	H48 Q49 N54 V58 I78 G80 L81	H48-Y56 CarbonylContact C-O 3.57Å; H48-Y56 WeakPolarHBondContact CA-O 3.43Å; Q49-Y56 PolarHBondContact N-O 3.35Å; Q49-Y56 PolarHBondContact O-N 2.71Å; N54-Y56 HydrophobicContact CB-CD2 4.48Å; N54-Y56 HydrophobicContact CB-CE1 4.15Å; N54-Y56 HydrophobicContact CB-CE2 3.6Å; N54-Y56 VanDerWaalsContact CB-CZ 3.42Å; N54-Y56 VanDerWaalsContact CB-OH 3.27Å; N54-Y56 WeakPolarHBondContact CB-OH 3.47Å; N54-Y56 PolarHBondContact ND2-OH 2.8Å; N54-Y56 VanDerWaalsContact ND2-OH 3.09Å; Y56-V58 PolarHBondContact O-N 2.67Å; Y56-I78 HydrophobicContact CD2-CD1 4.27Å; Y56-I78 HydrophobicContact CG-CD1 4.12Å; Y56-I78 HydrophobicContact CG-CG1 4.37Å; Y56-G80 WeakPolarHBondContact CD1-O 3.38Å; Y56-G80 WeakPolarHBondContact CE1-O 3.46Å; Y56-L81 HydrophobicContact CD1-CD1 4.41Å; Y56-L81 HydrophobicContact CD2-CD1 4.08Å; Y56-L81 HydrophobicContact CE1-CD1 4.12Å; Y56-L81 HydrophobicContact CE2-CD1 3.75Å; Y56-L81 HydrophobicContact CG-CD1 4.38Å
57	D	97.6	Very high	94.5	Very high	81 Å²	81	55 Å²	55	43%	0.433	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	130.3	173.2	-68	-16.1	0	0	0	109.6	H48 I78 K79	H48-D57 IonicContact CD2-OD1 3.4Å; H48-D57 PolarHBondContact CD2-OD1 2.9Å; H48-D57 IonicContact NE2-OD1 3.57Å; D57-I78 WeakPolarHBondContact O-CA 3.21Å; D57-K79 HydrophobicContact CB-CB 4.23Å; D57-K79 HydrophobicContact CB-CD 4.16Å; D57-K79 HydrophobicContact CB-CG 4.38Å; D57-K79 PolarHBondContact O-N 3.25Å
58	V	98.1	Very high	94.2	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.03	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.3	177.5	178.9	0	0	0	0	110.3	R46 G47 Q49 Y56 V60 L76 K77 I78 L201 L203	R46-V58 WeakPolarHBondContact CA-O 3.39Å; G47-V58 PolarHBondContact N-O 2.76Å; G47-V58 PolarHBondContact O-N 2.93Å; Q49-V58 HydrophobicContact CB-CG2 3.73Å; Y56-V58 PolarHBondContact O-N 2.67Å; V58-V60 HydrophobicContact CG1-CG2 4.11Å; V58-L76 HydrophobicContact CG1-CD2 4.15Å; V58-L76 HydrophobicContact CG1-CG 4.05Å; V58-K77 CarbonylContact C-O 3.58Å; V58-K77 VanDerWaalsContact CA-O 3.26Å; V58-K77 WeakPolarHBondContact CA-O 3.21Å; V58-I78 HydrophobicContact CG2-CB 4.2Å; V58-I78 HydrophobicContact CG2-CD1 4.09Å; V58-I78 HydrophobicContact CG2-CG1 3.92Å; V58-L201 HydrophobicContact CB-CD1 4.15Å; V58-L201 HydrophobicContact CG1-CD1 3.96Å; V58-L201 HydrophobicContact CG2-CD1 4.14Å; V58-L203 HydrophobicContact CB-CD2 3.95Å; V58-L203 HydrophobicContact CG1-CD2 3.94Å
59	E	98.1	Very high	94	Very high	29 Å²	29	62.5 Å²	62.5	14%	0.136	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132	168.5	-178.5	178.5	93.3	0	0	109	K44 F45 R46 K77	K44-E59 HydrophobicContact CD-CG 4.38Å; K44-E59 HydrophobicContact CG-CG 4.2Å; F45-E59 CarbonylContact O-C 3.54Å; F45-E59 WeakPolarHBondContact O-CA 3.31Å; R46-E59 HydrophobicContact CG-CB 4.19Å; R46-E59 HydrophobicContact CG-CG 4Å; R46-E59 IonicContact CZ-OE2 3.8Å; R46-E59 IonicContact NE-OE2 3.43Å; R46-E59 PolarHBondContact NE-OE2 2.75Å; R46-E59 IonicContact NH2-OE2 3.38Å; R46-E59 PolarHBondContact NH2-OE2 2.71Å; E59-K77 HydrophobicContact CB-CB 4.47Å; E59-K77 PolarHBondContact N-O 3.1Å; E59-K77 PolarHBondContact O-N 3.08Å; E59-K77 VanDerWaalsContact OE1-CE 3.28Å; E59-K77 WeakPolarHBondContact OE1-CE 3.4Å; E59-K77 IonicContact OE1-NZ 2.67Å; E59-K77 PolarHBondContact OE1-NZ 3.36Å; E59-K77 IonicContact OE2-NZ 3.86Å
60	V	98.1	Very high	94	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.9	176.5	170.4	0	0	0	0	109.1	K44 F45 V58 L62 Y75 L76 F92 W152 L203	K44-V60 CarbonylContact C-O 3.52Å; K44-V60 WeakPolarHBondContact CA-O 3.34Å; F45-V60 HydrophobicContact CB-CB 4.37Å; F45-V60 PolarHBondContact N-O 2.95Å; F45-V60 PolarHBondContact O-N 3.28Å; V58-V60 HydrophobicContact CG1-CG2 4.11Å; V60-L62 HydrophobicContact CG1-CD2 3.87Å; V60-Y75 VanDerWaalsContact CA-O 3.29Å; V60-Y75 WeakPolarHBondContact CA-O 3.3Å; V60-L76 HydrophobicContact CG2-CB 4.27Å; V60-L76 HydrophobicContact CG2-CD1 4.38Å; V60-L76 HydrophobicContact CG2-CG 4.04Å; V60-F92 HydrophobicContact CG1-CE1 3.96Å; V60-F92 HydrophobicContact CG1-CZ 4.03Å; V60-W152 HydrophobicContact CG1-CH2 3.9Å; V60-W152 HydrophobicContact CG1-CZ3 3.96Å; V60-W152 HydrophobicContact CG2-CZ3 4.06Å; V60-L203 HydrophobicContact CB-CD1 4.07Å; V60-L203 HydrophobicContact CG2-CD1 3.61Å
61	V	96.7	Very high	94.1	Very high	29 Å²	29	61.4 Å²	61.4	18%	0.176	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.6	171.1	-177.2	0	0	0	0	108.3	S43 K44 G74 Y75	S43-V61 WeakPolarHBondContact O-CA 3.08Å; K44-V61 HydrophobicContact CG-CG2 4.15Å; V61-G74 CarbonylContact O-C 3.58Å; V61-G74 WeakPolarHBondContact O-CA 3.26Å; V61-Y75 PolarHBondContact N-O 3.12Å; V61-Y75 PolarHBondContact O-N 2.93Å
62	L	96.1	Very high	94.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	124.2	174.3	-55.3	-169.1	0	0	0	108.4	L39 G42 S43 F45 V60 V65 L72 F92 W152	L39-L62 HydrophobicContact CD1-CD1 3.48Å; L39-L62 VanDerWaalsContact CD1-CD1 3.48Å; L39-L62 HydrophobicContact CG-CD1 4.09Å; G42-L62 WeakPolarHBondContact CA-O 3.47Å; G42-L62 PolarHBondContact N-O 2.8Å; S43-L62 PolarHBondContact O-N 2.86Å; S43-L62 WeakPolarHBondContact OG-CD1 3.28Å; F45-L62 HydrophobicContact CE2-CD1 4.06Å; F45-L62 HydrophobicContact CE2-CG 4.24Å; V60-L62 HydrophobicContact CG1-CD2 3.87Å; L62-V65 HydrophobicContact CB-CG2 4.1Å; L62-V65 HydrophobicContact CD1-CG2 3.96Å; L62-L72 HydrophobicContact CD1-CD1 4.48Å; L62-L72 HydrophobicContact CD2-CD1 3.73Å; L62-F92 HydrophobicContact CD2-CZ 3.85Å; L62-W152 HydrophobicContact CD2-CH2 4.42Å; L62-W152 HydrophobicContact CD2-CZ2 4.32Å
63	Q	94.5	Very high	95	Very high	89 Å²	89	51.8 Å²	51.8	42%	0.416	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-42.6	-179.5	-70.3	-61.5	-41.7	0	0	111.5	S41 C73 Y75	S41-Q63 WeakPolarHBondContact CB-O 3.43Å; Q63-C73 PolarHBondContact N-O 2.72Å; Q63-Y75 HydrophobicContact CG-CD2 3.71Å; Q63-Y75 HydrophobicContact CG-CE2 3.49Å; Q63-Y75 VanDerWaalsContact CG-CE2 3.49Å
64	H	93.6	Very high	95.5	Very high	91 Å²	91	48.6 Å²	48.6	42%	0.421	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	135.7	-178.9	-175.7	66.5	0	0	0	109.6	S41 T66 L72 C73	S41-H64 WeakPolarHBondContact OG-CA 3.43Å; H64-T66 PolarHBondContact CE1-OG1 3.37Å; H64-T66 VanDerWaalsContact CE1-OG1 3.27Å; H64-T66 PolarHBondContact NE2-OG1 2.88Å; H64-L72 CarbonylContact O-C 3.52Å; H64-L72 WeakPolarHBondContact O-CA 3.25Å; H64-L72 VanDerWaalsContact O-CB 3.27Å; H64-L72 WeakPolarHBondContact O-CB 3.36Å; H64-C73 PolarHBondContact N-O 3.13Å; H64-C73 PolarHBondContact O-N 3.09Å
65	V	94.1	Very high	95.8	Very high	23 Å²	23	48.5 Å²	48.5	14%	0.139	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	122.5	178.1	-176.3	0	0	0	0	108.9	L39 S41 L62 M67 L72	L39-V65 HydrophobicContact CD2-CG1 4.36Å; L39-V65 HydrophobicContact CG-CG1 4.35Å; S41-V65 PolarHBondContact OG-N 3.42Å; S41-V65 VanDerWaalsContact OG-N 3.15Å; L62-V65 HydrophobicContact CB-CG2 4.1Å; L62-V65 HydrophobicContact CD1-CG2 3.96Å; V65-M67 HydrophobicContact CG1-SD 4.41Å; V65-L72 HydrophobicContact CB-CB 4.37Å; V65-L72 HydrophobicContact CG1-CB 4.39Å; V65-L72 HydrophobicContact CG2-CB 4.04Å
66	T	93.8	Very high	95.9	Very high	31 Å²	31	45.4 Å²	45.4	19%	0.19	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	101.7	178.5	-60.3	0	0	0	0	109.8	H64 E68 D69 S70 Y71	H64-T66 PolarHBondContact CE1-OG1 3.37Å; H64-T66 VanDerWaalsContact CE1-OG1 3.27Å; H64-T66 PolarHBondContact NE2-OG1 2.88Å; T66-E68 VanDerWaalsContact C-N 3.29Å; T66-E68 HydrophobicContact CG2-CB 4.25Å; T66-E68 PolarHBondContact O-N 2.84Å; T66-D69 HydrophobicContact CG2-CB 3.91Å; T66-D69 PolarHBondContact O-N 3.41Å; T66-S70 PolarHBondContact O-N 2.92Å; T66-S70 VanDerWaalsContact O-N 3.09Å; T66-Y71 PolarHBondContact N-O 3.17Å; T66-Y71 PolarHBondContact O-N 2.55Å
67	M	90.5	Very high	96	Very high	97 Å²	97	46.3 Å²	46.3	48%	0.478	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-34.6	-179.1	-60.7	-60.7	-73.3	0	0	112.2	L39 V65 S70 I96 I148	L39-M67 HydrophobicContact CD2-SD 4.48Å; V65-M67 HydrophobicContact CG1-SD 4.41Å; M67-S70 PolarHBondContact O-N 2.84Å; M67-S70 VanDerWaalsContact O-N 3.13Å; M67-I96 HydrophobicContact CE-CD1 4.46Å; M67-I96 HydrophobicContact SD-CD1 3.58Å; M67-I96 VanDerWaalsContact SD-CD1 3.58Å; M67-I148 HydrophobicContact CE-CD1 4.03Å
68	E	91.3	Very high	95.9	Very high	158 Å²	158	43 Å²	43	74%	0.738	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-44.5	178.5	-178.4	172.9	-172.3	0	0	112.1	T66 S70 K100	T66-E68 VanDerWaalsContact C-N 3.29Å; T66-E68 HydrophobicContact CG2-CB 4.25Å; T66-E68 PolarHBondContact O-N 2.84Å; E68-S70 PolarHBondContact O-N 3.05Å; E68-K100 PolarHBondContact O-NZ 3.32Å
69	D	93.9	Very high	95.8	Very high	92 Å²	92	47.4 Å²	47.4	49%	0.492	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-3.3	177	-69.7	-34.5	0	0	0	113.2	T66 Y71 K100	T66-D69 HydrophobicContact CG2-CB 3.91Å; T66-D69 PolarHBondContact O-N 3.41Å; D69-Y71 PolarHBondContact O-N 2.99Å; D69-K100 IonicContact OD1-NZ 2.75Å
70	S	96.6	Very high	95.3	Very high	8 Å²	8	48.2 Å²	48.2	6%	0.056	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	43.3	-175.4	-53.9	0	0	0	0	111.2	T66 M67 E68 I96 S98	T66-S70 PolarHBondContact O-N 2.92Å; T66-S70 VanDerWaalsContact O-N 3.09Å; M67-S70 PolarHBondContact O-N 2.84Å; M67-S70 VanDerWaalsContact O-N 3.13Å; E68-S70 PolarHBondContact O-N 3.05Å; S70-I96 WeakPolarHBondContact CB-O 3.38Å; S70-I96 PolarHBondContact O-N 3.17Å; S70-S98 WeakPolarHBondContact CB-OG 3.28Å; S70-S98 VanDerWaalsContact OG-CB 3.32Å; S70-S98 WeakPolarHBondContact OG-CB 3.22Å; S70-S98 PolarHBondContact OG-OG 3.38Å
71	Y	97.3	Very high	94.8	Very high	85 Å²	85	50.3 Å²	50.3	33%	0.333	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.3	-171.5	179	-98.8	0	0	0	111.1	T66 D69 C73 A93 G94	T66-Y71 PolarHBondContact N-O 3.17Å; T66-Y71 PolarHBondContact O-N 2.55Å; D69-Y71 PolarHBondContact O-N 2.99Å; Y71-C73 HydrophobicContact CE1-CB 4.1Å; Y71-C73 WeakPolarHBondContact OH-CB 3.26Å; Y71-A93 HydrophobicContact CE2-CB 4.08Å; Y71-G94 WeakPolarHBondContact CA-O 3.46Å; Y71-G94 WeakPolarHBondContact CD2-O 3.48Å
72	L	97.8	Very high	94.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	166.5	160.1	64.5	125.6	0	0	0	110.3	L62 H64 V65 F92 G94 I96 M150 W152	L62-L72 HydrophobicContact CD1-CD1 4.48Å; L62-L72 HydrophobicContact CD2-CD1 3.73Å; H64-L72 CarbonylContact O-C 3.52Å; H64-L72 WeakPolarHBondContact O-CA 3.25Å; H64-L72 VanDerWaalsContact O-CB 3.27Å; H64-L72 WeakPolarHBondContact O-CB 3.36Å; V65-L72 HydrophobicContact CB-CB 4.37Å; V65-L72 HydrophobicContact CG1-CB 4.39Å; V65-L72 HydrophobicContact CG2-CB 4.04Å; L72-F92 HydrophobicContact CD1-CE2 3.74Å; L72-F92 HydrophobicContact CD1-CZ 4.26Å; L72-G94 PolarHBondContact N-O 2.83Å; L72-G94 VanDerWaalsContact N-O 3.09Å; L72-G94 WeakPolarHBondContact O-CA 3.26Å; L72-G94 PolarHBondContact O-N 3.01Å; L72-I96 HydrophobicContact CD2-CD1 4.05Å; L72-I96 HydrophobicContact CD2-CG1 3.64Å; L72-M150 HydrophobicContact CD2-CG 4.24Å; L72-M150 HydrophobicContact CD2-SD 3.29Å; L72-M150 WeakPolarHBondContact CD2-SD 3.29Å; L72-W152 HydrophobicContact CD1-CZ2 4.24Å
73	C	98	Very high	93.6	Very high	13 Å²	13	59.4 Å²	59.4	9%	0.088	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	164.2	167.7	67.4	0	0	0	0	110.9	Q63 H64 Y71 F91 F92	Q63-C73 PolarHBondContact N-O 2.72Å; H64-C73 PolarHBondContact N-O 3.13Å; H64-C73 PolarHBondContact O-N 3.09Å; Y71-C73 HydrophobicContact CE1-CB 4.1Å; Y71-C73 WeakPolarHBondContact OH-CB 3.26Å; C73-F91 HydrophobicContact CB-CE2 3.77Å; C73-F91 HydrophobicContact CB-CZ 3.55Å; C73-F92 VanDerWaalsContact CA-O 3.25Å; C73-F92 WeakPolarHBondContact CA-O 3.34Å; C73-F92 VanDerWaalsContact CB-O 3.26Å; C73-F92 WeakPolarHBondContact CB-O 3.49Å
74	G	97.8	Very high	93	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	-174.6	-177.7	0	0	0	0	0	113.2	V61 F91 F92	V61-G74 CarbonylContact O-C 3.58Å; V61-G74 WeakPolarHBondContact O-CA 3.26Å; G74-F91 WeakPolarHBondContact O-CA 3.1Å; G74-F91 WeakPolarHBondContact O-CD2 3.46Å; G74-F92 VanDerWaalsContact C-CD1 3.49Å; G74-F92 PolarHBondContact N-O 3.06Å; G74-F92 VanDerWaalsContact N-O 3.12Å; G74-F92 VanDerWaalsContact O-CD1 3.26Å; G74-F92 WeakPolarHBondContact O-CD1 3.22Å; G74-F92 PolarHBondContact O-N 3.41Å
75	Y	97.8	Very high	92.5	Very high	84 Å²	84	61 Å²	61	33%	0.329	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.3	170.9	-59.6	-68.7	0	0	0	109.8	V60 V61 Q63 T89 T90 F91 V158	V60-Y75 VanDerWaalsContact CA-O 3.29Å; V60-Y75 WeakPolarHBondContact CA-O 3.3Å; V61-Y75 PolarHBondContact N-O 3.12Å; V61-Y75 PolarHBondContact O-N 2.93Å; Q63-Y75 HydrophobicContact CG-CD2 3.71Å; Q63-Y75 HydrophobicContact CG-CE2 3.49Å; Q63-Y75 VanDerWaalsContact CG-CE2 3.49Å; Y75-T89 HydrophobicContact CD1-CG2 4.44Å; Y75-T90 CarbonylContact C-O 3.33Å; Y75-T90 VanDerWaalsContact CA-O 3.29Å; Y75-T90 WeakPolarHBondContact CA-O 3.27Å; Y75-F91 HydrophobicContact CD1-CB 4.21Å; Y75-F91 HydrophobicContact CD1-CD2 4.23Å; Y75-F91 HydrophobicContact CE1-CB 4.09Å; Y75-F91 AromaticContact CE1-CD2 3.81Å; Y75-F91 HydrophobicContact CE1-CD2 3.81Å; Y75-F91 HydrophobicContact CE1-CG 4.44Å; Y75-V158 HydrophobicContact CD1-CG2 4.22Å; Y75-V158 HydrophobicContact CE1-CG2 3.92Å
76	L	98	Very high	92.2	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.6	169.2	-174.2	157.9	0	0	0	107.4	V58 V60 I78 T89 T90 F92 Y175	V58-L76 HydrophobicContact CG1-CD2 4.15Å; V58-L76 HydrophobicContact CG1-CG 4.05Å; V60-L76 HydrophobicContact CG2-CB 4.27Å; V60-L76 HydrophobicContact CG2-CD1 4.38Å; V60-L76 HydrophobicContact CG2-CG 4.04Å; L76-I78 HydrophobicContact CD2-CB 4.25Å; L76-T89 CarbonylContact O-C 3.6Å; L76-T89 VanDerWaalsContact O-CA 3.31Å; L76-T89 WeakPolarHBondContact O-CA 3.27Å; L76-T90 PolarHBondContact N-O 3.46Å; L76-T90 PolarHBondContact O-N 3Å; L76-T90 PolarHBondContact O-OG1 3.22Å; L76-F92 HydrophobicContact CB-CD1 4.09Å; L76-F92 HydrophobicContact CB-CE1 4.42Å; L76-Y175 HydrophobicContact CD1-CE2 4.09Å
77	K	97	Very high	92.1	Very high	56 Å²	56	65.8 Å²	65.8	24%	0.243	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122.7	177.3	177.4	177.1	62	-168.9	0	109.1	V58 E59 T87 L88 T89	V58-K77 CarbonylContact C-O 3.58Å; V58-K77 VanDerWaalsContact CA-O 3.26Å; V58-K77 WeakPolarHBondContact CA-O 3.21Å; E59-K77 HydrophobicContact CB-CB 4.47Å; E59-K77 PolarHBondContact N-O 3.1Å; E59-K77 PolarHBondContact O-N 3.08Å; E59-K77 VanDerWaalsContact OE1-CE 3.28Å; E59-K77 WeakPolarHBondContact OE1-CE 3.4Å; E59-K77 IonicContact OE1-NZ 2.67Å; E59-K77 PolarHBondContact OE1-NZ 3.36Å; E59-K77 IonicContact OE2-NZ 3.86Å; K77-T87 HydrophobicContact CD-CG2 3.74Å; K77-T87 HydrophobicContact CG-CG2 3.56Å; K77-L88 CarbonylContact C-O 3.54Å; K77-L88 VanDerWaalsContact CA-O 3.3Å; K77-L88 WeakPolarHBondContact CA-O 3.39Å; K77-T89 HydrophobicContact CB-CG2 4.39Å
