A0A096MGK2_POEFO Loading...

Jumonji domain containing 8

AlphaFold DB , UniProt , Accession A0A096MGK2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 316 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	31.4	Very low	257 Å²	257	153.9 Å²	153.9	100%	1.266	78%	0.783	S	S	*	*				0	106.4	0	-74.5	168.9	173.7	0	0	107.7
2	G	33.8	Very low	31.2	Very low	68 Å²	68	149.8 Å²	149.8	70%	0.701	76%	0.763	S	S	*	*			cis	-155.2	110.7	-16.6	0	0	0	0	0	105.2
3	R	29.8	Very low	31.1	Very low	227 Å²	227	148.5 Å²	148.5	86%	0.857	76%	0.758	S	S	*	*				61	98.3	104.7	-67.4	-159.4	174.3	-173.2	-0.2	113.7
4	I	31.4	Very low	31	Very low	117 Å²	117	145 Å²	145	60%	0.6	75%	0.747	S	S	*	*				63.1	129.7	81.5	-42.5	153.6	0	0	0	110.4	V6	I4-V6 HydrophobicContact CG2-CG2 4.5Å
5	Y	29.1	Very low	31	Very low	196 Å²	196	150.4 Å²	150.4	77%	0.769	75%	0.754	S	S	*	*				-159	135.2	54.1	-84.8	-92.7	0	0	0	109.3
6	V	32	Very low	30.9	Very low	104 Å²	104	150.6 Å²	150.6	63%	0.63	75%	0.749	S	S	*	*				71.5	118.1	69.6	179.7	0	0	0	0	115.6	I4 L8	I4-V6 HydrophobicContact CG2-CG2 4.5Å; V6-L8 HydrophobicContact CG1-CD1 4.3Å
7	T	30.2	Very low	30.8	Very low	130 Å²	130	152.3 Å²	152.3	80%	0.798	75%	0.746	S	S	*	*				-161.3	105.4	128.4	12.1	0	0	0	0	108.8
8	L	31.6	Very low	30.7	Very low	148 Å²	148	151.4 Å²	151.4	78%	0.775	74%	0.744	S	S	*	*				72.7	137.1	103.3	-105.9	93.2	0	0	0	114.2	V6	V6-L8 HydrophobicContact CG1-CD1 4.3Å
9	C	30.7	Very low	30.5	Very low	106 Å²	106	148.9 Å²	148.9	72%	0.716	74%	0.743	S	S	*	*			cis	-171.3	124.1	-9.2	-127.1	0	0	0	0	103.3
10	D	31.8	Very low	30.4	Very low	135 Å²	135	153.8 Å²	153.8	72%	0.722	75%	0.752	S	S	*	*				87	136.9	74	-122.2	10.5	0	0	0	115.9
11	W	30	Very low	30.2	Very low	205 Å²	205	149.6 Å²	149.6	78%	0.777	75%	0.748	S	S	*	*			trans	84.8	140.6	157.8	-72.5	48.9	0	0	0	120.7
12	L	28.5	Very low	29.9	Very low	104 Å²	104	148.7 Å²	148.7	55%	0.545	73%	0.733	S	S	.	*			cis	-173.4	152	-14	-106.3	-154.3	0	0	0	110.7
13	L	30.3	Very low	29.7	Very low	134 Å²	134	153.1 Å²	153.1	70%	0.702	74%	0.739	S	S	*	*				16.7	153.7	127.2	-63.9	171.8	0	0	0	119.3
14	T	30	Very low	30.2	Very low	99 Å²	99	147.6 Å²	147.6	61%	0.607	73%	0.733	S	S	*	*			cis	176.4	155.2	21	8.8	0	0	0	0	108.9
15	R	30.8	Very low	30.1	Very low	226 Å²	226	148 Å²	148	85%	0.853	74%	0.74	S	S	*	*			trans	55.4	164.2	139.7	-71	175.6	-177.7	-151	3.1	120.3
16	K	29.8	Very low	30.1	Very low	153 Å²	153	149.5 Å²	149.5	67%	0.665	75%	0.745	S	S	*	*			cis	170.1	152	-24.9	-161.1	174.7	-175.5	-171.2	0	104.3
17	Y	28.1	Very low	29.9	Very low	180 Å²	180	149.1 Å²	149.1	71%	0.706	75%	0.747	S	S	*	*			trans	101.2	108.6	158.3	-77.2	-83.2	0	0	0	122.9