78	I	95.5	Very high	92.2	Very high	10 Å²	10	61.8 Å²	61.8	5%	0.051	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.2	177.7	-172.1	164.4	0	0	0	110.3	Q49 Y56 D57 V58 L76 L81 T87 L88	Q49-I78 HydrophobicContact CB-CD1 4.27Å; Y56-I78 HydrophobicContact CD2-CD1 4.27Å; Y56-I78 HydrophobicContact CG-CD1 4.12Å; Y56-I78 HydrophobicContact CG-CG1 4.37Å; D57-I78 WeakPolarHBondContact O-CA 3.21Å; V58-I78 HydrophobicContact CG2-CB 4.2Å; V58-I78 HydrophobicContact CG2-CD1 4.09Å; V58-I78 HydrophobicContact CG2-CG1 3.92Å; L76-I78 HydrophobicContact CD2-CB 4.25Å; I78-L81 HydrophobicContact CD1-CB 4.46Å; I78-L81 HydrophobicContact CD1-CD1 4.16Å; I78-L81 HydrophobicContact CD1-CD2 4.32Å; I78-L81 HydrophobicContact CG1-CB 4.43Å; I78-L81 HydrophobicContact CG2-CB 4.37Å; I78-L81 HydrophobicContact CG2-CD2 4.16Å; I78-T87 WeakPolarHBondContact O-CA 3.36Å; I78-L88 HydrophobicContact CG2-CB 3.84Å; I78-L88 PolarHBondContact N-O 3.13Å; I78-L88 PolarHBondContact O-N 3.09Å
79	K	94.9	Very high	92.4	Very high	98 Å²	98	55.9 Å²	55.9	43%	0.426	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	141.6	-180	-57.8	-177.2	-176.2	172.8	0	111.9	D57 L81 P86	D57-K79 HydrophobicContact CB-CB 4.23Å; D57-K79 HydrophobicContact CB-CD 4.16Å; D57-K79 HydrophobicContact CB-CG 4.38Å; D57-K79 PolarHBondContact O-N 3.25Å; K79-L81 VanDerWaalsContact C-N 3.3Å; K79-L81 PolarHBondContact O-N 3.15Å; K79-P86 WeakPolarHBondContact CA-O 3.48Å
80	G	89.1	Confident	92.5	Very high	47 Å²	47	51.7 Å²	51.7	49%	0.485	26%	0.263	S	S	.	.	S	Bend	trans	72.7	16.9	172.3	0	0	0	0	0	115	Y56 T82 P86	Y56-G80 WeakPolarHBondContact CD1-O 3.38Å; Y56-G80 WeakPolarHBondContact CE1-O 3.46Å; G80-T82 VanDerWaalsContact C-N 3.33Å; G80-P86 PolarHBondContact N-O 3.3Å
81	L	86.9	Confident	92.6	Very high	44 Å²	44	53.1 Å²	53.1	23%	0.23	27%	0.268	C	S	.	.	S	Bend	trans	-68.7	-33.6	179.6	-170.6	64.3	0	0	0	112.3	Y56 I78 K79 L88 A169	Y56-L81 HydrophobicContact CD1-CD1 4.41Å; Y56-L81 HydrophobicContact CD2-CD1 4.08Å; Y56-L81 HydrophobicContact CE1-CD1 4.12Å; Y56-L81 HydrophobicContact CE2-CD1 3.75Å; Y56-L81 HydrophobicContact CG-CD1 4.38Å; I78-L81 HydrophobicContact CD1-CB 4.46Å; I78-L81 HydrophobicContact CD1-CD1 4.16Å; I78-L81 HydrophobicContact CD1-CD2 4.32Å; I78-L81 HydrophobicContact CG1-CB 4.43Å; I78-L81 HydrophobicContact CG2-CB 4.37Å; I78-L81 HydrophobicContact CG2-CD2 4.16Å; K79-L81 VanDerWaalsContact C-N 3.3Å; K79-L81 PolarHBondContact O-N 3.15Å; L81-L88 HydrophobicContact CB-CD1 4.21Å; L81-L88 HydrophobicContact CD2-CD1 3.92Å; L81-A169 HydrophobicContact CD2-CB 3.55Å; L81-A169 HydrophobicContact CG-CB 4.03Å
82	T	84.7	Confident	92.6	Very high	18 Å²	18	49.1 Å²	49.1	11%	0.11	25%	0.253	C	S	.	.			trans	-136.7	154.1	178.7	70.6	0	0	0	0	109.8	G80 Y85 L88 I166 S167 A169	G80-T82 VanDerWaalsContact C-N 3.33Å; T82-Y85 CarbonylContact O-C 3.47Å; T82-Y85 WeakPolarHBondContact OG1-CA 3.45Å; T82-Y85 WeakPolarHBondContact OG1-CB 3.2Å; T82-Y85 PolarHBondContact OG1-N 2.65Å; T82-Y85 PolarHBondContact OG1-O 3.04Å; T82-L88 HydrophobicContact CG2-CD1 4.35Å; T82-I166 HydrophobicContact CG2-CG2 3.9Å; T82-S167 WeakPolarHBondContact CG2-O 3.16Å; T82-A169 HydrophobicContact CG2-CB 3.79Å
83	E	81.8	Confident	92.6	Very high	202 Å²	202	50.2 Å²	50.2	94%	0.944	26%	0.261	S	S	*	.	S	Bend	trans	-69.7	-36.3	175.6	-65.9	-175.6	174	0	0	112.1
84	E	82.9	Confident	92.7	Very high	128 Å²	128	49.6 Å²	49.6	60%	0.598	26%	0.258	S	S	*	.	S	Bend	trans	-71.1	-42.2	-177.9	-169.8	-175.9	164.3	0	0	112.1	P86	E84-P86 WeakPolarHBondContact O-CD 3.12Å
85	Y	82.4	Confident	92.7	Very high	85 Å²	85	50.6 Å²	50.6	33%	0.333	26%	0.262	S	S	.	.			trans	-115.6	92.7	178.6	-58.2	-81.6	0	0	0	109.7	T82 T87 L88 I166	T82-Y85 CarbonylContact O-C 3.47Å; T82-Y85 WeakPolarHBondContact OG1-CA 3.45Å; T82-Y85 WeakPolarHBondContact OG1-CB 3.2Å; T82-Y85 PolarHBondContact OG1-N 2.65Å; T82-Y85 PolarHBondContact OG1-O 3.04Å; Y85-T87 PolarHBondContact O-N 2.77Å; Y85-T87 VanDerWaalsContact O-N 3.13Å; Y85-L88 VanDerWaalsContact CB-CD2 3.46Å; Y85-L88 HydrophobicContact CD2-CD2 4.47Å; Y85-L88 HydrophobicContact CG-CD2 3.91Å; Y85-I166 HydrophobicContact CD2-CG2 4.09Å
86	P	88.4	Confident	92.7	Very high	89 Å²	89	47 Å²	47	58%	0.578	25%	0.248	S	C	*	.	S	Bend	trans	-65.8	-17.9	-177.4	26.4	-35.4	0	0	0	112.6	K79 G80 E84	K79-P86 WeakPolarHBondContact CA-O 3.48Å; G80-P86 PolarHBondContact N-O 3.3Å; E84-P86 WeakPolarHBondContact O-CD 3.12Å
87	T	91.9	Very high	92.7	Very high	66 Å²	66	47.3 Å²	47.3	41%	0.405	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	124.9	172.5	-62	0	0	0	0	109	K77 I78 Y85	K77-T87 HydrophobicContact CD-CG2 3.74Å; K77-T87 HydrophobicContact CG-CG2 3.56Å; I78-T87 WeakPolarHBondContact O-CA 3.36Å; Y85-T87 PolarHBondContact O-N 2.77Å; Y85-T87 VanDerWaalsContact O-N 3.13Å
88	L	92.9	Very high	92.7	Very high	13 Å²	13	45.7 Å²	45.7	7%	0.068	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	135.1	174.1	-69.7	169.3	0	0	0	108.4	K77 I78 L81 T82 Y85 L157 I166 A169	K77-L88 CarbonylContact C-O 3.54Å; K77-L88 VanDerWaalsContact CA-O 3.3Å; K77-L88 WeakPolarHBondContact CA-O 3.39Å; I78-L88 HydrophobicContact CG2-CB 3.84Å; I78-L88 PolarHBondContact N-O 3.13Å; I78-L88 PolarHBondContact O-N 3.09Å; L81-L88 HydrophobicContact CB-CD1 4.21Å; L81-L88 HydrophobicContact CD2-CD1 3.92Å; T82-L88 HydrophobicContact CG2-CD1 4.35Å; Y85-L88 VanDerWaalsContact CB-CD2 3.46Å; Y85-L88 HydrophobicContact CD2-CD2 4.47Å; Y85-L88 HydrophobicContact CG-CD2 3.91Å; L88-L157 HydrophobicContact CB-CD2 4.49Å; L88-L157 HydrophobicContact CD2-CD2 4.06Å; L88-I166 HydrophobicContact CD1-CD1 3.87Å; L88-I166 HydrophobicContact CD2-CD1 3.64Å; L88-I166 HydrophobicContact CG-CD1 4.38Å; L88-A169 HydrophobicContact CD1-CB 4.4Å
89	T	95.6	Very high	92.6	Very high	33 Å²	33	54 Å²	54	20%	0.202	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126	175.1	-55.4	0	0	0	0	109	Y75 L76 K77 L157 V158	Y75-T89 HydrophobicContact CD1-CG2 4.44Å; L76-T89 CarbonylContact O-C 3.6Å; L76-T89 VanDerWaalsContact O-CA 3.31Å; L76-T89 WeakPolarHBondContact O-CA 3.27Å; K77-T89 HydrophobicContact CB-CG2 4.39Å; T89-L157 CarbonylContact O-C 3.53Å; T89-L157 WeakPolarHBondContact O-CA 3.43Å; T89-V158 HydrophobicContact CG2-CB 4.49Å; T89-V158 PolarHBondContact O-N 2.62Å
90	T	96.1	Very high	92.6	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.031	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	145	177.3	51.3	0	0	0	0	110.2	Y75 L76 E154 F156 L157 F171	Y75-T90 CarbonylContact C-O 3.33Å; Y75-T90 VanDerWaalsContact CA-O 3.29Å; Y75-T90 WeakPolarHBondContact CA-O 3.27Å; L76-T90 PolarHBondContact N-O 3.46Å; L76-T90 PolarHBondContact O-N 3Å; L76-T90 PolarHBondContact O-OG1 3.22Å; T90-E154 VanDerWaalsContact CB-OE1 3.29Å; T90-E154 WeakPolarHBondContact CB-OE1 3.43Å; T90-E154 VanDerWaalsContact CG2-OE1 3.29Å; T90-E154 WeakPolarHBondContact CG2-OE1 3.27Å; T90-E154 PolarHBondContact OG1-OE1 3Å; T90-F156 CarbonylContact C-O 3.55Å; T90-F156 VanDerWaalsContact CA-O 3.31Å; T90-F156 WeakPolarHBondContact CA-O 3.43Å; T90-L157 HydrophobicContact CG2-CD2 3.65Å; T90-L157 HydrophobicContact CG2-CG 4.31Å; T90-F171 HydrophobicContact CG2-CB 4.38Å; T90-F171 HydrophobicContact CG2-CD1 4.37Å; T90-F171 HydrophobicContact CG2-CG 4.31Å
91	F	97.3	Very high	93	Very high	38 Å²	38	58.3 Å²	58.3	17%	0.167	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	134.2	163.4	176.1	-98.4	0	0	0	108.9	C73 G74 Y75 E154 Q155 F156 V158	C73-F91 HydrophobicContact CB-CE2 3.77Å; C73-F91 HydrophobicContact CB-CZ 3.55Å; G74-F91 WeakPolarHBondContact O-CA 3.1Å; G74-F91 WeakPolarHBondContact O-CD2 3.46Å; Y75-F91 HydrophobicContact CD1-CB 4.21Å; Y75-F91 HydrophobicContact CD1-CD2 4.23Å; Y75-F91 HydrophobicContact CE1-CB 4.09Å; Y75-F91 AromaticContact CE1-CD2 3.81Å; Y75-F91 HydrophobicContact CE1-CD2 3.81Å; Y75-F91 HydrophobicContact CE1-CG 4.44Å; F91-E154 WeakPolarHBondContact O-CA 3.37Å; F91-Q155 HydrophobicContact CD1-CB 4.19Å; F91-Q155 HydrophobicContact CD1-CG 4.14Å; F91-Q155 HydrophobicContact CE1-CG 4.42Å; F91-Q155 PolarHBondContact O-N 3.31Å; F91-F156 HydrophobicContact CB-CD2 4.05Å; F91-F156 HydrophobicContact CB-CE1 4.38Å; F91-F156 HydrophobicContact CB-CE2 3.57Å; F91-F156 HydrophobicContact CB-CZ 3.75Å; F91-F156 AromaticContact CD1-CE1 3.75Å; F91-F156 HydrophobicContact CD1-CE1 3.75Å; F91-F156 HydrophobicContact CD1-CE2 4.33Å; F91-F156 AromaticContact CD1-CZ 3.61Å; F91-F156 HydrophobicContact CD1-CZ 3.61Å; F91-F156 HydrophobicContact CE1-CE1 4.47Å; F91-F156 HydrophobicContact CE1-CZ 4.41Å; F91-F156 HydrophobicContact CG-CE1 4.35Å; F91-F156 HydrophobicContact CG-CE2 4.11Å; F91-F156 AromaticContact CG-CZ 3.79Å; F91-F156 HydrophobicContact CG-CZ 3.79Å; F91-F156 PolarHBondContact N-O 3.4Å; F91-V158 HydrophobicContact CB-CG2 4.28Å
92	F	98.2	Very high	93.5	Very high	1 Å²	1	58.3 Å²	58.3	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.2	174.7	73.2	-91.7	0	0	0	112	V60 L62 L72 C73 G74 L76 W152 K153 E154	V60-F92 HydrophobicContact CG1-CE1 3.96Å; V60-F92 HydrophobicContact CG1-CZ 4.03Å; L62-F92 HydrophobicContact CD2-CZ 3.85Å; L72-F92 HydrophobicContact CD1-CE2 3.74Å; L72-F92 HydrophobicContact CD1-CZ 4.26Å; C73-F92 VanDerWaalsContact CA-O 3.25Å; C73-F92 WeakPolarHBondContact CA-O 3.34Å; C73-F92 VanDerWaalsContact CB-O 3.26Å; C73-F92 WeakPolarHBondContact CB-O 3.49Å; G74-F92 VanDerWaalsContact C-CD1 3.49Å; G74-F92 PolarHBondContact N-O 3.06Å; G74-F92 VanDerWaalsContact N-O 3.12Å; G74-F92 VanDerWaalsContact O-CD1 3.26Å; G74-F92 WeakPolarHBondContact O-CD1 3.22Å; G74-F92 PolarHBondContact O-N 3.41Å; L76-F92 HydrophobicContact CB-CD1 4.09Å; L76-F92 HydrophobicContact CB-CE1 4.42Å; F92-W152 HydrophobicContact CD2-CB 3.82Å; F92-W152 AromaticContact CD2-CD2 3.98Å; F92-W152 HydrophobicContact CD2-CD2 3.98Å; F92-W152 HydrophobicContact CD2-CE3 4.32Å; F92-W152 AromaticContact CD2-CG 3.77Å; F92-W152 HydrophobicContact CD2-CG 3.77Å; F92-W152 HydrophobicContact CE1-CE3 4.37Å; F92-W152 HydrophobicContact CE1-CZ3 4.49Å; F92-W152 HydrophobicContact CE2-CB 4.26Å; F92-W152 AromaticContact CE2-CD2 3.51Å; F92-W152 HydrophobicContact CE2-CD2 3.51Å; F92-W152 AromaticContact CE2-CE2 3.78Å; F92-W152 AromaticContact CE2-CE3 3.87Å; F92-W152 HydrophobicContact CE2-CE3 3.87Å; F92-W152 AromaticContact CE2-CG 3.7Å; F92-W152 HydrophobicContact CE2-CG 3.7Å; F92-W152 HydrophobicContact CE2-CZ2 4.32Å; F92-W152 HydrophobicContact CE2-CZ3 4.41Å; F92-W152 HydrophobicContact CG-CB 4.45Å; F92-W152 AromaticContact CZ-CD2 3.97Å; F92-W152 HydrophobicContact CZ-CD2 3.97Å; F92-W152 AromaticContact CZ-CE3 3.89Å; F92-W152 HydrophobicContact CZ-CE3 3.89Å; F92-W152 HydrophobicContact CZ-CH2 4.2Å; F92-W152 HydrophobicContact CZ-CZ2 4.3Å; F92-W152 HydrophobicContact CZ-CZ3 4.02Å; F92-K153 WeakPolarHBondContact CA-O 3.36Å; F92-E154 HydrophobicContact CB-CG 4.19Å
93	A	98.3	Very high	94.1	Very high	22 Å²	22	57.5 Å²	57.5	18%	0.182	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.1	166.6	0	0	0	0	0	108.8	Y71 K153 Q155	Y71-A93 HydrophobicContact CE2-CB 4.08Å; A93-K153 PolarHBondContact N-O 2.86Å; A93-K153 PolarHBondContact O-N 2.96Å; A93-Q155 HydrophobicContact CB-CG 4.44Å
94	G	98.3	Very high	94.9	Very high	1 Å²	1	49 Å²	49	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.6	-177.6	0	0	0	0	0	112.5	Y71 L72 R151	Y71-G94 WeakPolarHBondContact CA-O 3.46Å; Y71-G94 WeakPolarHBondContact CD2-O 3.48Å; L72-G94 PolarHBondContact N-O 2.83Å; L72-G94 VanDerWaalsContact N-O 3.09Å; L72-G94 WeakPolarHBondContact O-CA 3.26Å; L72-G94 PolarHBondContact O-N 3.01Å; G94-R151 CarbonylContact C-O 3.56Å; G94-R151 WeakPolarHBondContact CA-O 3.29Å
95	E	98.4	Very high	95.6	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.098	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.1	170.4	-62.1	-175.3	147.1	0	0	109.2	R101 K107 M150 R151	E95-R101 HydrophobicContact CB-CB 4.37Å; E95-R101 HydrophobicContact CB-CG 4.18Å; E95-R101 HydrophobicContact CG-CG 4.47Å; E95-R101 WeakPolarHBondContact OE1-CD 3.46Å; E95-R101 IonicContact OE1-CZ 2.72Å; E95-R101 IonicContact OE1-NE 3.59Å; E95-R101 PolarHBondContact OE1-NE 2.84Å; E95-R101 IonicContact OE1-NH1 3.28Å; E95-R101 PolarHBondContact OE1-NH1 2.92Å; E95-K107 IonicContact OE1-NZ 2.6Å; E95-K107 PolarHBondContact OE1-NZ 2.85Å; E95-K107 IonicContact OE2-NZ 3.02Å; E95-K107 PolarHBondContact OE2-NZ 3.35Å; E95-M150 CarbonylContact O-C 3.5Å; E95-M150 WeakPolarHBondContact O-CA 3.38Å; E95-M150 WeakPolarHBondContact O-CB 3.21Å; E95-R151 PolarHBondContact N-O 3.39Å; E95-R151 PolarHBondContact O-N 2.89Å; E95-R151 IonicContact OE2-CZ 3.82Å; E95-R151 IonicContact OE2-NE 3.32Å; E95-R151 PolarHBondContact OE2-NE 2.88Å; E95-R151 IonicContact OE2-NH2 3.44Å; E95-R151 PolarHBondContact OE2-NH2 3.09Å
96	I	98.4	Very high	96.3	Very high	8 Å²	8	48.3 Å²	48.3	4%	0.041	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	131.5	171.7	-58.9	166.2	0	0	0	107.9	M67 S70 L72 S98 R101 I148 M150	M67-I96 HydrophobicContact CE-CD1 4.46Å; M67-I96 HydrophobicContact SD-CD1 3.58Å; M67-I96 VanDerWaalsContact SD-CD1 3.58Å; S70-I96 WeakPolarHBondContact CB-O 3.38Å; S70-I96 PolarHBondContact O-N 3.17Å; L72-I96 HydrophobicContact CD2-CD1 4.05Å; L72-I96 HydrophobicContact CD2-CG1 3.64Å; I96-S98 PolarHBondContact O-N 2.95Å; I96-R101 WeakPolarHBondContact O-CB 3.49Å; I96-I148 HydrophobicContact CG2-CG2 3.71Å; I96-M150 HydrophobicContact CB-CG 4.46Å; I96-M150 HydrophobicContact CG1-CG 4.06Å; I96-M150 HydrophobicContact CG1-SD 4.3Å
97	I	98.1	Very high	96.7	Very high	9 Å²	9	47.4 Å²	47.4	5%	0.046	22%	0.217	C	C	.	.			trans	-65.5	123.5	179.3	-57.5	-51.9	0	0	0	109.7	R101 F103 W119 Y139 L142 F149	I97-R101 WeakPolarHBondContact CA-O 3.18Å; I97-F103 HydrophobicContact CB-CE1 4.48Å; I97-F103 HydrophobicContact CG1-CD1 4.29Å; I97-F103 HydrophobicContact CG1-CE1 4.25Å; I97-F103 HydrophobicContact CG2-CD1 3.94Å; I97-F103 HydrophobicContact CG2-CD2 3.77Å; I97-F103 HydrophobicContact CG2-CE1 3.95Å; I97-F103 HydrophobicContact CG2-CE2 3.77Å; I97-F103 HydrophobicContact CG2-CG 3.86Å; I97-F103 HydrophobicContact CG2-CZ 3.86Å; I97-W119 HydrophobicContact CD1-CH2 4.12Å; I97-W119 HydrophobicContact CD1-CZ2 3.85Å; I97-W119 HydrophobicContact CG1-CH2 3.98Å; I97-W119 HydrophobicContact CG1-CZ2 4.08Å; I97-Y139 HydrophobicContact CG2-CE1 4.22Å; I97-L142 HydrophobicContact CB-CD2 4.43Å; I97-L142 HydrophobicContact CG2-CD2 3.97Å; I97-F149 HydrophobicContact CB-CB 3.94Å; I97-F149 HydrophobicContact CG1-CB 3.51Å; I97-F149 WeakPolarHBondContact CG1-O 3.29Å; I97-F149 PolarHBondContact N-O 2.95Å
98	S	96.3	Very high	97	Very high	21 Å²	21	47.9 Å²	47.9	15%	0.147	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-161	179.9	-177	76.3	0	0	0	0	110.2	S70 I96 K100 R101 Y139	S70-S98 WeakPolarHBondContact CB-OG 3.28Å; S70-S98 VanDerWaalsContact OG-CB 3.32Å; S70-S98 WeakPolarHBondContact OG-CB 3.22Å; S70-S98 PolarHBondContact OG-OG 3.38Å; I96-S98 PolarHBondContact O-N 2.95Å; S98-K100 PolarHBondContact O-N 3.44Å; S98-K100 PolarHBondContact OG-N 3.02Å; S98-K100 VanDerWaalsContact OG-N 3.16Å; S98-R101 PolarHBondContact N-O 2.83Å; S98-R101 CarbonylContact O-C 3.58Å; S98-R101 PolarHBondContact O-N 2.6Å; S98-R101 PolarHBondContact OG-N 3.44Å; S98-Y139 VanDerWaalsContact C-CE1 3.4Å; S98-Y139 WeakPolarHBondContact O-CE1 3.32Å
99	R	94.4	Very high	97.1	Very high	185 Å²	185	51.5 Å²	51.5	70%	0.698	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-32	171.9	-171.4	-179.9	-72.1	-109.9	-0.5	112.8	Y139	R99-Y139 HydrophobicContact CB-CD2 3.99Å; R99-Y139 HydrophobicContact CB-CE2 4.47Å; R99-Y139 HydrophobicContact CB-CG 4.25Å; R99-Y139 HydrophobicContact CG-CD2 4.48Å
100	K	95.2	Very high	97.2	Very high	126 Å²	126	50.1 Å²	50.1	55%	0.548	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-29.3	175.7	-67.2	179.3	178	174.7	0	112.1	E68 D69 S98	E68-K100 PolarHBondContact O-NZ 3.32Å; D69-K100 IonicContact OD1-NZ 2.75Å; S98-K100 PolarHBondContact O-N 3.44Å; S98-K100 PolarHBondContact OG-N 3.02Å; S98-K100 VanDerWaalsContact OG-N 3.16Å
101	R	96.6	Very high	97.3	Very high	110 Å²	110	54.4 Å²	54.4	42%	0.415	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-135.5	80.4	-173.8	-59	-63.4	-174.5	-171	-0.4	109.3	E95 I96 I97 S98	E95-R101 HydrophobicContact CB-CB 4.37Å; E95-R101 HydrophobicContact CB-CG 4.18Å; E95-R101 HydrophobicContact CG-CG 4.47Å; E95-R101 WeakPolarHBondContact OE1-CD 3.46Å; E95-R101 IonicContact OE1-CZ 2.72Å; E95-R101 IonicContact OE1-NE 3.59Å; E95-R101 PolarHBondContact OE1-NE 2.84Å; E95-R101 IonicContact OE1-NH1 3.28Å; E95-R101 PolarHBondContact OE1-NH1 2.92Å; I96-R101 WeakPolarHBondContact O-CB 3.49Å; I97-R101 WeakPolarHBondContact CA-O 3.18Å; S98-R101 PolarHBondContact N-O 2.83Å; S98-R101 CarbonylContact O-C 3.58Å; S98-R101 PolarHBondContact O-N 2.6Å; S98-R101 PolarHBondContact OG-N 3.44Å
102	P	97.4	Very high	97.3	Very high	44 Å²	44	56.5 Å²	56.5	29%	0.286	26%	0.256	S	S	.	.			trans	-60	169.4	-174.6	-23	33.3	0	0	0	113.7	L104 Y139 R151	P102-L104 VanDerWaalsContact C-N 3.28Å; P102-L104 PolarHBondContact O-N 2.87Å; P102-Y139 WeakPolarHBondContact CA-OH 3.45Å; P102-Y139 WeakPolarHBondContact CB-OH 3.36Å; P102-R151 VanDerWaalsContact O-CZ 3.29Å; P102-R151 PolarHBondContact O-NH1 2.97Å; P102-R151 PolarHBondContact O-NH2 3.43Å
103	F	97.9	Very high	97.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.275	C	S	.	.	S	Bend	trans	-61.4	-35.9	171.7	-82.9	-74	0	0	0	112.9	I97 T105 W119 F125 F132 F137 L142 F149 R151	I97-F103 HydrophobicContact CB-CE1 4.48Å; I97-F103 HydrophobicContact CG1-CD1 4.29Å; I97-F103 HydrophobicContact CG1-CE1 4.25Å; I97-F103 HydrophobicContact CG2-CD1 3.94Å; I97-F103 HydrophobicContact CG2-CD2 3.77Å; I97-F103 HydrophobicContact CG2-CE1 3.95Å; I97-F103 HydrophobicContact CG2-CE2 3.77Å; I97-F103 HydrophobicContact CG2-CG 3.86Å; I97-F103 HydrophobicContact CG2-CZ 3.86Å; F103-T105 PolarHBondContact O-N 2.91Å; F103-W119 AromaticContact CD1-CD2 3.9Å; F103-W119 HydrophobicContact CD1-CD2 3.9Å; F103-W119 AromaticContact CD1-CE2 3.68Å; F103-W119 HydrophobicContact CD1-CE3 4.47Å; F103-W119 HydrophobicContact CD1-CG 4.14Å; F103-W119 HydrophobicContact CD1-CZ2 4.1Å; F103-W119 AromaticContact CD1-NE1 3.77Å; F103-W119 HydrophobicContact CE1-CD2 4.24Å; F103-W119 HydrophobicContact CE1-CE3 4.4Å; F103-W119 PolarHBondContact O-NE1 3.43Å; F103-F125 HydrophobicContact CD1-CD2 4.27Å; F103-F125 AromaticContact CD1-CE2 3.64Å; F103-F125 HydrophobicContact CD1-CE2 3.64Å; F103-F125 HydrophobicContact CD2-CE2 4.4Å; F103-F125 AromaticContact CE1-CD2 3.74Å; F103-F125 HydrophobicContact CE1-CD2 3.74Å; F103-F125 AromaticContact CE1-CE2 3.54Å; F103-F125 HydrophobicContact CE1-CE2 3.54Å; F103-F125 HydrophobicContact CE2-CE2 4.31Å; F103-F125 HydrophobicContact CG-CE2 4.08Å; F103-F125 HydrophobicContact CZ-CD2 4.06Å; F103-F125 AromaticContact CZ-CE2 3.9Å; F103-F125 HydrophobicContact CZ-CE2 3.9Å; F103-F132 HydrophobicContact CB-CB 4.04Å; F103-F132 HydrophobicContact CB-CD2 3.65Å; F103-F132 HydrophobicContact CB-CG 4.31Å; F103-F132 HydrophobicContact CD2-CB 3.93Å; F103-F132 HydrophobicContact CG-CB 4.08Å; F103-F132 HydrophobicContact CG-CD2 4.48Å; F103-F137 HydrophobicContact CD2-CE1 4.32Å; F103-F137 HydrophobicContact CD2-CZ 4.27Å; F103-F137 AromaticContact CE2-CE1 3.86Å; F103-F137 HydrophobicContact CE2-CE1 3.86Å; F103-F137 HydrophobicContact CE2-CE2 4.37Å; F103-F137 AromaticContact CE2-CZ 3.65Å; F103-F137 HydrophobicContact CE2-CZ 3.65Å; F103-L142 HydrophobicContact CE2-CD2 3.9Å; F103-L142 HydrophobicContact CZ-CD1 4.21Å; F103-L142 HydrophobicContact CZ-CD2 4.03Å; F103-F149 HydrophobicContact CE1-CB 3.85Å; F103-F149 HydrophobicContact CE1-CD1 4.1Å; F103-F149 AromaticContact CE1-CD2 3.99Å; F103-F149 HydrophobicContact CE1-CD2 3.99Å; F103-F149 AromaticContact CE1-CG 3.7Å; F103-F149 HydrophobicContact CE1-CG 3.7Å; F103-F149 HydrophobicContact CZ-CB 4.3Å; F103-F149 AromaticContact CZ-CD2 3.76Å; F103-F149 HydrophobicContact CZ-CD2 3.76Å; F103-F149 HydrophobicContact CZ-CE2 4.21Å; F103-F149 AromaticContact CZ-CG 3.98Å; F103-F149 HydrophobicContact CZ-CG 3.98Å; F103-R151 PolarHBondContact O-NH1 3Å; F103-R151 VanDerWaalsContact O-NH1 3.14Å
104	L	97.8	Very high	97.2	Very high	23 Å²	23	59.4 Å²	59.4	12%	0.12	27%	0.268	C	S	.	.			trans	-67.2	117.1	172.9	-65.9	175.2	0	0	0	110.4	P102 R106 E112 D115 F132 N133	P102-L104 VanDerWaalsContact C-N 3.28Å; P102-L104 PolarHBondContact O-N 2.87Å; L104-R106 HydrophobicContact CB-CG 4.18Å; L104-E112 HydrophobicContact CD2-CB 4.02Å; L104-E112 HydrophobicContact CD2-CG 3.84Å; L104-D115 WeakPolarHBondContact CA-OD2 3.46Å; L104-F132 HydrophobicContact CD2-CD2 4.35Å; L104-F132 HydrophobicContact CD2-CE2 3.67Å; L104-F132 HydrophobicContact CG-CE2 4.38Å; L104-N133 HydrophobicContact CD1-CB 4.09Å; L104-N133 HydrophobicContact CD2-CB 4.25Å; L104-N133 HydrophobicContact CG-CB 4.34Å
105	T	97.8	Very high	97.2	Very high	9 Å²	9	59.4 Å²	59.4	6%	0.055	27%	0.268	C	S	.	.			trans	-74.4	-47.9	-172.8	-60.4	0	0	0	0	111.4	F103 K107 W108 A110 D115 R151 F174	F103-T105 PolarHBondContact O-N 2.91Å; T105-K107 HydrophobicContact CG2-CG 3.81Å; T105-K107 WeakPolarHBondContact CG2-O 3.21Å; T105-K107 WeakPolarHBondContact O-CG 3.43Å; T105-K107 PolarHBondContact O-N 3.13Å; T105-K107 VanDerWaalsContact O-N 3.13Å; T105-W108 HydrophobicContact CG2-CE3 3.82Å; T105-W108 HydrophobicContact CG2-CZ3 4.36Å; T105-A110 HydrophobicContact CG2-CB 4.13Å; T105-D115 WeakPolarHBondContact CB-OD1 3.43Å; T105-D115 PolarHBondContact N-OD2 3.4Å; T105-D115 PolarHBondContact OG1-OD1 2.83Å; T105-R151 WeakPolarHBondContact OG1-CD 3.45Å; T105-F174 HydrophobicContact CG2-CE2 4.4Å; T105-F174 HydrophobicContact CG2-CZ 3.98Å
106	R	97.2	Very high	97.2	Very high	190 Å²	190	62.9 Å²	62.9	72%	0.717	28%	0.28	S	S	*	.			trans	57.4	22.5	176.7	-54.2	179.8	178.4	169.9	-0.2	114.8	L104	L104-R106 HydrophobicContact CB-CG 4.18Å
107	K	97.2	Very high	97.2	Very high	71 Å²	71	66.6 Å²	66.6	31%	0.309	30%	0.296	S	S	.	.	S	Bend	trans	-159.7	178.9	177.9	62.4	-177.2	168.3	171.2	0	109.3	E95 T105 D109 A110	E95-K107 IonicContact OE1-NZ 2.6Å; E95-K107 PolarHBondContact OE1-NZ 2.85Å; E95-K107 IonicContact OE2-NZ 3.02Å; E95-K107 PolarHBondContact OE2-NZ 3.35Å; T105-K107 HydrophobicContact CG2-CG 3.81Å; T105-K107 WeakPolarHBondContact CG2-O 3.21Å; T105-K107 WeakPolarHBondContact O-CG 3.43Å; T105-K107 PolarHBondContact O-N 3.13Å; T105-K107 VanDerWaalsContact O-N 3.13Å; K107-D109 PolarHBondContact O-N 3.01Å; K107-A110 PolarHBondContact O-N 2.84Å; K107-A110 VanDerWaalsContact O-N 3.12Å
108	W	96.8	Very high	97.2	Very high	76 Å²	76	66.2 Å²	66.2	29%	0.288	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	37.1	176.4	-50.3	-39.7	0	0	0	113.3	T105 A110 R151 K153 F174	T105-W108 HydrophobicContact CG2-CE3 3.82Å; T105-W108 HydrophobicContact CG2-CZ3 4.36Å; W108-A110 PolarHBondContact O-N 3.05Å; W108-R151 HydrophobicContact CZ3-CB 4.01Å; W108-K153 HydrophobicContact CD2-CD 4.21Å; W108-K153 HydrophobicContact CG-CD 4.39Å; W108-K153 HydrophobicContact CH2-CB 3.91Å; W108-K153 HydrophobicContact CZ2-CB 3.76Å; W108-K153 HydrophobicContact CZ2-CD 4.37Å; W108-K153 HydrophobicContact CZ2-CG 3.96Å; W108-F174 HydrophobicContact CB-CD1 3.52Å; W108-F174 HydrophobicContact CB-CE1 3.57Å; W108-F174 HydrophobicContact CD2-CD1 4.13Å; W108-F174 HydrophobicContact CD2-CG 4.34Å; W108-F174 HydrophobicContact CE3-CB 4.1Å; W108-F174 AromaticContact CE3-CD1 3.71Å; W108-F174 HydrophobicContact CE3-CD1 3.71Å; W108-F174 AromaticContact CE3-CD2 3.89Å; W108-F174 HydrophobicContact CE3-CD2 3.89Å; W108-F174 HydrophobicContact CE3-CE1 4.01Å; W108-F174 HydrophobicContact CE3-CE2 4.2Å; W108-F174 AromaticContact CE3-CG 3.63Å; W108-F174 HydrophobicContact CE3-CG 3.63Å; W108-F174 HydrophobicContact CE3-CZ 4.25Å; W108-F174 HydrophobicContact CG-CD1 4.12Å; W108-F174 HydrophobicContact CG-CE1 4.45Å; W108-F174 HydrophobicContact CZ3-CB 4.44Å; W108-F174 HydrophobicContact CZ3-CD2 4.17Å; W108-F174 HydrophobicContact CZ3-CG 4.2Å
109	D	96.1	Very high	97.3	Very high	88 Å²	88	65.2 Å²	65.2	47%	0.471	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	11.2	179.9	-67.1	-52.8	0	0	0	116.1	K107 Y191 R193	K107-D109 PolarHBondContact O-N 3.01Å; D109-Y191 PolarHBondContact O-OH 2.75Å; D109-Y191 VanDerWaalsContact O-OH 3.11Å; D109-R193 VanDerWaalsContact CB-NH2 3.26Å; D109-R193 VanDerWaalsContact CG-NH2 3.26Å; D109-R193 IonicContact OD1-CZ 3.18Å; D109-R193 VanDerWaalsContact OD1-CZ 3.28Å; D109-R193 IonicContact OD1-NH1 3.44Å; D109-R193 IonicContact OD1-NH2 2.76Å; D109-R193 PolarHBondContact OD1-NH2 2.93Å
110	A	97.6	Very high	97.4	Very high	5 Å²	5	57.6 Å²	57.6	4%	0.041	27%	0.266	C	S	.	.			trans	-95.5	113.3	175.6	0	0	0	0	0	111.3	T105 K107 W108 V114 F174 Y176 Y191	T105-A110 HydrophobicContact CG2-CB 4.13Å; K107-A110 PolarHBondContact O-N 2.84Å; K107-A110 VanDerWaalsContact O-N 3.12Å; W108-A110 PolarHBondContact O-N 3.05Å; A110-V114 HydrophobicContact CB-CB 4.26Å; A110-V114 HydrophobicContact CB-CG1 3.83Å; A110-F174 HydrophobicContact CB-CE1 3.93Å; A110-F174 HydrophobicContact CB-CZ 3.68Å; A110-Y176 WeakPolarHBondContact CB-OH 3.41Å; A110-Y191 HydrophobicContact CB-CD1 4.41Å; A110-Y191 HydrophobicContact CB-CE1 4.1Å
111	D	97.3	Very high	97.5	Very high	94 Å²	94	56 Å²	56	50%	0.503	26%	0.259	S	S	.	.			trans	-90.3	-178.5	168.7	65.3	22.1	0	0	0	111.5	D113 V114 D115	D111-D113 VanDerWaalsContact C-N 3.27Å; D111-D113 PolarHBondContact O-N 3.12Å; D111-D113 PolarHBondContact OD1-N 3.03Å; D111-V114 PolarHBondContact O-N 3.29Å; D111-V114 WeakPolarHBondContact OD1-CG2 3.36Å; D111-V114 PolarHBondContact OD1-N 3.05Å; D111-D115 PolarHBondContact O-N 3.48Å
112	E	97.6	Very high	97.6	Very high	83 Å²	83	50.7 Å²	50.7	39%	0.388	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-35.7	-179.9	-179.9	-179.6	153.1	0	0	113	L104 D115 R116 F132 N133	L104-E112 HydrophobicContact CD2-CB 4.02Å; L104-E112 HydrophobicContact CD2-CG 3.84Å; E112-D115 PolarHBondContact O-N 2.83Å; E112-R116 VanDerWaalsContact O-CB 3.25Å; E112-R116 WeakPolarHBondContact O-CB 3.39Å; E112-R116 PolarHBondContact O-N 3.19Å; E112-R116 IonicContact OE1-CZ 3.82Å; E112-R116 IonicContact OE1-NH2 2.75Å; E112-R116 PolarHBondContact OE1-NH2 2.98Å; E112-F132 HydrophobicContact CG-CZ 4.31Å; E112-N133 PolarHBondContact OE1-ND2 2.87Å; E112-N133 VanDerWaalsContact OE1-ND2 3.12Å
113	D	97.4	Very high	97.6	Very high	76 Å²	76	54.9 Å²	54.9	41%	0.406	26%	0.255	S	S	.	.	H	α-helix	trans	-69.8	-41.7	-179.7	175.3	70	0	0	0	110.8	D111 R116 K117	D111-D113 VanDerWaalsContact C-N 3.27Å; D111-D113 PolarHBondContact O-N 3.12Å; D111-D113 PolarHBondContact OD1-N 3.03Å; D113-R116 PolarHBondContact O-N 3.16Å; D113-K117 WeakPolarHBondContact O-CB 3.5Å; D113-K117 VanDerWaalsContact O-CG 3.26Å; D113-K117 WeakPolarHBondContact O-CG 3.32Å; D113-K117 PolarHBondContact O-N 3.47Å; D113-K117 WeakPolarHBondContact OD1-CE 3.48Å; D113-K117 IonicContact OD1-NZ 3.36Å; D113-K117 PolarHBondContact OD1-NZ 3.4Å; D113-K117 WeakPolarHBondContact OD2-CE 3.5Å; D113-K117 IonicContact OD2-NZ 2.62Å; D113-K117 PolarHBondContact OD2-NZ 3.11Å
114	V	97.9	Very high	97.5	Very high	7 Å²	7	55.5 Å²	55.5	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-49.6	171.6	174.1	0	0	0	0	110.6	A110 D111 R116 K117 H118 Y191 W197	A110-V114 HydrophobicContact CB-CB 4.26Å; A110-V114 HydrophobicContact CB-CG1 3.83Å; D111-V114 PolarHBondContact O-N 3.29Å; D111-V114 WeakPolarHBondContact OD1-CG2 3.36Å; D111-V114 PolarHBondContact OD1-N 3.05Å; V114-R116 PolarHBondContact O-N 3.25Å; V114-K117 PolarHBondContact O-N 3.41Å; V114-H118 PolarHBondContact O-N 3.21Å; V114-H118 PolarHBondContact O-ND1 3.32Å; V114-Y191 HydrophobicContact CB-CE2 4.48Å; V114-Y191 HydrophobicContact CG1-CD1 4.11Å; V114-Y191 HydrophobicContact CG1-CD2 3.78Å; V114-Y191 HydrophobicContact CG1-CE1 3.84Å; V114-Y191 HydrophobicContact CG1-CE2 3.47Å; V114-Y191 VanDerWaalsContact CG1-CE2 3.47Å; V114-Y191 HydrophobicContact CG1-CG 4.06Å; V114-Y191 HydrophobicContact CG2-CE2 4.09Å; V114-W197 HydrophobicContact CG2-CH2 4.36Å
115	D	98.2	Very high	97.4	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-47.8	178.4	-77.7	-36	0	0	0	111	L104 T105 D111 E112 K117 H118 W119 F132 Y176	L104-D115 WeakPolarHBondContact CA-OD2 3.46Å; T105-D115 WeakPolarHBondContact CB-OD1 3.43Å; T105-D115 PolarHBondContact N-OD2 3.4Å; T105-D115 PolarHBondContact OG1-OD1 2.83Å; D111-D115 PolarHBondContact O-N 3.48Å; E112-D115 PolarHBondContact O-N 2.83Å; D115-K117 VanDerWaalsContact C-N 3.33Å; D115-K117 PolarHBondContact O-N 3.24Å; D115-H118 PolarHBondContact O-N 3.03Å; D115-W119 VanDerWaalsContact O-CB 3.28Å; D115-W119 WeakPolarHBondContact O-CB 3.27Å; D115-W119 PolarHBondContact O-N 2.93Å; D115-F132 HydrophobicContact CB-CE2 4.49Å; D115-Y176 VanDerWaalsContact OD1-CE1 3.3Å; D115-Y176 WeakPolarHBondContact OD1-CE1 3.19Å; D115-Y176 PolarHBondContact OD1-OH 2.92Å
116	R	97.9	Very high	97.3	Very high	95 Å²	95	60 Å²	60	36%	0.358	28%	0.275	S	S	.	.	H	α-helix	trans	-59.3	-43.3	178.5	-173.3	-180	-61.9	-80	-2.6	111.8	E112 D113 V114 G120 A129 F132	E112-R116 VanDerWaalsContact O-CB 3.25Å; E112-R116 WeakPolarHBondContact O-CB 3.39Å; E112-R116 PolarHBondContact O-N 3.19Å; E112-R116 IonicContact OE1-CZ 3.82Å; E112-R116 IonicContact OE1-NH2 2.75Å; E112-R116 PolarHBondContact OE1-NH2 2.98Å; D113-R116 PolarHBondContact O-N 3.16Å; V114-R116 PolarHBondContact O-N 3.25Å; R116-G120 WeakPolarHBondContact O-CA 3.44Å; R116-G120 PolarHBondContact O-N 2.71Å; R116-A129 PolarHBondContact NH1-O 3.42Å; R116-F132 HydrophobicContact CB-CZ 4.1Å; R116-F132 HydrophobicContact CG-CE1 4.47Å
117	K	97.8	Very high	97.2	Very high	86 Å²	86	56.9 Å²	56.9	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-68.9	-37.1	-179.7	-75.4	172.1	-179.5	166.8	0	113.1	D113 V114 D115 W197	D113-K117 WeakPolarHBondContact O-CB 3.5Å; D113-K117 VanDerWaalsContact O-CG 3.26Å; D113-K117 WeakPolarHBondContact O-CG 3.32Å; D113-K117 PolarHBondContact O-N 3.47Å; D113-K117 WeakPolarHBondContact OD1-CE 3.48Å; D113-K117 IonicContact OD1-NZ 3.36Å; D113-K117 PolarHBondContact OD1-NZ 3.4Å; D113-K117 WeakPolarHBondContact OD2-CE 3.5Å; D113-K117 IonicContact OD2-NZ 2.62Å; D113-K117 PolarHBondContact OD2-NZ 3.11Å; V114-K117 PolarHBondContact O-N 3.41Å; D115-K117 VanDerWaalsContact C-N 3.33Å; D115-K117 PolarHBondContact O-N 3.24Å; K117-W197 HydrophobicContact CB-CZ3 4.45Å; K117-W197 HydrophobicContact CD-CH2 4.28Å; K117-W197 HydrophobicContact CD-CZ3 3.85Å