18	I	29.3	Very low	29.9	Very low	137 Å²	137	152.7 Å²	152.7	70%	0.703	75%	0.746	S	S	*	*				47.8	118.5	118.7	-56.3	-175.8	0	0	0	121.3
19	S	27.1	Very low	29.8	Very low	104 Å²	104	153.6 Å²	153.6	73%	0.727	75%	0.748	S	S	*	*				149.3	141.7	110	51.7	0	0	0	0	116
20	R	28.1	Very low	29.7	Very low	246 Å²	246	152 Å²	152	93%	0.928	75%	0.75	S	S	*	*			trans	54.2	118.4	145.8	-79.6	-179.5	170.1	-179.2	-2.9	121.6
21	G	27.8	Very low	29.7	Very low	65 Å²	65	156 Å²	156	67%	0.67	76%	0.761	S	S	*	*				105.9	141.8	120.9	0	0	0	0	0	118
22	Y	29	Very low	29.7	Very low	239 Å²	239	149.6 Å²	149.6	94%	0.937	76%	0.759	S	S	*	*			trans	92.3	107.6	164.6	-61.7	-84.3	0	0	0	118.8
23	L	29.1	Very low	30.1	Very low	161 Å²	161	149.4 Å²	149.4	84%	0.843	77%	0.772	S	S	*	*			trans	-74.5	152.5	141.6	-81	164.6	0	0	0	107.5
24	P	39.3	Very low	30.3	Very low	111 Å²	111	149.7 Å²	149.7	72%	0.721	78%	0.779	S	S	*	*				-156.1	177.7	52.5	40.7	-17.3	0	0	0	118.8
25	V	29.1	Very low	30.5	Very low	124 Å²	124	153.6 Å²	153.6	75%	0.752	79%	0.79	S	S	*	*			trans	66.1	117.6	156.7	-146.1	0	0	0	0	121.1
26	R	28.8	Very low	30.8	Very low	229 Å²	229	152 Å²	152	86%	0.864	79%	0.79	S	S	*	*			trans	135.5	101.5	133.5	-76.4	-171.7	167.3	-177.7	-4.4	108.5
27	S	29.5	Very low	31.1	Very low	96 Å²	96	152.1 Å²	152.1	67%	0.671	80%	0.803	S	S	*	*				53.2	110.3	104.3	-169.6	0	0	0	0	111.9
28	W	28.7	Very low	31.4	Very low	205 Å²	205	147.1 Å²	147.1	78%	0.777	80%	0.799	S	S	*	*				166	120.9	118.6	-92.6	72.4	0	0	0	108.8
29	M	29.8	Very low	31.7	Very low	166 Å²	166	145.2 Å²	145.2	82%	0.818	80%	0.804	S	S	*	*			trans	60.7	124.9	148.6	-64.2	-177.9	173.1	0	0	121.2
30	G	28.8	Very low	32	Very low	74 Å²	74	151.4 Å²	151.4	76%	0.763	81%	0.811	S	S	*	*			trans	136.2	62.9	150.1	0	0	0	0	0	115.6
31	F	32.4	Very low	32.3	Very low	218 Å²	218	147.7 Å²	147.7	96%	0.956	81%	0.809	S	S	*	*			trans	-93.3	105.6	159.1	-88	-78.5	0	0	0	109.2
32	G	29.9	Very low	32.5	Very low	71 Å²	71	149.5 Å²	149.5	73%	0.732	81%	0.807	S	S	*	*			trans	-61.4	144.2	170.2	0	0	0	0	0	111.7
33	A	35.6	Very low	32.6	Very low	99 Å²	99	148.4 Å²	148.4	82%	0.818	80%	0.801	S	S	*	*			trans	-62.8	126.9	176.4	0	0	0	0	0	111.9
34	V	35.2	Very low	33	Very low	140 Å²	140	146.1 Å²	146.1	85%	0.848	79%	0.794	S	S	*	*			trans	-139.8	85.8	144.8	-172.5	0	0	0	0	106.5
35	Q	35	Very low	32.8	Very low	181 Å²	181	144.2 Å²	144.2	85%	0.846	79%	0.788	S	S	*	*			trans	-106.1	114.9	164.4	-80.7	-158.3	-44.2	0	0	108.9	V37	Q35-V37 PolarHBondContact O-N 3.1Å
36	F	35.8	Very low	33.4	Very low	193 Å²	193	140.6 Å²	140.6	85%	0.846	78%	0.776	S	S	*	*			trans	9.1	105.6	147.7	-65.4	-88.7	0	0	0	116.5	A38	F36-A38 VanDerWaalsContact C-N 3.34Å; F36-A38 PolarHBondContact O-N 2.77Å; F36-A38 VanDerWaalsContact O-N 3.13Å