118	H	98.2	Very high	97.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-83.2	-48.5	-178.9	-71.4	78	0	0	0	112.1	V114 D115 G120 K121 Y176 Y191 W197	V114-H118 PolarHBondContact O-N 3.21Å; V114-H118 PolarHBondContact O-ND1 3.32Å; D115-H118 PolarHBondContact O-N 3.03Å; H118-G120 PolarHBondContact O-N 2.86Å; H118-K121 WeakPolarHBondContact O-CB 3.48Å; H118-K121 PolarHBondContact O-N 2.83Å; H118-Y176 HydrophobicContact CB-CD1 3.98Å; H118-Y176 HydrophobicContact CB-CD2 3.46Å; H118-Y176 VanDerWaalsContact CB-CD2 3.46Å; H118-Y176 HydrophobicContact CB-CE1 4.07Å; H118-Y176 HydrophobicContact CB-CE2 3.55Å; H118-Y176 HydrophobicContact CB-CG 3.68Å; H118-Y176 AromaticContact CD2-CD2 3.77Å; H118-Y176 AromaticContact CD2-CE2 3.93Å; H118-Y176 AromaticContact CG-CD2 3.67Å; H118-Y176 AromaticContact CG-CE2 3.55Å; H118-Y191 AromaticContact CE1-CD2 3.32Å; H118-Y191 WeakPolarHBondContact CE1-CD2 3.37Å; H118-Y191 AromaticContact CE1-CE2 3.97Å; H118-Y191 AromaticContact NE2-CD2 3.5Å; H118-Y191 WeakPolarHBondContact NE2-CD2 3.44Å; H118-W197 AromaticContact CE1-CE3 3.83Å; H118-W197 AromaticContact CE1-CZ3 3.87Å
119	W	98.4	Very high	97	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-36.9	174.5	-67.5	128.1	0	0	0	111.4	I97 F103 D115 K121 F122 F125 F149 M150 R151 Y176	I97-W119 HydrophobicContact CD1-CH2 4.12Å; I97-W119 HydrophobicContact CD1-CZ2 3.85Å; I97-W119 HydrophobicContact CG1-CH2 3.98Å; I97-W119 HydrophobicContact CG1-CZ2 4.08Å; F103-W119 AromaticContact CD1-CD2 3.9Å; F103-W119 HydrophobicContact CD1-CD2 3.9Å; F103-W119 AromaticContact CD1-CE2 3.68Å; F103-W119 HydrophobicContact CD1-CE3 4.47Å; F103-W119 HydrophobicContact CD1-CG 4.14Å; F103-W119 HydrophobicContact CD1-CZ2 4.1Å; F103-W119 AromaticContact CD1-NE1 3.77Å; F103-W119 HydrophobicContact CE1-CD2 4.24Å; F103-W119 HydrophobicContact CE1-CE3 4.4Å; F103-W119 PolarHBondContact O-NE1 3.43Å; D115-W119 VanDerWaalsContact O-CB 3.28Å; D115-W119 WeakPolarHBondContact O-CB 3.27Å; D115-W119 PolarHBondContact O-N 2.93Å; W119-K121 PolarHBondContact O-N 2.87Å; W119-F122 AromaticContact CE3-CD2 3.82Å; W119-F122 HydrophobicContact CE3-CD2 3.82Å; W119-F122 AromaticContact CE3-CE2 3.62Å; W119-F122 HydrophobicContact CE3-CE2 3.62Å; W119-F122 HydrophobicContact CZ3-CD2 4.37Å; W119-F122 AromaticContact CZ3-CE2 3.89Å; W119-F122 HydrophobicContact CZ3-CE2 3.89Å; W119-F122 WeakPolarHBondContact O-CD2 3.32Å; W119-F122 PolarHBondContact O-N 2.95Å; W119-F125 HydrophobicContact CB-CD1 3.59Å; W119-F125 HydrophobicContact CB-CD2 3.88Å; W119-F125 HydrophobicContact CB-CE1 3.46Å; W119-F125 VanDerWaalsContact CB-CE1 3.46Å; W119-F125 HydrophobicContact CB-CE2 3.77Å; W119-F125 HydrophobicContact CB-CG 3.78Å; W119-F125 HydrophobicContact CB-CZ 3.54Å; W119-F125 HydrophobicContact CG-CD2 4.45Å; W119-F125 HydrophobicContact CG-CE2 4.14Å; W119-F125 HydrophobicContact CG-CZ 4.15Å; W119-F125 WeakPolarHBondContact O-CB 3.45Å; W119-F125 WeakPolarHBondContact O-CD1 3.28Å; W119-F125 WeakPolarHBondContact O-CG 3.3Å; W119-F149 AromaticContact CE3-CD1 3.83Å; W119-F149 HydrophobicContact CE3-CD1 3.83Å; W119-F149 HydrophobicContact CH2-CB 4.09Å; W119-F149 HydrophobicContact CZ3-CB 3.89Å; W119-F149 AromaticContact CZ3-CD1 3.72Å; W119-F149 HydrophobicContact CZ3-CD1 3.72Å; W119-F149 HydrophobicContact CZ3-CG 4.25Å; W119-M150 WeakPolarHBondContact CH2-O 3.02Å; W119-R151 HydrophobicContact CH2-CG 4.18Å; W119-R151 HydrophobicContact CZ2-CG 3.99Å; W119-Y176 AromaticContact CD2-CD1 3.64Å; W119-Y176 HydrophobicContact CD2-CD1 3.64Å; W119-Y176 HydrophobicContact CD2-CE1 4.12Å; W119-Y176 AromaticContact CE2-CD1 3.38Å; W119-Y176 AromaticContact CE2-CE1 3.58Å; W119-Y176 AromaticContact CE3-CD1 3.95Å; W119-Y176 HydrophobicContact CE3-CD1 3.95Å; W119-Y176 HydrophobicContact CG-CD1 4.28Å; W119-Y176 HydrophobicContact CG-CE1 4.42Å; W119-Y176 AromaticContact CH2-CD1 3.78Å; W119-Y176 HydrophobicContact CH2-CD1 3.78Å; W119-Y176 AromaticContact CZ2-CD1 3.48Å; W119-Y176 HydrophobicContact CZ2-CD1 3.48Å; W119-Y176 VanDerWaalsContact CZ2-CD1 3.48Å; W119-Y176 AromaticContact CZ2-CE1 3.88Å; W119-Y176 HydrophobicContact CZ2-CE1 3.88Å; W119-Y176 AromaticContact CZ3-CD1 3.99Å; W119-Y176 HydrophobicContact CZ3-CD1 3.99Å; W119-Y176 AromaticContact NE1-CD1 3.87Å; W119-Y176 AromaticContact NE1-CE1 3.57Å
120	G	97.6	Very high	96.9	Very high	26 Å²	26	56.6 Å²	56.6	27%	0.268	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-2.6	174.1	0	0	0	0	0	115.6	R116 H118 Y126	R116-G120 WeakPolarHBondContact O-CA 3.44Å; R116-G120 PolarHBondContact O-N 2.71Å; H118-G120 PolarHBondContact O-N 2.86Å; G120-Y126 WeakPolarHBondContact O-CE1 3.41Å
121	K	97.9	Very high	96.8	Very high	91 Å²	91	59.3 Å²	59.3	40%	0.396	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-25.1	169	-66.3	-60	-171.2	174.6	0	113	H118 W119 F189 Y198	H118-K121 WeakPolarHBondContact O-CB 3.48Å; H118-K121 PolarHBondContact O-N 2.83Å; W119-K121 PolarHBondContact O-N 2.87Å; K121-F189 HydrophobicContact CB-CD2 3.75Å; K121-F189 HydrophobicContact CB-CE1 4.43Å; K121-F189 HydrophobicContact CB-CE2 3.31Å; K121-F189 HydrophobicContact CB-CG 4.49Å; K121-F189 HydrophobicContact CB-CZ 3.71Å; K121-F189 HydrophobicContact CG-CD2 4.28Å; K121-F189 HydrophobicContact CG-CE2 4.15Å; K121-F189 HydrophobicContact CG-CZ 4.31Å; K121-Y198 HydrophobicContact CD-CD1 4.36Å; K121-Y198 HydrophobicContact CD-CE1 4.32Å; K121-Y198 VanDerWaalsContact CE-CD1 3.44Å; K121-Y198 HydrophobicContact CG-CD1 4.1Å; K121-Y198 HydrophobicContact CG-CE1 4.12Å
122	F	97.8	Very high	96.6	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-84	122.6	179	-53.8	-68	0	0	0	109.7	W119 A124 F125 Y126 F149 C178 E187 F189	W119-F122 AromaticContact CE3-CD2 3.82Å; W119-F122 HydrophobicContact CE3-CD2 3.82Å; W119-F122 AromaticContact CE3-CE2 3.62Å; W119-F122 HydrophobicContact CE3-CE2 3.62Å; W119-F122 HydrophobicContact CZ3-CD2 4.37Å; W119-F122 AromaticContact CZ3-CE2 3.89Å; W119-F122 HydrophobicContact CZ3-CE2 3.89Å; W119-F122 WeakPolarHBondContact O-CD2 3.32Å; W119-F122 PolarHBondContact O-N 2.95Å; F122-A124 PolarHBondContact O-N 2.92Å; F122-F125 HydrophobicContact CB-CB 4.18Å; F122-F125 WeakPolarHBondContact O-CB 3.41Å; F122-F125 PolarHBondContact O-N 3.02Å; F122-Y126 WeakPolarHBondContact O-CD1 3.35Å; F122-F149 HydrophobicContact CB-CE1 4.23Å; F122-F149 HydrophobicContact CD2-CD1 4.48Å; F122-F149 HydrophobicContact CD2-CE1 4.32Å; F122-F149 HydrophobicContact CG-CE1 4.47Å; F122-C178 HydrophobicContact CB-CB 4.35Å; F122-C178 HydrophobicContact CD1-CB 3.41Å; F122-C178 VanDerWaalsContact CD1-CB 3.41Å; F122-C178 HydrophobicContact CD2-CB 4.24Å; F122-C178 HydrophobicContact CE1-CB 3.62Å; F122-C178 HydrophobicContact CE2-CB 4.42Å; F122-C178 HydrophobicContact CG-CB 3.74Å; F122-C178 HydrophobicContact CZ-CB 4.13Å; F122-E187 HydrophobicContact CD1-CB 4.21Å; F122-E187 HydrophobicContact CD1-CG 4.04Å; F122-E187 HydrophobicContact CE1-CB 4Å; F122-E187 HydrophobicContact CE1-CG 3.85Å; F122-E187 WeakPolarHBondContact CE1-O 3.45Å; F122-F189 HydrophobicContact CD1-CD2 4.43Å; F122-F189 AromaticContact CD1-CE2 3.97Å; F122-F189 HydrophobicContact CD1-CE2 3.97Å; F122-F189 AromaticContact CE1-CD2 3.66Å; F122-F189 HydrophobicContact CE1-CD2 3.66Å; F122-F189 AromaticContact CE1-CE2 3.54Å; F122-F189 HydrophobicContact CE1-CE2 3.54Å; F122-F189 HydrophobicContact CE2-CD2 4.25Å; F122-F189 AromaticContact CZ-CD2 3.56Å; F122-F189 HydrophobicContact CZ-CD2 3.56Å; F122-F189 AromaticContact CZ-CE2 3.94Å; F122-F189 HydrophobicContact CZ-CE2 3.94Å
123	Q	96.9	Very high	96.4	Very high	132 Å²	132	53.9 Å²	53.9	62%	0.617	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-55.6	-37.2	175.1	-176.3	64.1	34.9	0	0	111.6	F125 Y126	Q123-F125 PolarHBondContact O-N 2.84Å; Q123-Y126 WeakPolarHBondContact O-CB 3.37Å; Q123-Y126 PolarHBondContact O-N 2.93Å
124	A	95.8	Very high	96.3	Very high	12 Å²	12	52.2 Å²	52.2	10%	0.099	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.8	-23.1	177.1	0	0	0	0	0	114	F122 Y147 F149	F122-A124 PolarHBondContact O-N 2.92Å; A124-Y147 HydrophobicContact CB-CD1 3.54Å; A124-Y147 HydrophobicContact CB-CD2 3.58Å; A124-Y147 HydrophobicContact CB-CE1 3.65Å; A124-Y147 HydrophobicContact CB-CE2 3.7Å; A124-Y147 HydrophobicContact CB-CG 3.49Å; A124-Y147 VanDerWaalsContact CB-CG 3.49Å; A124-F149 HydrophobicContact CB-CZ 3.94Å
125	F	97	Very high	95.8	Very high	1 Å²	1	58.8 Å²	58.8	0%	0.004	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-83	-14	-178.6	-176.2	-105.2	0	0	0	113.2	F103 W119 F122 Q123 Q127 Y128 A129 F132 F149	F103-F125 HydrophobicContact CD1-CD2 4.27Å; F103-F125 AromaticContact CD1-CE2 3.64Å; F103-F125 HydrophobicContact CD1-CE2 3.64Å; F103-F125 HydrophobicContact CD2-CE2 4.4Å; F103-F125 AromaticContact CE1-CD2 3.74Å; F103-F125 HydrophobicContact CE1-CD2 3.74Å; F103-F125 AromaticContact CE1-CE2 3.54Å; F103-F125 HydrophobicContact CE1-CE2 3.54Å; F103-F125 HydrophobicContact CE2-CE2 4.31Å; F103-F125 HydrophobicContact CG-CE2 4.08Å; F103-F125 HydrophobicContact CZ-CD2 4.06Å; F103-F125 AromaticContact CZ-CE2 3.9Å; F103-F125 HydrophobicContact CZ-CE2 3.9Å; W119-F125 HydrophobicContact CB-CD1 3.59Å; W119-F125 HydrophobicContact CB-CD2 3.88Å; W119-F125 HydrophobicContact CB-CE1 3.46Å; W119-F125 VanDerWaalsContact CB-CE1 3.46Å; W119-F125 HydrophobicContact CB-CE2 3.77Å; W119-F125 HydrophobicContact CB-CG 3.78Å; W119-F125 HydrophobicContact CB-CZ 3.54Å; W119-F125 HydrophobicContact CG-CD2 4.45Å; W119-F125 HydrophobicContact CG-CE2 4.14Å; W119-F125 HydrophobicContact CG-CZ 4.15Å; W119-F125 WeakPolarHBondContact O-CB 3.45Å; W119-F125 WeakPolarHBondContact O-CD1 3.28Å; W119-F125 WeakPolarHBondContact O-CG 3.3Å; F122-F125 HydrophobicContact CB-CB 4.18Å; F122-F125 WeakPolarHBondContact O-CB 3.41Å; F122-F125 PolarHBondContact O-N 3.02Å; Q123-F125 PolarHBondContact O-N 2.84Å; F125-Q127 PolarHBondContact O-N 2.83Å; F125-Q127 VanDerWaalsContact O-N 3.12Å; F125-Y128 HydrophobicContact CD2-CD2 4.38Å; F125-Y128 CarbonylContact O-C 3.6Å; F125-Y128 WeakPolarHBondContact O-CA 3.39Å; F125-Y128 PolarHBondContact O-N 2.84Å; F125-A129 HydrophobicContact CD1-CB 4.21Å; F125-A129 HydrophobicContact CE1-CB 4.02Å; F125-A129 PolarHBondContact O-N 2.77Å; F125-F132 HydrophobicContact CE1-CD1 4.3Å; F125-F132 HydrophobicContact CE2-CB 3.88Å; F125-F132 HydrophobicContact CE2-CG 4.27Å; F125-F132 HydrophobicContact CZ-CB 3.65Å; F125-F132 AromaticContact CZ-CD1 3.71Å; F125-F132 HydrophobicContact CZ-CD1 3.71Å; F125-F132 HydrophobicContact CZ-CD2 4.18Å; F125-F132 HydrophobicContact CZ-CE1 4.38Å; F125-F132 AromaticContact CZ-CG 3.58Å; F125-F132 HydrophobicContact CZ-CG 3.58Å; F125-F149 HydrophobicContact CB-CE1 3.96Å; F125-F149 HydrophobicContact CB-CZ 4.11Å; F125-F149 HydrophobicContact CD2-CE1 4.32Å; F125-F149 HydrophobicContact CD2-CZ 4.41Å
126	Y	95.7	Very high	95.5	Very high	126 Å²	126	66.1 Å²	66.1	49%	0.494	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-33.2	-171.1	-75.5	12.4	0	0	0	113.3	G120 F122 Q123 Y128 A129	G120-Y126 WeakPolarHBondContact O-CE1 3.41Å; F122-Y126 WeakPolarHBondContact O-CD1 3.35Å; Q123-Y126 WeakPolarHBondContact O-CB 3.37Å; Q123-Y126 PolarHBondContact O-N 2.93Å; Y126-Y128 PolarHBondContact O-N 2.96Å; Y126-A129 PolarHBondContact O-N 2.75Å
127	Q	94	Very high	95.4	Very high	124 Å²	124	62.1 Å²	62.1	58%	0.579	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-25	175.6	64.9	-173.5	1	0	0	113.4	F125	F125-Q127 PolarHBondContact O-N 2.83Å; F125-Q127 VanDerWaalsContact O-N 3.12Å
128	Y	95.4	Very high	95.2	Very high	9 Å²	9	62.5 Å²	62.5	4%	0.035	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-12.2	-178.5	-53.1	-54.2	0	0	0	113.1	F125 Y126 K130 T131 F132 F137 D141 L142 F149	F125-Y128 HydrophobicContact CD2-CD2 4.38Å; F125-Y128 CarbonylContact O-C 3.6Å; F125-Y128 WeakPolarHBondContact O-CA 3.39Å; F125-Y128 PolarHBondContact O-N 2.84Å; Y126-Y128 PolarHBondContact O-N 2.96Å; Y128-K130 PolarHBondContact O-N 3.14Å; Y128-T131 PolarHBondContact O-N 2.78Å; Y128-T131 PolarHBondContact O-OG1 3.3Å; Y128-F132 WeakPolarHBondContact O-CB 3.38Å; Y128-F132 PolarHBondContact O-N 2.63Å; Y128-F137 AromaticContact CD1-CE2 3.54Å; Y128-F137 HydrophobicContact CD1-CE2 3.54Å; Y128-F137 AromaticContact CD1-CZ 3.49Å; Y128-F137 HydrophobicContact CD1-CZ 3.49Å; Y128-F137 VanDerWaalsContact CD1-CZ 3.49Å; Y128-F137 HydrophobicContact CE1-CE2 4.37Å; Y128-F137 AromaticContact CE1-CZ 3.97Å; Y128-F137 HydrophobicContact CE1-CZ 3.97Å; Y128-F137 AromaticContact CG-CE2 3.96Å; Y128-F137 HydrophobicContact CG-CE2 3.96Å; Y128-F137 AromaticContact CG-CZ 3.88Å; Y128-F137 HydrophobicContact CG-CZ 3.88Å; Y128-D141 PolarHBondContact OH-OD2 2.84Å; Y128-L142 HydrophobicContact CD2-CD1 4.22Å; Y128-L142 HydrophobicContact CE1-CD1 4.49Å; Y128-L142 HydrophobicContact CE2-CD1 3.54Å; Y128-F149 HydrophobicContact CD2-CE2 4.22Å; Y128-F149 HydrophobicContact CD2-CZ 4.46Å; Y128-F149 HydrophobicContact CE2-CE2 4.02Å
129	A	94.4	Very high	95	Very high	30 Å²	30	63.8 Å²	63.8	25%	0.248	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.3	-171.6	0	0	0	0	0	115.1	R116 F125 Y126 F132	R116-A129 PolarHBondContact NH1-O 3.42Å; F125-A129 HydrophobicContact CD1-CB 4.21Å; F125-A129 HydrophobicContact CE1-CB 4.02Å; F125-A129 PolarHBondContact O-N 2.77Å; Y126-A129 PolarHBondContact O-N 2.75Å; A129-F132 WeakPolarHBondContact O-CD1 3.08Å
130	K	93.3	Very high	94.7	Very high	191 Å²	191	69.6 Å²	69.6	83%	0.83	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-21	177.7	-65.8	-177	-179.2	177.5	0	114	Y128	Y128-K130 PolarHBondContact O-N 3.14Å
131	T	95.3	Very high	94.4	Very high	62 Å²	62	71.9 Å²	71.9	38%	0.38	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-9.2	-168.5	54.4	0	0	0	0	113.6	Y128 N133 S134 F137	Y128-T131 PolarHBondContact O-N 2.78Å; Y128-T131 PolarHBondContact O-OG1 3.3Å; T131-N133 PolarHBondContact O-N 3.02Å; T131-S134 WeakPolarHBondContact O-CB 3.42Å; T131-S134 PolarHBondContact O-N 2.91Å; T131-F137 WeakPolarHBondContact O-CD2 3.33Å
132	F	94.9	Very high	94.2	Very high	2 Å²	2	68 Å²	68	1%	0.009	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.2	-174.9	81.2	-85.3	0	0	0	115	F103 L104 E112 D115 R116 F125 Y128 A129	F103-F132 HydrophobicContact CB-CB 4.04Å; F103-F132 HydrophobicContact CB-CD2 3.65Å; F103-F132 HydrophobicContact CB-CG 4.31Å; F103-F132 HydrophobicContact CD2-CB 3.93Å; F103-F132 HydrophobicContact CG-CB 4.08Å; F103-F132 HydrophobicContact CG-CD2 4.48Å; L104-F132 HydrophobicContact CD2-CD2 4.35Å; L104-F132 HydrophobicContact CD2-CE2 3.67Å; L104-F132 HydrophobicContact CG-CE2 4.38Å; E112-F132 HydrophobicContact CG-CZ 4.31Å; D115-F132 HydrophobicContact CB-CE2 4.49Å; R116-F132 HydrophobicContact CB-CZ 4.1Å; R116-F132 HydrophobicContact CG-CE1 4.47Å; F125-F132 HydrophobicContact CE1-CD1 4.3Å; F125-F132 HydrophobicContact CE2-CB 3.88Å; F125-F132 HydrophobicContact CE2-CG 4.27Å; F125-F132 HydrophobicContact CZ-CB 3.65Å; F125-F132 AromaticContact CZ-CD1 3.71Å; F125-F132 HydrophobicContact CZ-CD1 3.71Å; F125-F132 HydrophobicContact CZ-CD2 4.18Å; F125-F132 HydrophobicContact CZ-CE1 4.38Å; F125-F132 AromaticContact CZ-CG 3.58Å; F125-F132 HydrophobicContact CZ-CG 3.58Å; Y128-F132 WeakPolarHBondContact O-CB 3.38Å; Y128-F132 PolarHBondContact O-N 2.63Å; A129-F132 WeakPolarHBondContact O-CD1 3.08Å
133	N	93.5	Very high	93.9	Very high	61 Å²	61	74.8 Å²	74.8	33%	0.326	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	2.9	178.5	68.2	-27.8	0	0	0	113.3	L104 E112 T131	L104-N133 HydrophobicContact CD1-CB 4.09Å; L104-N133 HydrophobicContact CD2-CB 4.25Å; L104-N133 HydrophobicContact CG-CB 4.34Å; E112-N133 PolarHBondContact OE1-ND2 2.87Å; E112-N133 VanDerWaalsContact OE1-ND2 3.12Å; T131-N133 PolarHBondContact O-N 3.02Å
134	S	94.4	Very high	93.6	Very high	41 Å²	41	72.9 Å²	72.9	29%	0.287	37%	0.368	S	S	.	.	S	Bend	trans	-82.6	143.4	174.3	151.4	0	0	0	0	110.8	T131 E136 F137	T131-S134 WeakPolarHBondContact O-CB 3.42Å; T131-S134 PolarHBondContact O-N 2.91Å; S134-E136 PolarHBondContact O-N 2.95Å; S134-E136 PolarHBondContact OG-N 2.77Å; S134-E136 PolarHBondContact OG-OE2 3.03Å; S134-F137 WeakPolarHBondContact O-CB 3.34Å; S134-F137 PolarHBondContact O-N 2.94Å
135	D	88.4	Confident	93.5	Very high	144 Å²	144	73.2 Å²	73.2	77%	0.77	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.7	178.2	-68.9	-33	0	0	0	112
136	E	91.1	Very high	93.4	Very high	156 Å²	156	75.8 Å²	75.8	73%	0.729	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	12.2	178.4	-54.5	76.9	-167	0	0	113.4	S134 D138	S134-E136 PolarHBondContact O-N 2.95Å; S134-E136 PolarHBondContact OG-N 2.77Å; S134-E136 PolarHBondContact OG-OE2 3.03Å; E136-D138 PolarHBondContact O-N 2.81Å
137	F	94.9	Very high	93.5	Very high	10 Å²	10	73.1 Å²	73.1	4%	0.044	37%	0.373	C	S	.	.			trans	-55.2	129.7	178.6	-176	-92.2	0	0	0	111.9	F103 Y128 T131 S134 Y139 L142	F103-F137 HydrophobicContact CD2-CE1 4.32Å; F103-F137 HydrophobicContact CD2-CZ 4.27Å; F103-F137 AromaticContact CE2-CE1 3.86Å; F103-F137 HydrophobicContact CE2-CE1 3.86Å; F103-F137 HydrophobicContact CE2-CE2 4.37Å; F103-F137 AromaticContact CE2-CZ 3.65Å; F103-F137 HydrophobicContact CE2-CZ 3.65Å; Y128-F137 AromaticContact CD1-CE2 3.54Å; Y128-F137 HydrophobicContact CD1-CE2 3.54Å; Y128-F137 AromaticContact CD1-CZ 3.49Å; Y128-F137 HydrophobicContact CD1-CZ 3.49Å; Y128-F137 VanDerWaalsContact CD1-CZ 3.49Å; Y128-F137 HydrophobicContact CE1-CE2 4.37Å; Y128-F137 AromaticContact CE1-CZ 3.97Å; Y128-F137 HydrophobicContact CE1-CZ 3.97Å; Y128-F137 AromaticContact CG-CE2 3.96Å; Y128-F137 HydrophobicContact CG-CE2 3.96Å; Y128-F137 AromaticContact CG-CZ 3.88Å; Y128-F137 HydrophobicContact CG-CZ 3.88Å; T131-F137 WeakPolarHBondContact O-CD2 3.33Å; S134-F137 WeakPolarHBondContact O-CB 3.34Å; S134-F137 PolarHBondContact O-N 2.94Å; F137-Y139 HydrophobicContact CB-CE2 4.09Å; F137-Y139 AromaticContact CD1-CD1 3.75Å; F137-Y139 HydrophobicContact CD1-CD1 3.75Å; F137-Y139 AromaticContact CD1-CD2 3.84Å; F137-Y139 HydrophobicContact CD1-CD2 3.84Å; F137-Y139 AromaticContact CD1-CE1 3.67Å; F137-Y139 HydrophobicContact CD1-CE1 3.67Å; F137-Y139 AromaticContact CD1-CE2 3.75Å; F137-Y139 HydrophobicContact CD1-CE2 3.75Å; F137-Y139 AromaticContact CD1-CG 3.84Å; F137-Y139 HydrophobicContact CD1-CG 3.84Å; F137-Y139 AromaticContact CD1-CZ 3.66Å; F137-Y139 AromaticContact CE1-CD1 3.9Å; F137-Y139 HydrophobicContact CE1-CD1 3.9Å; F137-Y139 AromaticContact CE1-CE1 4Å; F137-Y139 HydrophobicContact CE1-CE1 4Å; F137-Y139 HydrophobicContact CE1-CG 4.27Å; F137-Y139 HydrophobicContact CG-CE2 4.38Å; F137-Y139 VanDerWaalsContact O-CD2 3.28Å; F137-Y139 WeakPolarHBondContact O-CD2 3.02Å; F137-Y139 PolarHBondContact O-N 2.58Å; F137-Y139 VanDerWaalsContact O-N 3.09Å; F137-L142 HydrophobicContact CE1-CB 4.2Å; F137-L142 HydrophobicContact CE1-CD2 4.19Å
138	D	93.9	Very high	93.6	Very high	94 Å²	94	67.7 Å²	67.7	50%	0.503	35%	0.348	S	S	.	.			trans	-80.7	91.8	-179.2	-167	-14.8	0	0	0	111.4	E136 E140 D141 L142	E136-D138 PolarHBondContact O-N 2.81Å; D138-E140 VanDerWaalsContact C-N 3.26Å; D138-E140 PolarHBondContact O-N 3.44Å; D138-E140 WeakPolarHBondContact OD1-CA 3.41Å; D138-E140 WeakPolarHBondContact OD1-CB 3.37Å; D138-E140 PolarHBondContact OD1-N 2.94Å; D138-D141 HydrophobicContact CB-CB 4.12Å; D138-D141 PolarHBondContact OD1-N 2.98Å; D138-L142 PolarHBondContact O-N 3.44Å
139	Y	94.2	Very high	93.8	Very high	28 Å²	28	67.4 Å²	67.4	11%	0.11	35%	0.346	C	S	.	.	H	α-helix	trans	-72.3	-16.2	174.9	-69.6	-80	0	0	0	113.7	I97 S98 R99 P102 F137 L142 K143	I97-Y139 HydrophobicContact CG2-CE1 4.22Å; S98-Y139 VanDerWaalsContact C-CE1 3.4Å; S98-Y139 WeakPolarHBondContact O-CE1 3.32Å; R99-Y139 HydrophobicContact CB-CD2 3.99Å; R99-Y139 HydrophobicContact CB-CE2 4.47Å; R99-Y139 HydrophobicContact CB-CG 4.25Å; R99-Y139 HydrophobicContact CG-CD2 4.48Å; P102-Y139 WeakPolarHBondContact CA-OH 3.45Å; P102-Y139 WeakPolarHBondContact CB-OH 3.36Å; F137-Y139 HydrophobicContact CB-CE2 4.09Å; F137-Y139 AromaticContact CD1-CD1 3.75Å; F137-Y139 HydrophobicContact CD1-CD1 3.75Å; F137-Y139 AromaticContact CD1-CD2 3.84Å; F137-Y139 HydrophobicContact CD1-CD2 3.84Å; F137-Y139 AromaticContact CD1-CE1 3.67Å; F137-Y139 HydrophobicContact CD1-CE1 3.67Å; F137-Y139 AromaticContact CD1-CE2 3.75Å; F137-Y139 HydrophobicContact CD1-CE2 3.75Å; F137-Y139 AromaticContact CD1-CG 3.84Å; F137-Y139 HydrophobicContact CD1-CG 3.84Å; F137-Y139 AromaticContact CD1-CZ 3.66Å; F137-Y139 AromaticContact CE1-CD1 3.9Å; F137-Y139 HydrophobicContact CE1-CD1 3.9Å; F137-Y139 AromaticContact CE1-CE1 4Å; F137-Y139 HydrophobicContact CE1-CE1 4Å; F137-Y139 HydrophobicContact CE1-CG 4.27Å; F137-Y139 HydrophobicContact CG-CE2 4.38Å; F137-Y139 VanDerWaalsContact O-CD2 3.28Å; F137-Y139 WeakPolarHBondContact O-CD2 3.02Å; F137-Y139 PolarHBondContact O-N 2.58Å; F137-Y139 VanDerWaalsContact O-N 3.09Å; Y139-L142 HydrophobicContact CD1-CD2 4.16Å; Y139-K143 WeakPolarHBondContact O-CB 3.36Å; Y139-K143 PolarHBondContact O-N 3.06Å; Y139-K143 VanDerWaalsContact O-N 3.08Å
140	E	92.2	Very high	94	Very high	121 Å²	121	66 Å²	66	57%	0.565	34%	0.335	S	S	*	.	H	α-helix	trans	-77	-40.2	176	-64	-56.3	137.9	0	0	110.5	D138 L142 K143 S144	D138-E140 VanDerWaalsContact C-N 3.26Å; D138-E140 PolarHBondContact O-N 3.44Å; D138-E140 WeakPolarHBondContact OD1-CA 3.41Å; D138-E140 WeakPolarHBondContact OD1-CB 3.37Å; D138-E140 PolarHBondContact OD1-N 2.94Å; E140-L142 VanDerWaalsContact C-N 3.32Å; E140-L142 PolarHBondContact O-N 3.26Å; E140-K143 WeakPolarHBondContact O-CB 3.3Å; E140-K143 PolarHBondContact O-N 3.46Å; E140-S144 PolarHBondContact O-N 3.3Å; E140-S144 VanDerWaalsContact O-N 3.07Å
141	D	92.2	Very high	94.2	Very high	74 Å²	74	57 Å²	57	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-55.4	-49.3	168.7	178.8	75.8	0	0	0	110.7	Y128 D138 K143 S144 S145	Y128-D141 PolarHBondContact OH-OD2 2.84Å; D138-D141 HydrophobicContact CB-CB 4.12Å; D138-D141 PolarHBondContact OD1-N 2.98Å; D141-K143 VanDerWaalsContact C-N 3.3Å; D141-K143 PolarHBondContact O-N 3.04Å; D141-S144 PolarHBondContact O-N 3.05Å; D141-S144 VanDerWaalsContact O-N 3.07Å; D141-S144 PolarHBondContact O-OG 3.1Å; D141-S145 PolarHBondContact O-N 3.21Å; D141-S145 VanDerWaalsContact O-N 3.08Å
142	L	93.8	Very high	94.4	Very high	9 Å²	9	54.1 Å²	54.1	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-55.4	-44.9	177.4	-175.5	66.4	0	0	0	112.4	I97 F103 Y128 F137 D138 Y139 E140 S144 S145 F149	I97-L142 HydrophobicContact CB-CD2 4.43Å; I97-L142 HydrophobicContact CG2-CD2 3.97Å; F103-L142 HydrophobicContact CE2-CD2 3.9Å; F103-L142 HydrophobicContact CZ-CD1 4.21Å; F103-L142 HydrophobicContact CZ-CD2 4.03Å; Y128-L142 HydrophobicContact CD2-CD1 4.22Å; Y128-L142 HydrophobicContact CE1-CD1 4.49Å; Y128-L142 HydrophobicContact CE2-CD1 3.54Å; F137-L142 HydrophobicContact CE1-CB 4.2Å; F137-L142 HydrophobicContact CE1-CD2 4.19Å; D138-L142 PolarHBondContact O-N 3.44Å; Y139-L142 HydrophobicContact CD1-CD2 4.16Å; E140-L142 VanDerWaalsContact C-N 3.32Å; E140-L142 PolarHBondContact O-N 3.26Å; L142-S144 VanDerWaalsContact C-N 3.28Å; L142-S144 PolarHBondContact O-N 3.33Å; L142-S145 WeakPolarHBondContact O-CB 3.34Å; L142-S145 PolarHBondContact O-N 2.94Å; L142-S145 PolarHBondContact O-OG 3.34Å; L142-F149 HydrophobicContact CD1-CD2 3.76Å; L142-F149 HydrophobicContact CD1-CE2 3.79Å
143	K	90.8	Very high	94.5	Very high	143 Å²	143	55.2 Å²	55.2	62%	0.622	28%	0.283	S	S	*	.	H	α-helix	trans	-63	-35.8	-180	-174.2	179.9	177.4	-174.6	0	111.9	Y139 E140 D141 S145 K181	Y139-K143 WeakPolarHBondContact O-CB 3.36Å; Y139-K143 PolarHBondContact O-N 3.06Å; Y139-K143 VanDerWaalsContact O-N 3.08Å; E140-K143 WeakPolarHBondContact O-CB 3.3Å; E140-K143 PolarHBondContact O-N 3.46Å; D141-K143 VanDerWaalsContact C-N 3.3Å; D141-K143 PolarHBondContact O-N 3.04Å; K143-S145 VanDerWaalsContact C-N 3.35Å; K143-K181 PolarHBondContact O-NZ 2.88Å
144	S	90.8	Very high	94.7	Very high	93 Å²	93	52.9 Å²	52.9	65%	0.65	27%	0.27	S	S	*	.	H	α-helix	trans	-75.6	-21	177.6	80.5	0	0	0	0	113.8	E140 D141 L142	E140-S144 PolarHBondContact O-N 3.3Å; E140-S144 VanDerWaalsContact O-N 3.07Å; D141-S144 PolarHBondContact O-N 3.05Å; D141-S144 VanDerWaalsContact O-N 3.07Å; D141-S144 PolarHBondContact O-OG 3.1Å; L142-S144 VanDerWaalsContact C-N 3.28Å; L142-S144 PolarHBondContact O-N 3.33Å
145	S	93.7	Very high	94.6	Very high	19 Å²	19	55.5 Å²	55.5	13%	0.133	28%	0.277	C	S	.	.	S	Bend	trans	-63.8	164.5	-178.9	85.4	0	0	0	0	113.6	D141 L142 K143 Y147 K181	D141-S145 PolarHBondContact O-N 3.21Å; D141-S145 VanDerWaalsContact O-N 3.08Å; L142-S145 WeakPolarHBondContact O-CB 3.34Å; L142-S145 PolarHBondContact O-N 2.94Å; L142-S145 PolarHBondContact O-OG 3.34Å; K143-S145 VanDerWaalsContact C-N 3.35Å; S145-Y147 PolarHBondContact O-N 3.27Å; S145-Y147 PolarHBondContact OG-N 2.89Å; S145-Y147 PolarHBondContact OG-O 2.85Å; S145-Y147 VanDerWaalsContact OG-O 3.05Å; S145-K181 VanDerWaalsContact O-CE 3.31Å; S145-K181 WeakPolarHBondContact O-CE 3.29Å; S145-K181 PolarHBondContact O-NZ 3.05Å
146	D	95.4	Very high	94.8	Very high	54 Å²	54	52.5 Å²	52.5	29%	0.289	26%	0.258	S	S	.	.	S	Bend	trans	-71.5	-5.5	174	-168.6	35.5	0	0	0	113	Q180 K181 S182	D146-Q180 WeakPolarHBondContact OD2-CG 3.34Å; D146-Q180 PolarHBondContact OD2-NE2 2.84Å; D146-K181 WeakPolarHBondContact O-CG 3.47Å; D146-K181 PolarHBondContact O-N 3.38Å; D146-K181 WeakPolarHBondContact OD1-CB 3.42Å; D146-S182 VanDerWaalsContact OD1-CB 3.29Å; D146-S182 WeakPolarHBondContact OD1-CB 3.44Å; D146-S182 PolarHBondContact OD1-N 3.48Å; D146-S182 PolarHBondContact OD1-OG 2.81Å; D146-S182 WeakPolarHBondContact OD2-CB 3.43Å; D146-S182 PolarHBondContact OD2-OG 2.77Å
147	Y	96.7	Very high	94.9	Very high	71 Å²	71	45.6 Å²	45.6	28%	0.278	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.4	-172.3	-60.7	-83.6	0	0	0	112.1	A124 S145 F179 Q180	A124-Y147 HydrophobicContact CB-CD1 3.54Å; A124-Y147 HydrophobicContact CB-CD2 3.58Å; A124-Y147 HydrophobicContact CB-CE1 3.65Å; A124-Y147 HydrophobicContact CB-CE2 3.7Å; A124-Y147 HydrophobicContact CB-CG 3.49Å; A124-Y147 VanDerWaalsContact CB-CG 3.49Å; S145-Y147 PolarHBondContact O-N 3.27Å; S145-Y147 PolarHBondContact OG-N 2.89Å; S145-Y147 PolarHBondContact OG-O 2.85Å; S145-Y147 VanDerWaalsContact OG-O 3.05Å; Y147-F179 CarbonylContact C-O 3.5Å; Y147-F179 WeakPolarHBondContact CA-O 3.5Å; Y147-Q180 HydrophobicContact CD1-CB 4.04Å; Y147-Q180 HydrophobicContact CD1-CG 4.14Å; Y147-Q180 HydrophobicContact CE1-CB 3.88Å; Y147-Q180 HydrophobicContact CE1-CG 3.7Å
148	I	97.2	Very high	94.7	Very high	10 Å²	10	47.6 Å²	47.6	5%	0.051	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	111.7	171.7	-55.7	178.1	0	0	0	107.1	L39 M67 I96 M150 F179 K181	L39-I148 HydrophobicContact CD2-CD1 3.8Å; L39-I148 HydrophobicContact CD2-CG2 4.39Å; M67-I148 HydrophobicContact CE-CD1 4.03Å; I96-I148 HydrophobicContact CG2-CG2 3.71Å; I148-M150 HydrophobicContact CG2-CG 3.96Å; I148-M150 HydrophobicContact CG2-SD 4.32Å; I148-F179 HydrophobicContact CB-CB 4.34Å; I148-F179 HydrophobicContact CB-CD1 4.19Å; I148-F179 HydrophobicContact CD1-CD1 3.91Å; I148-F179 HydrophobicContact CD1-CE1 4.26Å; I148-F179 HydrophobicContact CG1-CD1 4.16Å; I148-F179 PolarHBondContact N-O 3.08Å; I148-F179 PolarHBondContact O-N 3.29Å; I148-K181 HydrophobicContact CD1-CD 4.43Å; I148-K181 HydrophobicContact CD1-CG 4.08Å; I148-K181 HydrophobicContact CG1-CD 4.38Å; I148-K181 VanDerWaalsContact CG1-CE 3.4Å; I148-K181 HydrophobicContact CG1-CG 4.13Å
149	F	98.4	Very high	94.3	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	142.3	173	-61	-90	0	0	0	109.5	I97 F103 W119 F122 A124 F125 Y128 L142 I177 C178	I97-F149 HydrophobicContact CB-CB 3.94Å; I97-F149 HydrophobicContact CG1-CB 3.51Å; I97-F149 WeakPolarHBondContact CG1-O 3.29Å; I97-F149 PolarHBondContact N-O 2.95Å; F103-F149 HydrophobicContact CE1-CB 3.85Å; F103-F149 HydrophobicContact CE1-CD1 4.1Å; F103-F149 AromaticContact CE1-CD2 3.99Å; F103-F149 HydrophobicContact CE1-CD2 3.99Å; F103-F149 AromaticContact CE1-CG 3.7Å; F103-F149 HydrophobicContact CE1-CG 3.7Å; F103-F149 HydrophobicContact CZ-CB 4.3Å; F103-F149 AromaticContact CZ-CD2 3.76Å; F103-F149 HydrophobicContact CZ-CD2 3.76Å; F103-F149 HydrophobicContact CZ-CE2 4.21Å; F103-F149 AromaticContact CZ-CG 3.98Å; F103-F149 HydrophobicContact CZ-CG 3.98Å; W119-F149 AromaticContact CE3-CD1 3.83Å; W119-F149 HydrophobicContact CE3-CD1 3.83Å; W119-F149 HydrophobicContact CH2-CB 4.09Å; W119-F149 HydrophobicContact CZ3-CB 3.89Å; W119-F149 AromaticContact CZ3-CD1 3.72Å; W119-F149 HydrophobicContact CZ3-CD1 3.72Å; W119-F149 HydrophobicContact CZ3-CG 4.25Å; F122-F149 HydrophobicContact CB-CE1 4.23Å; F122-F149 HydrophobicContact CD2-CD1 4.48Å; F122-F149 HydrophobicContact CD2-CE1 4.32Å; F122-F149 HydrophobicContact CG-CE1 4.47Å; A124-F149 HydrophobicContact CB-CZ 3.94Å; F125-F149 HydrophobicContact CB-CE1 3.96Å; F125-F149 HydrophobicContact CB-CZ 4.11Å; F125-F149 HydrophobicContact CD2-CE1 4.32Å; F125-F149 HydrophobicContact CD2-CZ 4.41Å; Y128-F149 HydrophobicContact CD2-CE2 4.22Å; Y128-F149 HydrophobicContact CD2-CZ 4.46Å; Y128-F149 HydrophobicContact CE2-CE2 4.02Å; L142-F149 HydrophobicContact CD1-CD2 3.76Å; L142-F149 HydrophobicContact CD1-CE2 3.79Å; F149-I177 CarbonylContact C-O 3.54Å; F149-I177 WeakPolarHBondContact CA-O 3.35Å; F149-C178 HydrophobicContact CD1-CB 4.2Å; F149-C178 HydrophobicContact CE1-CB 4.22Å