37	V	35.8	Very low	34.5	Very low	156 Å²	156	131.7 Å²	131.7	95%	0.945	75%	0.751	S	S	*	*			trans	-76.9	91.4	158	-178.9	0	0	0	0	106.9	Q35	Q35-V37 PolarHBondContact O-N 3.1Å
38	A	35.3	Very low	36.3	Very low	75 Å²	75	134.5 Å²	134.5	62%	0.62	75%	0.754	S	S	*	*			trans	-112.2	114	169.5	0	0	0	0	0	108.9	F36	F36-A38 VanDerWaalsContact C-N 3.34Å; F36-A38 PolarHBondContact O-N 2.77Å; F36-A38 VanDerWaalsContact O-N 3.13Å
39	A	35.1	Very low	38.8	Very low	96 Å²	96	128.4 Å²	128.4	79%	0.793	74%	0.736	S	S	*	*			trans	39.5	92	155	0	0	0	0	0	118.3
40	W	33.9	Very low	41.6	Very low	234 Å²	234	121 Å²	121	89%	0.886	70%	0.703	S	S	*	*			trans	-98.4	80.1	152.3	-76.1	87.8	0	0	0	109.1	V42	W40-V42 HydrophobicContact CE3-CG2 3.81Å; W40-V42 HydrophobicContact CZ3-CG2 4.01Å
41	L	33.7	Very low	44.6	Very low	169 Å²	169	119.3 Å²	119.3	89%	0.885	69%	0.685	S	S	*	*			trans	-121.2	82.9	153.4	-85	166.9	0	0	0	105.4	W43	L41-W43 VanDerWaalsContact C-N 3.32Å; L41-W43 PolarHBondContact O-N 3.21Å; L41-W43 VanDerWaalsContact O-N 3.08Å
42	V	33.6	Very low	47.4	Very low	103 Å²	103	109.4 Å²	109.4	62%	0.624	64%	0.642	S	S	*	*			trans	-72.8	96.4	166.4	176.6	0	0	0	0	105.4	W40 T44	W40-V42 HydrophobicContact CE3-CG2 3.81Å; W40-V42 HydrophobicContact CZ3-CG2 4.01Å; V42-T44 VanDerWaalsContact C-N 3.33Å; V42-T44 HydrophobicContact CG1-CG2 4.24Å; V42-T44 PolarHBondContact O-N 3.32Å; V42-T44 VanDerWaalsContact O-N 3.09Å
43	W	31	Very low	49.8	Very low	215 Å²	215	109.8 Å²	109.8	81%	0.814	63%	0.633	S	S	*	*			trans	-68.6	100.7	160.3	-161	-38.5	0	0	0	105.2	L41 A45	L41-W43 VanDerWaalsContact C-N 3.32Å; L41-W43 PolarHBondContact O-N 3.21Å; L41-W43 VanDerWaalsContact O-N 3.08Å; W43-A45 VanDerWaalsContact C-N 3.3Å; W43-A45 PolarHBondContact O-N 2.81Å
44	T	35.8	Very low	51.5	Low	113 Å²	113	108.3 Å²	108.3	69%	0.693	61%	0.609	S	S	*	*			trans	-63.4	101.7	162.1	46	0	0	0	0	105.7	V42 G46	V42-T44 VanDerWaalsContact C-N 3.33Å; V42-T44 HydrophobicContact CG1-CG2 4.24Å; V42-T44 PolarHBondContact O-N 3.32Å; V42-T44 VanDerWaalsContact O-N 3.09Å; T44-G46 PolarHBondContact O-N 3.4Å
45	A	35	Very low	53.1	Low	71 Å²	71	106.1 Å²	106.1	59%	0.587	60%	0.598	S	S	*	*			trans	-67.9	67.2	164.6	0	0	0	0	0	108.1	W43	W43-A45 VanDerWaalsContact C-N 3.3Å; W43-A45 PolarHBondContact O-N 2.81Å
46	G	42.7	Very low	54.5	Low	49 Å²	49	107.3 Å²	107.3	51%	0.505	60%	0.604	S	S	.	*			trans	-64.9	148.6	150.5	0	0	0	0	0	106.8	T44 E48	T44-G46 PolarHBondContact O-N 3.4Å; G46-E48 PolarHBondContact O-N 2.84Å
47	A	51.2	Low	55.9	Low	42 Å²	42	102 Å²	102	35%	0.347	60%	0.603	S	S	.	*			trans	-44.6	121.5	167	0	0	0	0	0	107.8	D49 L287	A47-D49 PolarHBondContact O-N 3.1Å; A47-L287 HydrophobicContact CB-CD1 3.43Å; A47-L287 VanDerWaalsContact CB-CD1 3.43Å; A47-L287 HydrophobicContact CB-CD2 4.09Å; A47-L287 HydrophobicContact CB-CG 4.41Å
48	E	67.2	Low	57.6	Low	155 Å²	155	96 Å²	96	72%	0.724	57%	0.568	S	S	*	*			trans	-49.2	130.8	169.5	-67.1	-172.4	162.2	0	0	106.6	G46 G50 Y215	G46-E48 PolarHBondContact O-N 2.84Å; E48-G50 PolarHBondContact O-N 2.97Å; E48-Y215 VanDerWaalsContact O-CE1 3.23Å; E48-Y215 WeakPolarHBondContact O-CE1 3.38Å
49	D	81.9	Confident	59.5	Low	76 Å²	76	93.6 Å²	93.6	41%	0.406	55%	0.551	S	S	.	*			trans	-68.1	13.8	-174.8	61.5	20.7	0	0	0	113.7	A47 G51 W52 S53 Y215	A47-D49 PolarHBondContact O-N 3.1Å; D49-G51 PolarHBondContact O-N 3.44Å; D49-G51 VanDerWaalsContact OD1-CA 3.29Å; D49-G51 WeakPolarHBondContact OD1-CA 3.46Å; D49-G51 PolarHBondContact OD1-N 3.16Å; D49-W52 WeakPolarHBondContact O-CB 3.37Å; D49-W52 VanDerWaalsContact O-CD1 3.25Å; D49-W52 PolarHBondContact O-N 3.08Å; D49-W52 VanDerWaalsContact O-N 3.1Å; D49-S53 WeakPolarHBondContact OD2-CB 3.2Å; D49-Y215 VanDerWaalsContact C-CD1 3.44Å; D49-Y215 WeakPolarHBondContact O-CD1 3.1Å
50	G	88.3	Confident	61.9	Low	11 Å²	11	91.6 Å²	91.6	11%	0.113	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	10.7	-177.4	0	0	0	0	0	113.6	E48 W52 S107 R108 Y215	E48-G50 PolarHBondContact O-N 2.97Å; G50-W52 VanDerWaalsContact C-N 3.34Å; G50-S107 CarbonylContact O-C 3.56Å; G50-S107 WeakPolarHBondContact O-CA 3.41Å; G50-R108 PolarHBondContact O-N 3.27Å; G50-Y215 VanDerWaalsContact CA-CE1 3.49Å; G50-Y215 VanDerWaalsContact CA-CZ 3.44Å; G50-Y215 VanDerWaalsContact N-CE1 3.29Å
51	G	91.3	Very high	64.4	Low	39 Å²	39	88.9 Å²	88.9	40%	0.402	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	20.4	-170.3	0	0	0	0	0	113.2	D49 R108	D49-G51 PolarHBondContact O-N 3.44Å; D49-G51 VanDerWaalsContact OD1-CA 3.29Å; D49-G51 WeakPolarHBondContact OD1-CA 3.46Å; D49-G51 PolarHBondContact OD1-N 3.16Å; G51-R108 WeakPolarHBondContact O-CB 3.31Å; G51-R108 WeakPolarHBondContact O-CD 3.31Å
52	W	92.1	Very high	66.9	Low	9 Å²	9	85.3 Å²	85.3	3%	0.034	51%	0.505	C	S	.	.			trans	-93.1	0.5	179.6	-64.2	107.4	0	0	0	114	D49 G50 Q54 C106 R108 L111 F137 V141 L145 I194 Y215 T307 V309	D49-W52 WeakPolarHBondContact O-CB 3.37Å; D49-W52 VanDerWaalsContact O-CD1 3.25Å; D49-W52 PolarHBondContact O-N 3.08Å; D49-W52 VanDerWaalsContact O-N 3.1Å; G50-W52 VanDerWaalsContact C-N 3.34Å; W52-Q54 PolarHBondContact O-N 3Å; W52-C106 PolarHBondContact NE1-O 3.34Å; W52-R108 HydrophobicContact CD2-CB 3.82Å; W52-R108 HydrophobicContact CD2-CG 4.35Å; W52-R108 HydrophobicContact CE3-CB 4Å; W52-R108 HydrophobicContact CE3-CG 4.01Å; W52-R108 HydrophobicContact CG-CB 4.4Å; W52-R108 HydrophobicContact CH2-CB 4.07Å; W52-R108 HydrophobicContact CH2-CG 4.03Å; W52-R108 