150	M	98.6	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	161.2	179.8	-55.5	172.3	-82.2	0	0	111.3	L39 L72 E95 I96 W119 I148 W152 I177 F179	L39-M150 HydrophobicContact CD1-CE 4.25Å; L39-M150 HydrophobicContact CD1-SD 4.48Å; L39-M150 HydrophobicContact CD2-SD 4.2Å; L72-M150 HydrophobicContact CD2-CG 4.24Å; L72-M150 HydrophobicContact CD2-SD 3.29Å; L72-M150 WeakPolarHBondContact CD2-SD 3.29Å; E95-M150 CarbonylContact O-C 3.5Å; E95-M150 WeakPolarHBondContact O-CA 3.38Å; E95-M150 WeakPolarHBondContact O-CB 3.21Å; I96-M150 HydrophobicContact CB-CG 4.46Å; I96-M150 HydrophobicContact CG1-CG 4.06Å; I96-M150 HydrophobicContact CG1-SD 4.3Å; W119-M150 WeakPolarHBondContact CH2-O 3.02Å; I148-M150 HydrophobicContact CG2-CG 3.96Å; I148-M150 HydrophobicContact CG2-SD 4.32Å; M150-W152 HydrophobicContact CE-CZ2 4.15Å; M150-I177 HydrophobicContact CB-CB 4.09Å; M150-I177 HydrophobicContact CB-CG2 4.48Å; M150-I177 HydrophobicContact CE-CB 4.47Å; M150-I177 HydrophobicContact CE-CG2 3.61Å; M150-I177 PolarHBondContact N-O 2.78Å; M150-I177 PolarHBondContact O-N 3.46Å; M150-F179 HydrophobicContact CE-CB 3.59Å
151	R	98.8	Very high	93.6	Very high	3 Å²	3	51.3 Å²	51.3	1%	0.011	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127.3	164.4	-70.1	175.2	-69.1	-95.5	-11.5	109.9	G94 E95 P102 F103 T105 W108 W119 F174 Y175	G94-R151 CarbonylContact C-O 3.56Å; G94-R151 WeakPolarHBondContact CA-O 3.29Å; E95-R151 PolarHBondContact N-O 3.39Å; E95-R151 PolarHBondContact O-N 2.89Å; E95-R151 IonicContact OE2-CZ 3.82Å; E95-R151 IonicContact OE2-NE 3.32Å; E95-R151 PolarHBondContact OE2-NE 2.88Å; E95-R151 IonicContact OE2-NH2 3.44Å; E95-R151 PolarHBondContact OE2-NH2 3.09Å; P102-R151 VanDerWaalsContact O-CZ 3.29Å; P102-R151 PolarHBondContact O-NH1 2.97Å; P102-R151 PolarHBondContact O-NH2 3.43Å; F103-R151 PolarHBondContact O-NH1 3Å; F103-R151 VanDerWaalsContact O-NH1 3.14Å; T105-R151 WeakPolarHBondContact OG1-CD 3.45Å; W108-R151 HydrophobicContact CZ3-CB 4.01Å; W119-R151 HydrophobicContact CH2-CG 4.18Å; W119-R151 HydrophobicContact CZ2-CG 3.99Å; R151-F174 HydrophobicContact CB-CD2 4.24Å; R151-F174 HydrophobicContact CG-CD2 4.23Å; R151-F174 HydrophobicContact CG-CE2 4.09Å; R151-Y175 CarbonylContact C-O 3.58Å; R151-Y175 WeakPolarHBondContact CA-O 3.29Å
152	W	98.6	Very high	93.2	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.7	178.3	-63.7	-4.1	0	0	0	110.9	V60 L62 L72 F92 M150 F174 Y175 I177 I186	V60-W152 HydrophobicContact CG1-CH2 3.9Å; V60-W152 HydrophobicContact CG1-CZ3 3.96Å; V60-W152 HydrophobicContact CG2-CZ3 4.06Å; L62-W152 HydrophobicContact CD2-CH2 4.42Å; L62-W152 HydrophobicContact CD2-CZ2 4.32Å; L72-W152 HydrophobicContact CD1-CZ2 4.24Å; F92-W152 HydrophobicContact CD2-CB 3.82Å; F92-W152 AromaticContact CD2-CD2 3.98Å; F92-W152 HydrophobicContact CD2-CD2 3.98Å; F92-W152 HydrophobicContact CD2-CE3 4.32Å; F92-W152 AromaticContact CD2-CG 3.77Å; F92-W152 HydrophobicContact CD2-CG 3.77Å; F92-W152 HydrophobicContact CE1-CE3 4.37Å; F92-W152 HydrophobicContact CE1-CZ3 4.49Å; F92-W152 HydrophobicContact CE2-CB 4.26Å; F92-W152 AromaticContact CE2-CD2 3.51Å; F92-W152 HydrophobicContact CE2-CD2 3.51Å; F92-W152 AromaticContact CE2-CE2 3.78Å; F92-W152 AromaticContact CE2-CE3 3.87Å; F92-W152 HydrophobicContact CE2-CE3 3.87Å; F92-W152 AromaticContact CE2-CG 3.7Å; F92-W152 HydrophobicContact CE2-CG 3.7Å; F92-W152 HydrophobicContact CE2-CZ2 4.32Å; F92-W152 HydrophobicContact CE2-CZ3 4.41Å; F92-W152 HydrophobicContact CG-CB 4.45Å; F92-W152 AromaticContact CZ-CD2 3.97Å; F92-W152 HydrophobicContact CZ-CD2 3.97Å; F92-W152 AromaticContact CZ-CE3 3.89Å; F92-W152 HydrophobicContact CZ-CE3 3.89Å; F92-W152 HydrophobicContact CZ-CH2 4.2Å; F92-W152 HydrophobicContact CZ-CZ2 4.3Å; F92-W152 HydrophobicContact CZ-CZ3 4.02Å; M150-W152 HydrophobicContact CE-CZ2 4.15Å; W152-F174 CarbonylContact O-C 3.53Å; W152-F174 VanDerWaalsContact O-CA 3.28Å; W152-F174 WeakPolarHBondContact O-CA 3.24Å; W152-F174 WeakPolarHBondContact O-CB 3.42Å; W152-Y175 PolarHBondContact N-O 2.85Å; W152-Y175 PolarHBondContact O-N 2.84Å; W152-I177 HydrophobicContact CB-CG1 4.38Å; W152-I177 HydrophobicContact CD2-CD1 4.04Å; W152-I177 HydrophobicContact CD2-CG1 3.7Å; W152-I177 HydrophobicContact CE3-CD1 3.92Å; W152-I177 HydrophobicContact CE3-CG1 4.13Å; W152-I177 HydrophobicContact CG-CG1 3.81Å; W152-I177 HydrophobicContact CZ2-CG2 4.31Å; W152-I177 HydrophobicContact CZ3-CD1 4.29Å; W152-I186 HydrophobicContact CH2-CD1 3.8Å; W152-I186 HydrophobicContact CH2-CG2 4.38Å; W152-I186 HydrophobicContact CZ2-CD1 4.29Å
153	K	98.1	Very high	92.7	Very high	25 Å²	25	54.1 Å²	54.1	11%	0.109	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	109.9	177.6	-178.1	73.1	-164.4	83.7	0	109.9	F92 A93 W108 Q155 F171 A172 G173 F174	F92-K153 WeakPolarHBondContact CA-O 3.36Å; A93-K153 PolarHBondContact N-O 2.86Å; A93-K153 PolarHBondContact O-N 2.96Å; W108-K153 HydrophobicContact CD2-CD 4.21Å; W108-K153 HydrophobicContact CG-CD 4.39Å; W108-K153 HydrophobicContact CH2-CB 3.91Å; W108-K153 HydrophobicContact CZ2-CB 3.76Å; W108-K153 HydrophobicContact CZ2-CD 4.37Å; W108-K153 HydrophobicContact CZ2-CG 3.96Å; K153-Q155 PolarHBondContact O-NE2 2.75Å; K153-Q155 VanDerWaalsContact O-NE2 3.15Å; K153-F171 PolarHBondContact NZ-O 2.71Å; K153-A172 WeakPolarHBondContact CE-O 3.33Å; K153-A172 PolarHBondContact NZ-O 3.33Å; K153-G173 WeakPolarHBondContact CD-O 3.33Å; K153-G173 WeakPolarHBondContact CE-O 3.25Å; K153-G173 PolarHBondContact NZ-O 2.8Å; K153-F174 HydrophobicContact CB-CB 4.35Å; K153-F174 HydrophobicContact CD-CB 3.83Å
154	E	96.8	Very high	92.2	Very high	12 Å²	12	55.1 Å²	55.1	6%	0.056	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	137.1	168.6	-64.7	172.3	100.2	0	0	110.2	T90 F91 F92 F171 Y175	T90-E154 VanDerWaalsContact CB-OE1 3.29Å; T90-E154 WeakPolarHBondContact CB-OE1 3.43Å; T90-E154 VanDerWaalsContact CG2-OE1 3.29Å; T90-E154 WeakPolarHBondContact CG2-OE1 3.27Å; T90-E154 PolarHBondContact OG1-OE1 3Å; F91-E154 WeakPolarHBondContact O-CA 3.37Å; F92-E154 HydrophobicContact CB-CG 4.19Å; E154-F171 HydrophobicContact CB-CB 3.89Å; E154-F171 HydrophobicContact CB-CD2 4.4Å; E154-F171 HydrophobicContact CG-CB 4.45Å; E154-F171 WeakPolarHBondContact OE2-CB 3.48Å; E154-Y175 HydrophobicContact CG-CE2 4.44Å; E154-Y175 WeakPolarHBondContact OE2-CE2 3.35Å
155	Q	93	Very high	91.6	Very high	96 Å²	96	57.8 Å²	57.8	45%	0.449	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-52	-174.4	-59.6	-63.3	-42.2	0	0	111.6	F91 A93 K153	F91-Q155 HydrophobicContact CD1-CB 4.19Å; F91-Q155 HydrophobicContact CD1-CG 4.14Å; F91-Q155 HydrophobicContact CE1-CG 4.42Å; F91-Q155 PolarHBondContact O-N 3.31Å; A93-Q155 HydrophobicContact CB-CG 4.44Å; K153-Q155 PolarHBondContact O-NE2 2.75Å; K153-Q155 VanDerWaalsContact O-NE2 3.15Å
156	F	92.8	Very high	91.1	Very high	82 Å²	82	57.7 Å²	57.7	36%	0.36	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	160.5	-174.9	51.3	-98.2	0	0	0	111.3	T90 F91 V158 H161	T90-F156 CarbonylContact C-O 3.55Å; T90-F156 VanDerWaalsContact CA-O 3.31Å; T90-F156 WeakPolarHBondContact CA-O 3.43Å; F91-F156 HydrophobicContact CB-CD2 4.05Å; F91-F156 HydrophobicContact CB-CE1 4.38Å; F91-F156 HydrophobicContact CB-CE2 3.57Å; F91-F156 HydrophobicContact CB-CZ 3.75Å; F91-F156 AromaticContact CD1-CE1 3.75Å; F91-F156 HydrophobicContact CD1-CE1 3.75Å; F91-F156 HydrophobicContact CD1-CE2 4.33Å; F91-F156 AromaticContact CD1-CZ 3.61Å; F91-F156 HydrophobicContact CD1-CZ 3.61Å; F91-F156 HydrophobicContact CE1-CE1 4.47Å; F91-F156 HydrophobicContact CE1-CZ 4.41Å; F91-F156 HydrophobicContact CG-CE1 4.35Å; F91-F156 HydrophobicContact CG-CE2 4.11Å; F91-F156 AromaticContact CG-CZ 3.79Å; F91-F156 HydrophobicContact CG-CZ 3.79Å; F91-F156 PolarHBondContact N-O 3.4Å; F156-V158 HydrophobicContact CD2-CG2 4.21Å; F156-V158 HydrophobicContact CE2-CG2 4.11Å; F156-H161 HydrophobicContact CB-CB 4Å; F156-H161 HydrophobicContact CD2-CB 3.84Å; F156-H161 HydrophobicContact CG-CB 4.04Å
157	L	92.4	Very high	90.2	Very high	10 Å²	10	59.9 Å²	59.9	5%	0.052	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	152.8	174.3	-71.2	159	0	0	0	111.6	L88 T89 T90 D160 H161 I163 I166 F171	L88-L157 HydrophobicContact CB-CD2 4.49Å; L88-L157 HydrophobicContact CD2-CD2 4.06Å; T89-L157 CarbonylContact O-C 3.53Å; T89-L157 WeakPolarHBondContact O-CA 3.43Å; T90-L157 HydrophobicContact CG2-CD2 3.65Å; T90-L157 HydrophobicContact CG2-CG 4.31Å; L157-D160 WeakPolarHBondContact CB-O 3.41Å; L157-D160 CarbonylContact O-C 3.52Å; L157-H161 WeakPolarHBondContact O-CA 3.28Å; L157-H161 PolarHBondContact O-N 3.09Å; L157-I163 HydrophobicContact CD1-CB 3.79Å; L157-I163 HydrophobicContact CD1-CG2 3.59Å; L157-I166 HydrophobicContact CD1-CD1 3.47Å; L157-I166 VanDerWaalsContact CD1-CD1 3.47Å; L157-I166 HydrophobicContact CD1-CG1 3.91Å; L157-I166 HydrophobicContact CD2-CD1 3.9Å; L157-I166 HydrophobicContact CG-CD1 4.24Å; L157-F171 HydrophobicContact CD1-CE1 3.83Å; L157-F171 HydrophobicContact CD1-CZ 4.36Å; L157-F171 HydrophobicContact CD2-CE1 4.46Å; L157-F171 HydrophobicContact CG-CD1 4.49Å; L157-F171 HydrophobicContact CG-CE1 3.86Å; L157-F171 HydrophobicContact CG-CZ 4.28Å
158	V	89.8	Confident	89	Confident	53 Å²	53	60.1 Å²	60.1	32%	0.321	34%	0.338	S	S	.	.	S	Bend	trans	-125.8	133.2	176.1	179.7	0	0	0	0	107.8	Y75 T89 F91 F156	Y75-V158 HydrophobicContact CD1-CG2 4.22Å; Y75-V158 HydrophobicContact CE1-CG2 3.92Å; T89-V158 HydrophobicContact CG2-CB 4.49Å; T89-V158 PolarHBondContact O-N 2.62Å; F91-V158 HydrophobicContact CB-CG2 4.28Å; F156-V158 HydrophobicContact CD2-CG2 4.21Å; F156-V158 HydrophobicContact CE2-CG2 4.11Å
159	P	86.9	Confident	88.1	Confident	126 Å²	126	60.6 Å²	60.6	82%	0.818	34%	0.343	S	S	*	.	S	Bend	cis	-82.1	-19.6	7.3	33	-35.8	0	0	0	115	H161	P159-H161 PolarHBondContact O-N 3.36Å
160	D	86.3	Confident	87.3	Confident	68 Å²	68	63.8 Å²	63.8	36%	0.364	37%	0.366	S	S	.	.			trans	-94.1	97.6	-174	-167.2	-12.4	0	0	0	111.9	L157 T162 I163	L157-D160 WeakPolarHBondContact CB-O 3.41Å; L157-D160 CarbonylContact O-C 3.52Å; D160-T162 PolarHBondContact O-N 3.33Å; D160-T162 WeakPolarHBondContact OD1-CB 3.32Å; D160-T162 PolarHBondContact OD1-N 3.07Å; D160-T162 PolarHBondContact OD1-OG1 3.4Å; D160-I163 HydrophobicContact CB-CD1 3.95Å; D160-I163 HydrophobicContact CB-CG1 4.25Å
161	H	84.9	Confident	86.7	Confident	126 Å²	126	65 Å²	65	58%	0.583	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-4.1	178.9	65.7	-83.6	0	0	0	113.6	F156 L157 P159	F156-H161 HydrophobicContact CB-CB 4Å; F156-H161 HydrophobicContact CD2-CB 3.84Å; F156-H161 HydrophobicContact CG-CB 4.04Å; L157-H161 WeakPolarHBondContact O-CA 3.28Å; L157-H161 PolarHBondContact O-N 3.09Å; P159-H161 PolarHBondContact O-N 3.36Å
162	T	84.3	Confident	86.2	Confident	92 Å²	92	67.4 Å²	67.4	56%	0.564	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-21.7	-179.6	73.7	0	0	0	0	112.4	D160 K164	D160-T162 PolarHBondContact O-N 3.33Å; D160-T162 WeakPolarHBondContact OD1-CB 3.32Å; D160-T162 PolarHBondContact OD1-N 3.07Å; D160-T162 PolarHBondContact OD1-OG1 3.4Å; T162-K164 PolarHBondContact O-N 3.07Å
163	I	83.4	Confident	86.1	Confident	51 Å²	51	67.5 Å²	67.5	26%	0.262	39%	0.392	S	S	.	.			trans	-73.1	118.3	175.9	-57.5	173.4	0	0	0	109	L157 D160 I166	L157-I163 HydrophobicContact CD1-CB 3.79Å; L157-I163 HydrophobicContact CD1-CG2 3.59Å; D160-I163 HydrophobicContact CB-CD1 3.95Å; D160-I163 HydrophobicContact CB-CG1 4.25Å; I163-I166 HydrophobicContact CG2-CG1 4.18Å
164	K	79.7	Confident	86.1	Confident	163 Å²	163	66.3 Å²	66.3	71%	0.709	39%	0.387	S	S	*	.			trans	-107.4	-30.6	179.4	-65.3	-173.2	179.6	-177.8	0	113.5	T162	T162-K164 PolarHBondContact O-N 3.07Å
165	D	79	Confident	86.1	Confident	149 Å²	149	66 Å²	66	80%	0.797	39%	0.386	S	S	*	.			trans	-121.7	129.1	-176	-61.5	-57.6	0	0	0	109
166	I	81.3	Confident	86.4	Confident	17 Å²	17	61.5 Å²	61.5	9%	0.087	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-117.1	131.3	173.3	-60.4	163.6	0	0	0	107.2	T82 Y85 L88 L157 I163 G168 A169 F171	T82-I166 HydrophobicContact CG2-CG2 3.9Å; Y85-I166 HydrophobicContact CD2-CG2 4.09Å; L88-I166 HydrophobicContact CD1-CD1 3.87Å; L88-I166 HydrophobicContact CD2-CD1 3.64Å; L88-I166 HydrophobicContact CG-CD1 4.38Å; L157-I166 HydrophobicContact CD1-CD1 3.47Å; L157-I166 VanDerWaalsContact CD1-CD1 3.47Å; L157-I166 HydrophobicContact CD1-CG1 3.91Å; L157-I166 HydrophobicContact CD2-CD1 3.9Å; L157-I166 HydrophobicContact CG-CD1 4.24Å; I163-I166 HydrophobicContact CG2-CG1 4.18Å; I166-G168 PolarHBondContact O-N 2.86Å; I166-A169 HydrophobicContact CB-CB 4.15Å; I166-A169 HydrophobicContact CG2-CB 4.03Å; I166-A169 PolarHBondContact O-N 3.23Å; I166-F171 HydrophobicContact CD1-CE1 4.31Å
167	S	76.5	Confident	86.7	Confident	100 Å²	100	57.6 Å²	57.6	70%	0.699	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	122.2	174.9	-170.8	0	0	0	0	110.4	T82 A169	T82-S167 WeakPolarHBondContact CG2-O 3.16Å; S167-A169 VanDerWaalsContact C-N 3.32Å; S167-A169 PolarHBondContact O-N 3.46Å
168	G	72.5	Confident	87	Confident	76 Å²	76	57.4 Å²	57.4	78%	0.784	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	3.2	179.1	0	0	0	0	0	115.8	I166	I166-G168 PolarHBondContact O-N 2.86Å
169	A	78.9	Confident	87.4	Confident	21 Å²	21	54.9 Å²	54.9	17%	0.174	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-140.7	151.5	177.2	0	0	0	0	0	112.2	L81 T82 L88 I166 S167	L81-A169 HydrophobicContact CD2-CB 3.55Å; L81-A169 HydrophobicContact CG-CB 4.03Å; T82-A169 HydrophobicContact CG2-CB 3.79Å; L88-A169 HydrophobicContact CD1-CB 4.4Å; I166-A169 HydrophobicContact CB-CB 4.15Å; I166-A169 HydrophobicContact CG2-CB 4.03Å; I166-A169 PolarHBondContact O-N 3.23Å; S167-A169 VanDerWaalsContact C-N 3.32Å; S167-A169 PolarHBondContact O-N 3.46Å
170	S	81.1	Confident	87.8	Confident	68 Å²	68	51 Å²	51	48%	0.476	30%	0.303	S	S	.	.			trans	-148.7	137.2	174.1	-177	0	0	0	0	110.9	A172 Y190	S170-A172 WeakPolarHBondContact OG-CB 3.28Å; S170-A172 PolarHBondContact OG-N 3.18Å; S170-Y190 PolarHBondContact O-OH 2.85Å
171	F	85.1	Confident	88.2	Confident	27 Å²	27	50.3 Å²	50.3	12%	0.118	30%	0.296	C	S	.	.			trans	-110.5	20.4	173.1	55.7	-93.2	0	0	0	111.7	T90 K153 E154 L157 I166 G173	T90-F171 HydrophobicContact CG2-CB 4.38Å; T90-F171 HydrophobicContact CG2-CD1 4.37Å; T90-F171 HydrophobicContact CG2-CG 4.31Å; K153-F171 PolarHBondContact NZ-O 2.71Å; E154-F171 HydrophobicContact CB-CB 3.89Å; E154-F171 HydrophobicContact CB-CD2 4.4Å; E154-F171 HydrophobicContact CG-CB 4.45Å; E154-F171 WeakPolarHBondContact OE2-CB 3.48Å; L157-F171 HydrophobicContact CD1-CE1 3.83Å; L157-F171 HydrophobicContact CD1-CZ 4.36Å; L157-F171 HydrophobicContact CD2-CE1 4.46Å; L157-F171 HydrophobicContact CG-CD1 4.49Å; L157-F171 HydrophobicContact CG-CE1 3.86Å; L157-F171 HydrophobicContact CG-CZ 4.28Å; I166-F171 HydrophobicContact CD1-CE1 4.31Å; F171-G173 VanDerWaalsContact C-N 3.28Å; F171-G173 PolarHBondContact O-N 3.24Å
172	A	89.9	Confident	88.5	Confident	52 Å²	52	48.2 Å²	48.2	43%	0.43	30%	0.296	S	S	.	.	S	Bend	trans	-67.6	-28.6	-179.2	0	0	0	0	0	112.8	K153 S170	K153-A172 WeakPolarHBondContact CE-O 3.33Å; K153-A172 PolarHBondContact NZ-O 3.33Å; S170-A172 WeakPolarHBondContact OG-CB 3.28Å; S170-A172 PolarHBondContact OG-N 3.18Å
173	G	94.7	Very high	89	Confident	3 Å²	3	47.3 Å²	47.3	3%	0.031	29%	0.29	C	S	.	.	S	Bend	trans	-76.1	-164	176.7	0	0	0	0	0	114.2	K153 F171 Y190 Y191	K153-G173 WeakPolarHBondContact CD-O 3.33Å; K153-G173 WeakPolarHBondContact CE-O 3.25Å; K153-G173 PolarHBondContact NZ-O 2.8Å; F171-G173 VanDerWaalsContact C-N 3.28Å; F171-G173 PolarHBondContact O-N 3.24Å; G173-Y190 WeakPolarHBondContact CA-OH 3.41Å; G173-Y190 PolarHBondContact N-OH 3.08Å; G173-Y191 CarbonylContact C-O 2.95Å; G173-Y191 WeakPolarHBondContact CA-O 3.42Å
174	F	98.1	Very high	89.5	Confident	0 Å²	0	45 Å²	45	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	165	175.7	69.9	-83.5	0	0	0	110.3	T105 W108 A110 R151 W152 K153 Y176 Y191	T105-F174 HydrophobicContact CG2-CE2 4.4Å; T105-F174 HydrophobicContact CG2-CZ 3.98Å; W108-F174 HydrophobicContact CB-CD1 3.52Å; W108-F174 HydrophobicContact CB-CE1 3.57Å; W108-F174 HydrophobicContact CD2-CD1 4.13Å; W108-F174 HydrophobicContact CD2-CG 4.34Å; W108-F174 HydrophobicContact CE3-CB 4.1Å; W108-F174 AromaticContact CE3-CD1 3.71Å; W108-F174 HydrophobicContact CE3-CD1 3.71Å; W108-F174 AromaticContact CE3-CD2 3.89Å; W108-F174 HydrophobicContact CE3-CD2 3.89Å; W108-F174 HydrophobicContact CE3-CE1 4.01Å; W108-F174 HydrophobicContact CE3-CE2 4.2Å; W108-F174 AromaticContact CE3-CG 3.63Å; W108-F174 HydrophobicContact CE3-CG 3.63Å; W108-F174 HydrophobicContact CE3-CZ 4.25Å; W108-F174 HydrophobicContact CG-CD1 4.12Å; W108-F174 HydrophobicContact CG-CE1 4.45Å; W108-F174 HydrophobicContact CZ3-CB 4.44Å; W108-F174 HydrophobicContact CZ3-CD2 4.17Å; W108-F174 HydrophobicContact CZ3-CG 4.2Å; A110-F174 HydrophobicContact CB-CE1 3.93Å; A110-F174 HydrophobicContact CB-CZ 3.68Å; R151-F174 HydrophobicContact CB-CD2 4.24Å; R151-F174 HydrophobicContact CG-CD2 4.23Å; R151-F174 HydrophobicContact CG-CE2 4.09Å; W152-F174 CarbonylContact O-C 3.53Å; W152-F174 VanDerWaalsContact O-CA 3.28Å; W152-F174 WeakPolarHBondContact O-CA 3.24Å; W152-F174 WeakPolarHBondContact O-CB 3.42Å; K153-F174 HydrophobicContact CB-CB 4.35Å; K153-F174 HydrophobicContact CD-CB 3.83Å; F174-Y176 HydrophobicContact CD2-CD2 4.49Å; F174-Y176 HydrophobicContact CD2-CE2 4.4Å; F174-Y176 HydrophobicContact CE2-CD1 4.37Å; F174-Y176 AromaticContact CE2-CD2 3.82Å; F174-Y176 HydrophobicContact CE2-CD2 3.82Å; F174-Y176 HydrophobicContact CE2-CE1 4.01Å; F174-Y176 AromaticContact CE2-CE2 3.4Å; F174-Y176 HydrophobicContact CE2-CE2 3.4Å; F174-Y176 HydrophobicContact CE2-CG 4.29Å; F174-Y176 AromaticContact CE2-CZ 3.51Å; F174-Y176 HydrophobicContact CZ-CD2 4.34Å; F174-Y176 HydrophobicContact CZ-CE1 4.39Å; F174-Y176 AromaticContact CZ-CE2 3.5Å; F174-Y176 HydrophobicContact CZ-CE2 3.5Å; F174-Y176 VanDerWaalsContact CZ-CE2 3.5Å; F174-Y176 AromaticContact CZ-CZ 3.53Å; F174-Y176 WeakPolarHBondContact CZ-OH 3.26Å; F174-Y191 HydrophobicContact CD1-CD1 4.24Å; F174-Y191 AromaticContact CE1-CD1 3.55Å; F174-Y191 HydrophobicContact CE1-CD1 3.55Å; F174-Y191 HydrophobicContact CE1-CE1 4.27Å; F174-Y191 HydrophobicContact CE1-CG 4.49Å; F174-Y191 HydrophobicContact CZ-CD1 4.05Å; F174-Y191 PolarHBondContact N-O 3.31Å; F174-Y191 PolarHBondContact O-N 2.88Å
175	Y	98.5	Very high	90.3	Very high	7 Å²	7	39.5 Å²	39.5	3%	0.027	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	133.1	176.8	-62.7	-100.2	0	0	0	110.4	Q49 L76 R151 W152 E154 I177 F189 Y190 L201	Q49-Y175 PolarHBondContact OE1-OH 3.14Å; L76-Y175 HydrophobicContact CD1-CE2 4.09Å; R151-Y175 CarbonylContact C-O 3.58Å; R151-Y175 WeakPolarHBondContact CA-O 3.29Å; W152-Y175 PolarHBondContact N-O 2.85Å; W152-Y175 PolarHBondContact O-N 2.84Å; E154-Y175 HydrophobicContact CG-CE2 4.44Å; E154-Y175 WeakPolarHBondContact OE2-CE2 3.35Å; Y175-I177 HydrophobicContact CG-CD1 4.42Å; Y175-F189 WeakPolarHBondContact CA-O 3.39Å; Y175-Y190 HydrophobicContact CD1-CD2 4.21Å; Y175-Y190 HydrophobicContact CD2-CD2 4.04Å; Y175-Y190 AromaticContact CE1-CD2 3.9Å; Y175-Y190 HydrophobicContact CE1-CD2 3.9Å; Y175-Y190 HydrophobicContact CE1-CG 4.23Å; Y175-Y190 AromaticContact CE2-CD2 3.69Å; Y175-Y190 HydrophobicContact CE2-CD2 3.69Å; Y175-Y190 HydrophobicContact CE2-CE2 4.23Å; Y175-Y190 HydrophobicContact CG-CD2 4.28Å; Y175-Y190 AromaticContact CZ-CD2 3.62Å; Y175-L201 HydrophobicContact CD1-CB 4.42Å; Y175-L201 HydrophobicContact CD1-CD2 4Å; Y175-L201 HydrophobicContact CE1-CB 4.45Å; Y175-L201 HydrophobicContact CE1-CD2 4.14Å
176	Y	98.7	Very high	91.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.8	155.5	-68.6	-92.4	0	0	0	107.9	A110 D115 H118 W119 F174 G188 F189 Y191	A110-Y176 WeakPolarHBondContact CB-OH 3.41Å; D115-Y176 VanDerWaalsContact OD1-CE1 3.3Å; D115-Y176 WeakPolarHBondContact OD1-CE1 3.19Å; D115-Y176 PolarHBondContact OD1-OH 2.92Å; H118-Y176 HydrophobicContact CB-CD1 3.98Å; H118-Y176 HydrophobicContact CB-CD2 3.46Å; H118-Y176 VanDerWaalsContact CB-CD2 3.46Å; H118-Y176 HydrophobicContact CB-CE1 4.07Å; H118-Y176 HydrophobicContact CB-CE2 3.55Å; H118-Y176 HydrophobicContact CB-CG 3.68Å; H118-Y176 AromaticContact CD2-CD2 3.77Å; H118-Y176 AromaticContact CD2-CE2 3.93Å; H118-Y176 AromaticContact CG-CD2 3.67Å; H118-Y176 AromaticContact CG-CE2 3.55Å; W119-Y176 AromaticContact CD2-CD1 3.64Å; W119-Y176 HydrophobicContact CD2-CD1 3.64Å; W119-Y176 HydrophobicContact CD2-CE1 4.12Å; W119-Y176 AromaticContact CE2-CD1 3.38Å; W119-Y176 AromaticContact CE2-CE1 3.58Å; W119-Y176 AromaticContact CE3-CD1 3.95Å; W119-Y176 HydrophobicContact CE3-CD1 3.95Å; W119-Y176 HydrophobicContact CG-CD1 4.28Å; W119-Y176 HydrophobicContact CG-CE1 4.42Å; W119-Y176 AromaticContact CH2-CD1 3.78Å; W119-Y176 HydrophobicContact CH2-CD1 3.78Å; W119-Y176 AromaticContact CZ2-CD1 3.48Å; W119-Y176 HydrophobicContact CZ2-CD1 3.48Å; W119-Y176 VanDerWaalsContact CZ2-CD1 3.48Å; W119-Y176 AromaticContact CZ2-CE1 3.88Å; W119-Y176 HydrophobicContact CZ2-CE1 3.88Å; W119-Y176 AromaticContact CZ3-CD1 3.99Å; W119-Y176 HydrophobicContact CZ3-CD1 3.99Å; W119-Y176 AromaticContact NE1-CD1 3.87Å; W119-Y176 AromaticContact NE1-CE1 3.57Å; F174-Y176 HydrophobicContact CD2-CD2 4.49Å; F174-Y176 HydrophobicContact CD2-CE2 4.4Å; F174-Y176 HydrophobicContact CE2-CD1 4.37Å; F174-Y176 AromaticContact CE2-CD2 3.82Å; F174-Y176 HydrophobicContact CE2-CD2 3.82Å; F174-Y176 HydrophobicContact CE2-CE1 4.01Å; F174-Y176 AromaticContact CE2-CE2 3.4Å; F174-Y176 HydrophobicContact CE2-CE2 3.4Å; F174-Y176 HydrophobicContact CE2-CG 4.29Å; F174-Y176 AromaticContact CE2-CZ 3.51Å; F174-Y176 HydrophobicContact CZ-CD2 4.34Å; F174-Y176 HydrophobicContact CZ-CE1 4.39Å; F174-Y176 AromaticContact CZ-CE2 3.5Å; F174-Y176 HydrophobicContact CZ-CE2 3.5Å; F174-Y176 VanDerWaalsContact CZ-CE2 3.5Å; F174-Y176 AromaticContact CZ-CZ 3.53Å; F174-Y176 WeakPolarHBondContact CZ-OH 3.26Å; Y176-G188 CarbonylContact O-C 3.57Å; Y176-G188 WeakPolarHBondContact O-CA 3.39Å; Y176-F189 PolarHBondContact N-O 2.63Å; Y176-F189 PolarHBondContact O-N 3.06Å; Y176-Y191 HydrophobicContact CE2-CG 4.29Å
177	I	98.7	Very high	92	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	139.7	-174.3	-57.3	-69.8	0	0	0	110	F149 M150 W152 Y175 I186 E187 L201	F149-I177 CarbonylContact C-O 3.54Å; F149-I177 WeakPolarHBondContact CA-O 3.35Å; M150-I177 HydrophobicContact CB-CB 4.09Å; M150-I177 HydrophobicContact CB-CG2 4.48Å; M150-I177 HydrophobicContact CE-CB 4.47Å; M150-I177 HydrophobicContact CE-CG2 3.61Å; M150-I177 PolarHBondContact N-O 2.78Å; M150-I177 PolarHBondContact O-N 3.46Å; W152-I177 HydrophobicContact CB-CG1 4.38Å; W152-I177 HydrophobicContact CD2-CD1 4.04Å; W152-I177 HydrophobicContact CD2-CG1 3.7Å; W152-I177 HydrophobicContact CE3-CD1 3.92Å; W152-I177 HydrophobicContact CE3-CG1 4.13Å; W152-I177 HydrophobicContact CG-CG1 3.81Å; W152-I177 HydrophobicContact CZ2-CG2 4.31Å; W152-I177 HydrophobicContact CZ3-CD1 4.29Å; Y175-I177 HydrophobicContact CG-CD1 4.42Å; I177-I186 HydrophobicContact CD1-CG2 4.34Å; I177-I186 HydrophobicContact CG2-CG2 3.66Å; I177-E187 CarbonylContact C-O 3.57Å; I177-E187 WeakPolarHBondContact CA-O 3.19Å; I177-L201 HydrophobicContact CD1-CD2 4.01Å
178	C	98.4	Very high	93.1	Very high	6 Å²	6	30 Å²	30	4%	0.041	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	118.1	167.5	-175	0	0	0	0	108.4	F122 F149 E187	F122-C178 HydrophobicContact CB-CB 4.35Å; F122-C178 HydrophobicContact CD1-CB 3.41Å; F122-C178 VanDerWaalsContact CD1-CB 3.41Å; F122-C178 HydrophobicContact CD2-CB 4.24Å; F122-C178 HydrophobicContact CE1-CB 3.62Å; F122-C178 HydrophobicContact CE2-CB 4.42Å; F122-C178 HydrophobicContact CG-CB 3.74Å; F122-C178 HydrophobicContact CZ-CB 4.13Å; F149-C178 HydrophobicContact CD1-CB 4.2Å; F149-C178 HydrophobicContact CE1-CB 4.22Å; C178-E187 PolarHBondContact N-O 3.09Å; C178-E187 PolarHBondContact O-N 3.18Å
179	F	98.1	Very high	94.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.3	173.6	168.8	-97.5	0	0	0	109.9	S37 L39 F45 Y147 I148 M150 K181 A184 T185 I186	S37-F179 WeakPolarHBondContact OG-CE1 3.31Å; L39-F179 HydrophobicContact CB-CD1 4.3Å; L39-F179 HydrophobicContact CB-CE1 3.81Å; L39-F179 HydrophobicContact CB-CZ 3.95Å; L39-F179 HydrophobicContact CD1-CD1 4.4Å; L39-F179 HydrophobicContact CD1-CD2 4.26Å; L39-F179 HydrophobicContact CD1-CE2 4.42Å; L39-F179 HydrophobicContact CD1-CG 4.23Å; F45-F179 HydrophobicContact CE1-CD2 4.4Å; F45-F179 AromaticContact CE1-CE2 3.88Å; F45-F179 HydrophobicContact CE1-CE2 3.88Å; F45-F179 AromaticContact CZ-CE2 3.92Å; F45-F179 HydrophobicContact CZ-CE2 3.92Å; Y147-F179 CarbonylContact C-O 3.5Å; Y147-F179 WeakPolarHBondContact CA-O 3.5Å; I148-F179 HydrophobicContact CB-CB 4.34Å; I148-F179 HydrophobicContact CB-CD1 4.19Å; I148-F179 HydrophobicContact CD1-CD1 3.91Å; I148-F179 HydrophobicContact CD1-CE1 4.26Å; I148-F179 HydrophobicContact CG1-CD1 4.16Å; I148-F179 PolarHBondContact N-O 3.08Å; I148-F179 PolarHBondContact O-N 3.29Å; M150-F179 HydrophobicContact CE-CB 3.59Å; F179-K181 HydrophobicContact CD1-CG 4.33Å; F179-K181 HydrophobicContact CE1-CB 4.3Å; F179-K181 HydrophobicContact CE1-CG 3.99Å; F179-A184 HydrophobicContact CE2-CB 4.18Å; F179-A184 HydrophobicContact CZ-CB 4.32Å; F179-T185 WeakPolarHBondContact CA-O 3.2Å; F179-T185 WeakPolarHBondContact CD2-O 3.44Å; F179-I186 HydrophobicContact CB-CG1 4.45Å; F179-I186 HydrophobicContact CD2-CD1 4.41Å; F179-I186 HydrophobicContact CD2-CG1 3.7Å
180	Q	96.8	Very high	95.1	Very high	45 Å²	45	26.7 Å²	26.7	21%	0.21	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119.5	174.5	-171.7	179.3	17.5	0	0	110.2	D146 Y147 S182 T183 A184 T185	D146-Q180 WeakPolarHBondContact OD2-CG 3.34Å; D146-Q180 PolarHBondContact OD2-NE2 2.84Å; Y147-Q180 HydrophobicContact CD1-CB 4.04Å; Y147-Q180 HydrophobicContact CD1-CG 4.14Å; Y147-Q180 HydrophobicContact CE1-CB 3.88Å; Y147-Q180 HydrophobicContact CE1-CG 3.7Å; Q180-S182 PolarHBondContact NE2-OG 3.19Å; Q180-S182 VanDerWaalsContact NE2-OG 3.14Å; Q180-T183 VanDerWaalsContact CD-OG1 3.3Å; Q180-T183 PolarHBondContact OE1-OG1 2.85Å; Q180-A184 VanDerWaalsContact O-CA 3.24Å; Q180-A184 WeakPolarHBondContact O-CA 3.43Å; Q180-A184 PolarHBondContact O-N 2.76Å; Q180-T185 PolarHBondContact N-O 3.3Å
181	K	93.3	Very high	95.9	Very high	54 Å²	54	23.8 Å²	23.8	24%	0.235	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-44.4	-175.4	-61.5	170.5	-174.7	170.4	0	111.7	K143 S145 D146 I148 F179	K143-K181 PolarHBondContact O-NZ 2.88Å; S145-K181 VanDerWaalsContact O-CE 3.31Å; S145-K181 WeakPolarHBondContact O-CE 3.29Å; S145-K181 PolarHBondContact O-NZ 3.05Å; D146-K181 WeakPolarHBondContact O-CG 3.47Å; D146-K181 PolarHBondContact O-N 3.38Å; D146-K181 WeakPolarHBondContact OD1-CB 3.42Å; I148-K181 HydrophobicContact CD1-CD 4.43Å; I148-K181 HydrophobicContact CD1-CG 4.08Å; I148-K181 HydrophobicContact CG1-CD 4.38Å; I148-K181 VanDerWaalsContact CG1-CE 3.4Å; I148-K181 HydrophobicContact CG1-CG 4.13Å; F179-K181 HydrophobicContact CD1-CG 4.33Å; F179-K181 HydrophobicContact CE1-CB 4.3Å; F179-K181 HydrophobicContact CE1-CG 3.99Å
182	S	92.4	Very high	96.4	Very high	82 Å²	82	24.4 Å²	24.4	57%	0.573	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-37.9	-176.2	59.8	0	0	0	0	114.6	D146 Q180	D146-S182 VanDerWaalsContact OD1-CB 3.29Å; D146-S182 WeakPolarHBondContact OD1-CB 3.44Å; D146-S182 PolarHBondContact OD1-N 3.48Å; D146-S182 PolarHBondContact OD1-OG 2.81Å; D146-S182 WeakPolarHBondContact OD2-CB 3.43Å; D146-S182 PolarHBondContact OD2-OG 2.77Å; Q180-S182 PolarHBondContact NE2-OG 3.19Å; Q180-S182 VanDerWaalsContact NE2-OG 3.14Å
183	T	93.3	Very high	96.5	Very high	73 Å²	73	29.3 Å²	29.3	45%	0.448	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-10.2	-177	61.9	0	0	0	0	113.4	Q180 T185	Q180-T183 VanDerWaalsContact CD-OG1 3.3Å; Q180-T183 PolarHBondContact OE1-OG1 2.85Å; T183-T185 PolarHBondContact O-N 3.3Å; T183-T185 WeakPolarHBondContact OG1-CG2 3.33Å; T183-T185 PolarHBondContact OG1-OG1 3.2Å
184	A	93.9	Very high	96.2	Very high	3 Å²	3	34 Å²	34	3%	0.025	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	45.4	-173	0	0	0	0	0	113	L38 F179 Q180 H205	L38-A184 HydrophobicContact CB-CB 3.69Å; L38-A184 HydrophobicContact CD1-CB 3.41Å; L38-A184 VanDerWaalsContact CD1-CB 3.41Å; L38-A184 HydrophobicContact CG-CB 4.1Å; F179-A184 HydrophobicContact CE2-CB 4.18Å; F179-A184 HydrophobicContact CZ-CB 4.32Å; Q180-A184 VanDerWaalsContact O-CA 3.24Å; Q180-A184 WeakPolarHBondContact O-CA 3.43Å; Q180-A184 PolarHBondContact O-N 2.76Å; A184-H205 HydrophobicContact CB-CB 3.61Å; A184-H205 WeakPolarHBondContact O-CB 3.4Å; A184-H205 PolarHBondContact O-N 2.97Å
185	T	96.6	Very high	95.7	Very high	47 Å²	47	35.6 Å²	35.6	29%	0.288	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	146.5	175.4	58.5	0	0	0	0	110.1	F179 Q180 T183 L203 T204	F179-T185 WeakPolarHBondContact CA-O 3.2Å; F179-T185 WeakPolarHBondContact CD2-O 3.44Å; Q180-T185 PolarHBondContact N-O 3.3Å; T183-T185 PolarHBondContact O-N 3.3Å; T183-T185 WeakPolarHBondContact OG1-CG2 3.33Å; T183-T185 PolarHBondContact OG1-OG1 3.2Å; T185-L203 WeakPolarHBondContact CA-O 3.48Å; T185-T204 HydrophobicContact CG2-CG2 4.2Å
186	I	98.4	Very high	95.3	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.3	176.1	-64	177	0	0	0	107.1	F45 W152 I177 F179 N202 L203	F45-I186 HydrophobicContact CB-CD1 4.28Å; F45-I186 HydrophobicContact CD1-CD1 3.57Å; F45-I186 HydrophobicContact CD1-CG1 3.99Å; F45-I186 HydrophobicContact CD2-CD1 3.93Å; F45-I186 HydrophobicContact CE1-CD1 3.81Å; F45-I186 HydrophobicContact CE1-CG1 4.08Å; F45-I186 HydrophobicContact CE2-CD1 4.14Å; F45-I186 HydrophobicContact CG-CD1 3.65Å; F45-I186 HydrophobicContact CZ-CD1 4.1Å; W152-I186 HydrophobicContact CH2-CD1 3.8Å; W152-I186 HydrophobicContact CH2-CG2 4.38Å; W152-I186 HydrophobicContact CZ2-CD1 4.29Å; I177-I186 HydrophobicContact CD1-CG2 4.34Å; I177-I186 HydrophobicContact CG2-CG2 3.66Å; F179-I186 HydrophobicContact CB-CG1 4.45Å; F179-I186 HydrophobicContact CD2-CD1 4.41Å; F179-I186 HydrophobicContact CD2-CG1 3.7Å; I186-N202 CarbonylContact O-C 3.48Å; I186-N202 WeakPolarHBondContact O-CA 3.23Å; I186-L203 HydrophobicContact CB-CB 4.11Å; I186-L203 HydrophobicContact CB-CD1 4.42Å; I186-L203 HydrophobicContact CD1-CD1 4.42Å; I186-L203 HydrophobicContact CG2-CD1 4.32Å; I186-L203 PolarHBondContact N-O 2.73Å; I186-L203 PolarHBondContact O-N 2.92Å