HydrophobicContact CZ2-CB 3.89Å; W52-R108 HydrophobicContact CZ2-CG 4.37Å; W52-R108 HydrophobicContact CZ3-CB 4.12Å; W52-R108 HydrophobicContact CZ3-CG 3.84Å; W52-L111 HydrophobicContact CH2-CD1 4.26Å; W52-L111 HydrophobicContact CZ2-CD1 3.75Å; W52-L111 HydrophobicContact CZ2-CG 4.41Å; W52-F137 HydrophobicContact CH2-CZ 4.41Å; W52-V141 HydrophobicContact CH2-CG2 4.44Å; W52-V141 HydrophobicContact CZ3-CG1 4.14Å; W52-V141 HydrophobicContact CZ3-CG2 4.3Å; W52-L145 HydrophobicContact CE3-CD2 4.13Å; W52-L145 HydrophobicContact CZ3-CD2 3.85Å; W52-I194 HydrophobicContact CE3-CG2 4.5Å; W52-I194 HydrophobicContact CH2-CD1 3.59Å; W52-I194 HydrophobicContact CH2-CG2 4.43Å; W52-I194 HydrophobicContact CZ2-CD1 3.95Å; W52-I194 HydrophobicContact CZ3-CD1 4.28Å; W52-I194 HydrophobicContact CZ3-CG2 4.14Å; W52-Y215 AromaticContact CD1-CD2 3.55Å; W52-Y215 AromaticContact CD1-CG 3.74Å; W52-Y215 AromaticContact NE1-CD2 3.61Å; W52-T307 HydrophobicContact CB-CG2 4Å; W52-T307 HydrophobicContact CD2-CG2 4.43Å; W52-T307 HydrophobicContact CE3-CG2 3.94Å; W52-T307 VanDerWaalsContact O-CB 3.3Å; W52-T307 WeakPolarHBondContact O-CB 3.45Å; W52-T307 PolarHBondContact O-OG1 3.09Å; W52-V309 HydrophobicContact CD2-CG2 3.98Å; W52-V309 HydrophobicContact CG-CG2 4.2Å; W52-V309 HydrophobicContact CZ2-CG2 3.97Å
53	S	79.3	Confident	69.6	Low	80 Å²	80	82.9 Å²	82.9	56%	0.559	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-51.1	134.6	173.3	49.8	0	0	0	0	111.9	D49	D49-S53 WeakPolarHBondContact OD2-CB 3.2Å
54	Q	72.4	Confident	72.5	Confident	68 Å²	68	74.2 Å²	74.2	32%	0.318	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-103.3	169.4	166.7	-71.5	-73.5	-12.6	0	0	108.6	W52 S58 L145 T307	W52-Q54 PolarHBondContact O-N 3Å; Q54-S58 WeakPolarHBondContact CB-OG 3.4Å; Q54-L145 PolarHBondContact NE2-O 2.98Å; Q54-T307 WeakPolarHBondContact CG-OG1 3.37Å
55	P	67.8	Low	75.1	Confident	94 Å²	94	70.8 Å²	70.8	61%	0.61	45%	0.451	S	S	*	.	S	Bend	trans	-50	148.1	179.2	-26.6	34.4	0	0	0	112.7	G57 S58	P55-G57 PolarHBondContact O-N 2.91Å; P55-S58 VanDerWaalsContact O-CB 3.25Å; P55-S58 WeakPolarHBondContact O-CB 3.2Å; P55-S58 PolarHBondContact O-N 3.42Å; P55-S58 VanDerWaalsContact O-N 3.15Å; P55-S58 PolarHBondContact O-OG 3.07Å
56	E	65.3	Low	78	Confident	206 Å²	206	70.7 Å²	70.7	96%	0.963	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	135.1	178.2	-71.4	-175.4	171.2	0	0	111.2
57	G	64.3	Low	80.6	Confident	81 Å²	81	71.5 Å²	71.5	84%	0.835	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	5.1	-179.2	0	0	0	0	0	115.9	P55	P55-G57 PolarHBondContact O-N 2.91Å
58	S	72.5	Confident	82.8	Confident	29 Å²	29	70 Å²	70	20%	0.203	43%	0.429	C	S	.	.			trans	-83.3	-21.3	176.2	58.3	0	0	0	0	114.6	Q54 P55 P197	Q54-S58 WeakPolarHBondContact CB-OG 3.4Å; P55-S58 VanDerWaalsContact O-CB 3.25Å; P55-S58 WeakPolarHBondContact O-CB 3.2Å; P55-S58 PolarHBondContact O-N 3.42Å; P55-S58 VanDerWaalsContact O-N 3.15Å; P55-S58 PolarHBondContact O-OG 3.07Å; S58-P197 WeakPolarHBondContact O-CB 3.32Å
59	G	75.8	Confident	84.3	Confident	25 Å²	25	65.3 Å²	65.3	26%	0.258	41%	0.408	S	S	.	.	S	Bend	trans	-82.2	154.8	175.9	0	0	0	0	0	112.5	L305	G59-L305 CarbonylContact C-O 3.55Å; G59-L305 WeakPolarHBondContact CA-O 3.29Å
60	L	85	Confident	84.9	Confident	54 Å²	54	64.3 Å²	64.3	28%	0.283	40%	0.404	S	S	.	.			trans	-85.2	128.8	172.1	-62.3	174.7	0	0	0	109.6	R217 L238 L303 L305	L60-R217 PolarHBondContact O-NH2 3.02Å; L60-L238 HydrophobicContact CD1-CD1 4Å; L60-L303 HydrophobicContact CD1-CD1 4.36Å; L60-L303 HydrophobicContact CD1-CD2 3.82Å; L60-L303 HydrophobicContact CD1-CG 4.18Å; L60-L305 HydrophobicContact CB-CB 4.29Å; L60-L305 HydrophobicContact CB-CD2 4Å; L60-L305 HydrophobicContact CD1-CD2 4.17Å; L60-L305 PolarHBondContact N-O 3.1Å
61	E	85.7	Confident	85.2	Confident	178 Å²	178	64.7 Å²	64.7	83%	0.832	40%	0.404	S	S	*	.			trans	-81.9	-30.4	-178.1	-63.1	-173.5	165	0	0	112.8	E63	E61-E63 PolarHBondContact O-N 3.12Å; E61-E63 VanDerWaalsContact O-N 3.09Å
62	D	87.5	Confident	85.3	Confident	94 Å²	94	65 Å²	65	50%	0.503	40%	0.396	S	S	.	.			trans	-75.5	98.8	-179.2	178.2	29.3	0	0	0	112.3	G64 R219	D62-G64 VanDerWaalsContact C-N 3.32Å; D62-G64 PolarHBondContact OD1-N 2.84Å; D62-R219 VanDerWaalsContact CG-NH1 3.3Å; D62-R219 PolarHBondContact O-NH1 3.07Å; D62-R219 VanDerWaalsContact O-NH1 3.15Å; D62-R219 IonicContact OD1-NH1 3.58Å; D62-R219 IonicContact OD2-CZ 3.52Å; D62-R219 IonicContact OD2-NH1 2.72Å; D62-R219 PolarHBondContact OD2-NH1 3.16Å; D62-R219 IonicContact OD2-NH2 3.47Å
63	E	90.5	Very high	85.3	Confident	52 Å²	52	65.3 Å²	65.3	24%	0.243	40%	0.402	C	S	.	.			trans	-80.3	-9.4	174.6	-59.8	-170.2	162.1	0	0	114	E61 R217 T258 R260 L305	E61-E63 PolarHBondContact O-N 3.12Å; E61-E63 VanDerWaalsContact O-N 3.09Å; E63-R217 WeakPolarHBondContact OE1-CD 3.04Å; E63-R217 IonicContact OE1-CZ 3.07Å; E63-R217 IonicContact OE1-NE 2.71Å; E63-R217 IonicContact OE1-NH1 2.66Å; E63-R217 PolarHBondContact OE1-NH1 3.05Å; E63-T258 HydrophobicContact CB-CG2 4.38Å; E63-T258 HydrophobicContact CG-CG2 4.48Å; E63-T258 PolarHBondContact O-OG1 3.37Å; E63-R260 IonicContact OE1-CZ 2.65Å; E63-R260 IonicContact OE1-NH1 2.76Å; E63-R260 PolarHBondContact OE1-NH1 2.96Å; E63-R260 IonicContact OE1-NH2 3.98Å; E63-R260 IonicContact OE2-CZ 3.62Å; E63-R260 IonicContact OE2-NH1 3.56Å; E63-R260 PolarHBondContact OE2-NH1 3.13Å; E63-R260 IonicContact OE2-NH2 2.81Å; E63-R260 PolarHBondContact OE2-NH2 3.26Å; E63-L305 HydrophobicContact CB-CD1 4.26Å; E63-L305 HydrophobicContact CG-CD1 3.94Å