187	E	98.5	Very high	94.9	Very high	65 Å²	65	42.8 Å²	42.8	30%	0.304	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	141.3	166.6	-168.1	-176.3	-179.3	0	0	108.4	F122 I177 C178 F189 L201	F122-E187 HydrophobicContact CD1-CB 4.21Å; F122-E187 HydrophobicContact CD1-CG 4.04Å; F122-E187 HydrophobicContact CE1-CB 4Å; F122-E187 HydrophobicContact CE1-CG 3.85Å; F122-E187 WeakPolarHBondContact CE1-O 3.45Å; I177-E187 CarbonylContact C-O 3.57Å; I177-E187 WeakPolarHBondContact CA-O 3.19Å; C178-E187 PolarHBondContact N-O 3.09Å; C178-E187 PolarHBondContact O-N 3.18Å; E187-F189 HydrophobicContact CG-CE2 4.31Å; E187-L201 CarbonylContact C-O 3.57Å; E187-L201 WeakPolarHBondContact CA-O 3.43Å
188	G	98.4	Very high	94.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	162.2	179.6	0	0	0	0	0	114.3	Y176 S200 L201	Y176-G188 CarbonylContact O-C 3.57Å; Y176-G188 WeakPolarHBondContact O-CA 3.39Å; G188-S200 CarbonylContact O-C 3.58Å; G188-S200 WeakPolarHBondContact O-CA 3.43Å; G188-L201 PolarHBondContact N-O 3.36Å; G188-L201 PolarHBondContact O-N 2.91Å
189	F	98.2	Very high	94.5	Very high	20 Å²	20	47.6 Å²	47.6	9%	0.088	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.3	175.5	-61.8	-79.9	0	0	0	109.6	K121 F122 Y175 Y176 E187 Q199	K121-F189 HydrophobicContact CB-CD2 3.75Å; K121-F189 HydrophobicContact CB-CE1 4.43Å; K121-F189 HydrophobicContact CB-CE2 3.31Å; K121-F189 HydrophobicContact CB-CG 4.49Å; K121-F189 HydrophobicContact CB-CZ 3.71Å; K121-F189 HydrophobicContact CG-CD2 4.28Å; K121-F189 HydrophobicContact CG-CE2 4.15Å; K121-F189 HydrophobicContact CG-CZ 4.31Å; F122-F189 HydrophobicContact CD1-CD2 4.43Å; F122-F189 AromaticContact CD1-CE2 3.97Å; F122-F189 HydrophobicContact CD1-CE2 3.97Å; F122-F189 AromaticContact CE1-CD2 3.66Å; F122-F189 HydrophobicContact CE1-CD2 3.66Å; F122-F189 AromaticContact CE1-CE2 3.54Å; F122-F189 HydrophobicContact CE1-CE2 3.54Å; F122-F189 HydrophobicContact CE2-CD2 4.25Å; F122-F189 AromaticContact CZ-CD2 3.56Å; F122-F189 HydrophobicContact CZ-CD2 3.56Å; F122-F189 AromaticContact CZ-CE2 3.94Å; F122-F189 HydrophobicContact CZ-CE2 3.94Å; Y175-F189 WeakPolarHBondContact CA-O 3.39Å; Y176-F189 PolarHBondContact N-O 2.63Å; Y176-F189 PolarHBondContact O-N 3.06Å; E187-F189 HydrophobicContact CG-CE2 4.31Å; F189-Q199 WeakPolarHBondContact CA-O 3.45Å
190	Y	97.1	Very high	94.5	Very high	6 Å²	6	48.7 Å²	48.7	2%	0.024	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	137	173.3	-178.7	-105.2	0	0	0	110.5	S170 G173 Y175 H192 Q199	S170-Y190 PolarHBondContact O-OH 2.85Å; G173-Y190 WeakPolarHBondContact CA-OH 3.41Å; G173-Y190 PolarHBondContact N-OH 3.08Å; Y175-Y190 HydrophobicContact CD1-CD2 4.21Å; Y175-Y190 HydrophobicContact CD2-CD2 4.04Å; Y175-Y190 AromaticContact CE1-CD2 3.9Å; Y175-Y190 HydrophobicContact CE1-CD2 3.9Å; Y175-Y190 HydrophobicContact CE1-CG 4.23Å; Y175-Y190 AromaticContact CE2-CD2 3.69Å; Y175-Y190 HydrophobicContact CE2-CD2 3.69Å; Y175-Y190 HydrophobicContact CE2-CE2 4.23Å; Y175-Y190 HydrophobicContact CG-CD2 4.28Å; Y175-Y190 AromaticContact CZ-CD2 3.62Å; Y190-H192 HydrophobicContact CE1-CB 3.7Å; Y190-Q199 PolarHBondContact N-O 3Å
191	Y	96.8	Very high	94.5	Very high	8 Å²	8	46.6 Å²	46.6	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.2	173.2	175.6	-100.7	0	0	0	111.3	D109 A110 V114 H118 G173 F174 Y176 W197	D109-Y191 PolarHBondContact O-OH 2.75Å; D109-Y191 VanDerWaalsContact O-OH 3.11Å; A110-Y191 HydrophobicContact CB-CD1 4.41Å; A110-Y191 HydrophobicContact CB-CE1 4.1Å; V114-Y191 HydrophobicContact CB-CE2 4.48Å; V114-Y191 HydrophobicContact CG1-CD1 4.11Å; V114-Y191 HydrophobicContact CG1-CD2 3.78Å; V114-Y191 HydrophobicContact CG1-CE1 3.84Å; V114-Y191 HydrophobicContact CG1-CE2 3.47Å; V114-Y191 VanDerWaalsContact CG1-CE2 3.47Å; V114-Y191 HydrophobicContact CG1-CG 4.06Å; V114-Y191 HydrophobicContact CG2-CE2 4.09Å; H118-Y191 AromaticContact CE1-CD2 3.32Å; H118-Y191 WeakPolarHBondContact CE1-CD2 3.37Å; H118-Y191 AromaticContact CE1-CE2 3.97Å; H118-Y191 AromaticContact NE2-CD2 3.5Å; H118-Y191 WeakPolarHBondContact NE2-CD2 3.44Å; G173-Y191 CarbonylContact C-O 2.95Å; G173-Y191 WeakPolarHBondContact CA-O 3.42Å; F174-Y191 HydrophobicContact CD1-CD1 4.24Å; F174-Y191 AromaticContact CE1-CD1 3.55Å; F174-Y191 HydrophobicContact CE1-CD1 3.55Å; F174-Y191 HydrophobicContact CE1-CE1 4.27Å; F174-Y191 HydrophobicContact CE1-CG 4.49Å; F174-Y191 HydrophobicContact CZ-CD1 4.05Å; F174-Y191 PolarHBondContact N-O 3.31Å; F174-Y191 PolarHBondContact O-N 2.88Å; Y176-Y191 HydrophobicContact CE2-CG 4.29Å; Y191-W197 HydrophobicContact CE2-CZ2 4.02Å
192	H	94.8	Very high	94.8	Very high	39 Å²	39	47.7 Å²	47.7	18%	0.181	25%	0.247	C	C	.	.			trans	-151.3	138.9	163.8	-178.9	-109.4	0	0	0	107.8	Y190 S194 S195	Y190-H192 HydrophobicContact CE1-CB 3.7Å; H192-S194 VanDerWaalsContact C-N 3.25Å; H192-S194 PolarHBondContact CE1-OG 3.47Å; H192-S194 PolarHBondContact ND1-OG 3.07Å; H192-S194 VanDerWaalsContact ND1-OG 3.1Å; H192-S194 PolarHBondContact O-N 2.97Å; H192-S194 VanDerWaalsContact O-N 3.13Å; H192-S195 PolarHBondContact ND1-OG 2.95Å; H192-S195 PolarHBondContact O-N 2.85Å; H192-S195 VanDerWaalsContact O-N 3.08Å
193	R	91.9	Very high	95	Very high	156 Å²	156	43.9 Å²	43.9	59%	0.589	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-37.8	-170.3	-178.3	-179.8	-68.3	167.8	4.5	113.7	D109	D109-R193 VanDerWaalsContact CB-NH2 3.26Å; D109-R193 VanDerWaalsContact CG-NH2 3.26Å; D109-R193 IonicContact OD1-CZ 3.18Å; D109-R193 VanDerWaalsContact OD1-CZ 3.28Å; D109-R193 IonicContact OD1-NH1 3.44Å; D109-R193 IonicContact OD1-NH2 2.76Å; D109-R193 PolarHBondContact OD1-NH2 2.93Å
194	S	89.2	Confident	95.2	Very high	101 Å²	101	44.4 Å²	44.4	71%	0.706	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.2	1.8	-177.5	62.3	0	0	0	0	114.6	H192	H192-S194 VanDerWaalsContact C-N 3.25Å; H192-S194 PolarHBondContact CE1-OG 3.47Å; H192-S194 PolarHBondContact ND1-OG 3.07Å; H192-S194 VanDerWaalsContact ND1-OG 3.1Å; H192-S194 PolarHBondContact O-N 2.97Å; H192-S194 VanDerWaalsContact O-N 3.13Å
195	S	88.1	Confident	95.3	Very high	34 Å²	34	45.6 Å²	45.6	24%	0.238	23%	0.228	C	C	.	.	S	Bend	trans	-95.9	165.8	180	-60.8	0	0	0	0	111.6	H192 W197	H192-S195 PolarHBondContact ND1-OG 2.95Å; H192-S195 PolarHBondContact O-N 2.85Å; H192-S195 VanDerWaalsContact O-N 3.08Å; S195-W197 PolarHBondContact O-N 3.12Å
196	E	89	Confident	95.1	Very high	72 Å²	72	45.3 Å²	45.3	34%	0.336	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-58.9	126.5	169.1	-173.3	-172.6	153.8	0	0	110.1	K52 Q199	K52-E196 VanDerWaalsContact CB-OE1 3.29Å; K52-E196 WeakPolarHBondContact CB-OE1 3.46Å; K52-E196 WeakPolarHBondContact CD-OE1 3.21Å; K52-E196 WeakPolarHBondContact CG-OE1 3.36Å; K52-E196 PolarHBondContact N-OE1 2.84Å; E196-Q199 HydrophobicContact CB-CG 4.44Å; E196-Q199 PolarHBondContact O-NE2 3.07Å
197	W	92.1	Very high	94.5	Very high	86 Å²	86	49.3 Å²	49.3	33%	0.326	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	150.8	178.4	-76.3	36.9	0	0	0	111.7	V114 K117 H118 Y191 S195 Q199	V114-W197 HydrophobicContact CG2-CH2 4.36Å; K117-W197 HydrophobicContact CB-CZ3 4.45Å; K117-W197 HydrophobicContact CD-CH2 4.28Å; K117-W197 HydrophobicContact CD-CZ3 3.85Å; H118-W197 AromaticContact CE1-CE3 3.83Å; H118-W197 AromaticContact CE1-CZ3 3.87Å; Y191-W197 HydrophobicContact CE2-CZ2 4.02Å; S195-W197 PolarHBondContact O-N 3.12Å; W197-Q199 VanDerWaalsContact C-N 3.33Å; W197-Q199 PolarHBondContact O-N 3.2Å
198	Y	92.6	Very high	93.1	Very high	78 Å²	78	50 Å²	50	31%	0.306	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	33.3	173	-44.2	-60.9	0	0	0	114.6	K121 S200	K121-Y198 HydrophobicContact CD-CD1 4.36Å; K121-Y198 HydrophobicContact CD-CE1 4.32Å; K121-Y198 VanDerWaalsContact CE-CD1 3.44Å; K121-Y198 HydrophobicContact CG-CD1 4.1Å; K121-Y198 HydrophobicContact CG-CE1 4.12Å; Y198-S200 PolarHBondContact O-N 3.12Å
199	Q	95.3	Very high	91.1	Very high	28 Å²	28	59.1 Å²	59.1	13%	0.131	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	109.6	163	-65.7	174	60.7	0	0	108.1	K50 F189 Y190 E196 W197	K50-Q199 CarbonylContact O-C 3.53Å; K50-Q199 VanDerWaalsContact O-CA 3.29Å; K50-Q199 WeakPolarHBondContact O-CA 3.47Å; F189-Q199 WeakPolarHBondContact CA-O 3.45Å; Y190-Q199 PolarHBondContact N-O 3Å; E196-Q199 HydrophobicContact CB-CG 4.44Å; E196-Q199 PolarHBondContact O-NE2 3.07Å; W197-Q199 VanDerWaalsContact C-N 3.33Å; W197-Q199 PolarHBondContact O-N 3.2Å
200	S	97.1	Very high	88.8	Confident	24 Å²	24	62.8 Å²	62.8	17%	0.168	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	145.9	-172.3	67	0	0	0	0	111.1	Q49 K50 G188 Y198	Q49-S200 CarbonylContact C-O 3.44Å; Q49-S200 WeakPolarHBondContact CA-O 3.31Å; K50-S200 PolarHBondContact N-O 3.29Å; K50-S200 PolarHBondContact O-N 3.05Å; G188-S200 CarbonylContact O-C 3.58Å; G188-S200 WeakPolarHBondContact O-CA 3.43Å; Y198-S200 PolarHBondContact O-N 3.12Å
201	L	98.3	Very high	86.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	120.5	173.4	-179.7	67.1	0	0	0	107.4	Q49 V58 Y175 I177 E187 G188 L203	Q49-L201 HydrophobicContact CB-CD1 4.15Å; V58-L201 HydrophobicContact CB-CD1 4.15Å; V58-L201 HydrophobicContact CG1-CD1 3.96Å; V58-L201 HydrophobicContact CG2-CD1 4.14Å; Y175-L201 HydrophobicContact CD1-CB 4.42Å; Y175-L201 HydrophobicContact CD1-CD2 4Å; Y175-L201 HydrophobicContact CE1-CB 4.45Å; Y175-L201 HydrophobicContact CE1-CD2 4.14Å; I177-L201 HydrophobicContact CD1-CD2 4.01Å; E187-L201 CarbonylContact C-O 3.57Å; E187-L201 WeakPolarHBondContact CA-O 3.43Å; G188-L201 PolarHBondContact N-O 3.36Å; G188-L201 PolarHBondContact O-N 2.91Å; L201-L203 HydrophobicContact CD1-CD1 4.27Å; L201-L203 HydrophobicContact CD1-CD2 3.87Å; L201-L203 HydrophobicContact CD1-CG 4.09Å; L201-L203 HydrophobicContact CD2-CD1 4.16Å; L201-L203 HydrophobicContact CG-CD1 4.17Å; L201-L203 HydrophobicContact CG-CD2 4.41Å; L201-L203 HydrophobicContact CG-CG 4.08Å
202	N	98.3	Very high	84.4	Confident	77 Å²	77	68.4 Å²	68.4	41%	0.412	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	117.7	178.1	-77	-88.6	0	0	0	108.9	G47 H48 I186	G47-N202 CarbonylContact C-O 3.45Å; G47-N202 VanDerWaalsContact CA-O 3.28Å; G47-N202 WeakPolarHBondContact CA-O 3.47Å; H48-N202 PolarHBondContact N-O 3.44Å; H48-N202 PolarHBondContact O-N 2.8Å; I186-N202 CarbonylContact O-C 3.48Å; I186-N202 WeakPolarHBondContact O-CA 3.23Å
203	L	98.1	Very high	82.4	Confident	3 Å²	3	74.1 Å²	74.1	2%	0.016	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	149	-177.8	-43.4	167.6	0	0	0	110.8	F45 R46 V58 V60 T185 I186 L201	F45-L203 HydrophobicContact CB-CB 3.89Å; F45-L203 HydrophobicContact CB-CD1 4.21Å; R46-L203 CarbonylContact O-C 3.44Å; R46-L203 VanDerWaalsContact O-CA 3.3Å; R46-L203 WeakPolarHBondContact O-CA 3.32Å; V58-L203 HydrophobicContact CB-CD2 3.95Å; V58-L203 HydrophobicContact CG1-CD2 3.94Å; V60-L203 HydrophobicContact CB-CD1 4.07Å; V60-L203 HydrophobicContact CG2-CD1 3.61Å; T185-L203 WeakPolarHBondContact CA-O 3.48Å; I186-L203 HydrophobicContact CB-CB 4.11Å; I186-L203 HydrophobicContact CB-CD1 4.42Å; I186-L203 HydrophobicContact CD1-CD1 4.42Å; I186-L203 HydrophobicContact CG2-CD1 4.32Å; I186-L203 PolarHBondContact N-O 2.73Å; I186-L203 PolarHBondContact O-N 2.92Å; L201-L203 HydrophobicContact CD1-CD1 4.27Å; L201-L203 HydrophobicContact CD1-CD2 3.87Å; L201-L203 HydrophobicContact CD1-CG 4.09Å; L201-L203 HydrophobicContact CD2-CD1 4.16Å; L201-L203 HydrophobicContact CG-CD1 4.17Å; L201-L203 HydrophobicContact CG-CD2 4.41Å; L201-L203 HydrophobicContact CG-CG 4.08Å
204	T	97.3	Very high	80.5	Confident	84 Å²	84	75.6 Å²	75.6	52%	0.515	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	145	173.1	58.6	0	0	0	0	109.8	F45 R46 T185 V206	F45-T204 CarbonylContact C-O 3.42Å; F45-T204 VanDerWaalsContact CA-O 3.27Å; F45-T204 WeakPolarHBondContact CA-O 3.21Å; R46-T204 PolarHBondContact N-O 2.93Å; R46-T204 PolarHBondContact O-N 3.09Å; R46-T204 PolarHBondContact O-OG1 2.74Å; T185-T204 HydrophobicContact CG2-CG2 4.2Å; T204-V206 PolarHBondContact O-N 3.47Å
205	H	95.4	Very high	78.3	Confident	28 Å²	28	78.4 Å²	78.4	13%	0.13	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	136.6	176.1	179	-102.2	0	0	0	110.8	F45 A184 P207	F45-H205 HydrophobicContact CD1-CB 3.98Å; F45-H205 HydrophobicContact CE1-CB 3.68Å; F45-H205 HydrophobicContact CZ-CB 4.37Å; F45-H205 AromaticContact CZ-CD2 4Å; A184-H205 HydrophobicContact CB-CB 3.61Å; A184-H205 WeakPolarHBondContact O-CB 3.4Å; A184-H205 PolarHBondContact O-N 2.97Å; H205-P207 WeakPolarHBondContact O-CD 3.49Å
206	V	93.3	Very high	76.1	Confident	40 Å²	40	86.1 Å²	86.1	24%	0.242	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	108.1	172.8	-178.3	0	0	0	0	107.1	K44 R46 T204 E208	K44-V206 HydrophobicContact CB-CB 4.49Å; K44-V206 HydrophobicContact CG-CB 4.41Å; K44-V206 PolarHBondContact O-N 3.25Å; R46-V206 HydrophobicContact CB-CG2 3.81Å; R46-V206 HydrophobicContact CG-CG2 3.73Å; T204-V206 PolarHBondContact O-N 3.47Å; V206-E208 PolarHBondContact O-N 3.38Å
207	P	84.8	Confident	73.9	Confident	86 Å²	86	97 Å²	97	56%	0.558	48%	0.482	S	S	*	.			trans	-59.1	125.9	175.4	-20.1	31.7	0	0	0	110.1	H205	H205-P207 WeakPolarHBondContact O-CD 3.49Å
208	E	69.9	Low	73	Confident	80 Å²	80	97.5 Å²	97.5	37%	0.374	49%	0.49	S	S	.	.			trans	-86	131.2	165.7	-75.4	-172.4	166.5	0	0	109.1	K44 V206 S210	K44-E208 IonicContact NZ-OE1 2.71Å; K44-E208 PolarHBondContact NZ-OE1 3.16Å; V206-E208 PolarHBondContact O-N 3.38Å; E208-S210 PolarHBondContact O-N 3.22Å
209	H	54.9	Low	72	Confident	191 Å²	191	98.5 Å²	98.5	88%	0.884	50%	0.5	S	S	*	.	S	Bend	trans	-75.7	2.1	175.1	-65.8	-69.8	0	0	0	113
210	S	50.9	Low	70.7	Confident	97 Å²	97	102.4 Å²	102.4	68%	0.678	52%	0.52	S	S	*	.			trans	-161.8	105.7	179.1	50.7	0	0	0	0	109.6	E208	E208-S210 PolarHBondContact O-N 3.22Å
211	A	51.2	Low	69.1	Low	65 Å²	65	107.1 Å²	107.1	54%	0.537	54%	0.541	S	S	.	.			trans	-91.6	124.6	171.2	0	0	0	0	0	109.3	I213	A211-I213 PolarHBondContact O-N 2.97Å
212	A	50.6	Low	67.3	Low	68 Å²	68	113.8 Å²	113.8	56%	0.562	58%	0.575	S	S	*	*			trans	-80.8	106.4	165.2	0	0	0	0	0	107.8	Y214	A212-Y214 HydrophobicContact CB-CD2 3.93Å; A212-Y214 HydrophobicContact CB-CE2 3.3Å; A212-Y214 PolarHBondContact O-N 3.35Å
213	I	51.7	Low	65.2	Low	158 Å²	158	116.2 Å²	116.2	81%	0.81	59%	0.585	S	S	*	*			trans	-77.5	106.5	177	-58.8	175.4	0	0	0	107.3	A211	A211-I213 PolarHBondContact O-N 2.97Å
214	Y	53.1	Low	62.9	Low	188 Å²	188	124.3 Å²	124.3	74%	0.737	63%	0.626	S	S	*	*			trans	-114.3	120	167.7	-60.5	-73.7	0	0	0	108.9	A212	A212-Y214 HydrophobicContact CB-CD2 3.93Å; A212-Y214 HydrophobicContact CB-CE2 3.3Å; A212-Y214 PolarHBondContact O-N 3.35Å
215	E	41.3	Very low	60.2	Low	160 Å²	160	127.4 Å²	127.4	75%	0.748	64%	0.635	S	S	*	*			trans	-107.1	121.2	167.2	-175.2	-177.7	-161.4	0	0	106.9
216	F	43.2	Very low	57.3	Low	196 Å²	196	135.7 Å²	135.7	86%	0.86	68%	0.677	S	S	*	*			trans	-88.9	125.7	171.9	-71.2	-83.4	0	0	0	108.5
217	R	42.9	Very low	54	Low	299 Å²	299	144.4 Å²	144.4	100%	1.128	72%	0.716	S	S	*	*			trans	-97.3	0	174.8	-69.8	-176.8	179.9	-177.6	-0.1	111.1

Retrieved 217 of 217 residues in 392.6 ms (Link to these results)

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