64	G	90.4	Very high	85.9	Confident	33 Å²	33	66.6 Å²	66.6	34%	0.34	41%	0.411	S	S	.	.			trans	65.8	-171.8	-173.8	0	0	0	0	0	114.8	D62 R219	D62-G64 VanDerWaalsContact C-N 3.32Å; D62-G64 PolarHBondContact OD1-N 2.84Å; G64-R219 VanDerWaalsContact CA-NH2 3.29Å
65	G	91.9	Very high	86.9	Confident	40 Å²	40	68.7 Å²	68.7	41%	0.412	42%	0.421	S	S	.	.			trans	-82.3	176.4	170.1	0	0	0	0	0	112.5	E256	G65-E256 PolarHBondContact N-OE1 3.04Å
66	C	95.1	Very high	88.3	Confident	70 Å²	70	64.5 Å²	64.5	47%	0.473	39%	0.393	S	S	.	.			trans	-125.5	106.8	165.8	-168.6	0	0	0	0	109.3	E256 C257	C66-E256 CarbonylContact C-O 3.48Å; C66-E256 VanDerWaalsContact CA-O 3.29Å; C66-E256 WeakPolarHBondContact CA-O 3.48Å; C66-C257 HydrophobicContact CB-CB 3.93Å; C66-C257 WeakPolarHBondContact CB-SG 3.45Å; C66-C257 WeakPolarHBondContact SG-CB 3.16Å; C66-C257 CovalentContact SG-SG 2.04Å; C66-C257 PolarHBondContact SG-SG 3.47Å
67	S	97.1	Very high	89.8	Confident	66 Å²	66	57.3 Å²	57.3	46%	0.462	37%	0.365	S	S	.	.			trans	-107.1	-2.7	178.4	58.1	0	0	0	0	113.2	L255 E256	S67-L255 WeakPolarHBondContact OG-CA 3.4Å; S67-E256 PolarHBondContact N-O 2.75Å; S67-E256 PolarHBondContact OG-N 2.89Å; S67-E256 PolarHBondContact OG-O 2.92Å
68	I	97.9	Very high	91.4	Very high	9 Å²	9	55.6 Å²	55.6	5%	0.046	34%	0.336	C	S	.	.	S	Bend	trans	-78.2	138.1	172.3	-56.1	171.5	0	0	0	109.1	V70 P90 I92 L222 L255 C257 L292	I68-V70 PolarHBondContact O-N 3Å; I68-P90 HydrophobicContact CG2-CB 4.33Å; I68-I92 HydrophobicContact CB-CD1 4.19Å; I68-I92 HydrophobicContact CB-CG1 4.41Å; I68-I92 HydrophobicContact CD1-CD1 4.49Å; I68-I92 HydrophobicContact CG2-CD1 4.31Å; I68-I92 HydrophobicContact CG2-CG1 3.97Å; I68-L222 HydrophobicContact CD1-CD1 3.46Å; I68-L222 VanDerWaalsContact CD1-CD1 3.46Å; I68-L222 HydrophobicContact CG1-CD1 4.39Å; I68-L255 HydrophobicContact CG1-CB 4.12Å; I68-C257 HydrophobicContact CB-CB 4.34Å; I68-C257 HydrophobicContact CD1-CB 3.77Å; I68-C257 HydrophobicContact CG1-CB 4.19Å; I68-L292 HydrophobicContact CD1-CD1 3.96Å; I68-L292 HydrophobicContact CG2-CD1 4.39Å
69	E	97.5	Very high	92.6	Very high	57 Å²	57	60.2 Å²	60.2	27%	0.266	35%	0.354	S	S	.	.			trans	-61.5	132.3	175.6	-176	172.6	152.8	0	0	110.6	L71 R84 R89 V91 I92	E69-L71 HydrophobicContact CG-CD2 4.33Å; E69-L71 HydrophobicContact CG-CG 4.32Å; E69-R84 IonicContact OE1-CZ 2.79Å; E69-R84 IonicContact OE1-NH2 3.97Å; E69-R84 PolarHBondContact OE1-NH2 2.62Å; E69-R89 IonicContact OE1-NH2 3.77Å; E69-R89 IonicContact OE2-CZ 2.78Å; E69-R89 IonicContact OE2-NH1 3.55Å; E69-R89 PolarHBondContact OE2-NH1 3.2Å; E69-R89 IonicContact OE2-NH2 3.88Å; E69-R89 PolarHBondContact OE2-NH2 2.87Å; E69-V91 WeakPolarHBondContact O-CG2 3.25Å; E69-I92 PolarHBondContact O-N 3.2Å
70	V	95.5	Very high	93.7	Very high	55 Å²	55	62.5 Å²	62.5	33%	0.333	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.6	178.7	-172.4	0	0	0	0	109.1	I68 I92 R94	I68-V70 PolarHBondContact O-N 3Å; V70-I92 CarbonylContact C-O 3.56Å; V70-I92 WeakPolarHBondContact CA-O 3.41Å; V70-I92 HydrophobicContact CB-CB 4.49Å; V70-I92 HydrophobicContact CG1-CB 4.35Å; V70-I92 HydrophobicContact CG1-CG2 4.1Å; V70-I92 HydrophobicContact CG2-CB 4.14Å; V70-I92 HydrophobicContact CG2-CD1 4.39Å; V70-I92 HydrophobicContact CG2-CG2 4.49Å; V70-R94 HydrophobicContact CG1-CG 3.94Å
71	L	94.8	Very high	94.3	Very high	19 Å²	19	60 Å²	60	10%	0.099	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.7	177	-64.2	179.6	0	0	0	111	E69 L76 F85 V91 I92 I93 R94	E69-L71 HydrophobicContact CG-CD2 4.33Å; E69-L71 HydrophobicContact CG-CG 4.32Å; L71-L76 HydrophobicContact CD1-CB 4.41Å; L71-L76 HydrophobicContact CD1-CD1 4.1Å; L71-L76 HydrophobicContact CD1-CD2 4.37Å; L71-F85 HydrophobicContact CD1-CE2 3.66Å; L71-F85 HydrophobicContact CD1-CZ 3.7Å; L71-V91 HydrophobicContact CD1-CG2 4.13Å; L71-V91 HydrophobicContact CG-CG2 4.21Å; L71-I92 PolarHBondContact N-O 2.97Å; L71-I93 WeakPolarHBondContact O-CA 3.11Å; L71-R94 PolarHBondContact O-N 2.57Å
72	D	93.1	Very high	94.9	Very high	47 Å²	47	53.7 Å²	53.7	25%	0.251	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	143.1	162.4	-167.9	-84.6	0	0	0	110.1	S74 E75	D72-S74 PolarHBondContact O-N 3.31Å; D72-S74 VanDerWaalsContact OD1-CB 3.24Å; D72-S74 WeakPolarHBondContact OD1-CB 3.43Å; D72-S74 PolarHBondContact OD1-N 3.41Å; D72-S74 PolarHBondContact OD1-OG 3.05Å; D72-E75 HydrophobicContact CB-CG 4.01Å; D72-E75 PolarHBondContact N-OE2 3.21Å; D72-E75 VanDerWaalsContact N-OE2 3.13Å; D72-E75 WeakPolarHBondContact O-CB 3.43Å; D72-E75 PolarHBondContact O-N 2.88Å
73	G	91.1	Very high	95.4	Very high	15 Å²	15	55.4 Å²	55.4	16%	0.155	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-59.3	-29	179	0	0	0	0	0	112.5	E75 L76 R94	G73-E75 PolarHBondContact O-N 3.05Å; G73-L76 PolarHBondContact O-N 2.89Å; G73-R94 WeakPolarHBondContact CA-O 3.24Å; G73-R94 PolarHBondContact N-O 2.63Å
74	S	92.4	Very high	95.8	Very high	106 Å²	106	57.2 Å²	57.2	74%	0.741	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-69.2	-17.5	174.3	66.5	0	0	0	0	114	D72	D72-S74 PolarHBondContact O-N 3.31Å; D72-S74 VanDerWaalsContact OD1-CB 3.24Å; D72-S74 WeakPolarHBondContact OD1-CB 3.43Å; D72-S74 PolarHBondContact OD1-N 3.41Å; D72-S74 PolarHBondContact OD1-OG 3.05Å
75	E	93.6	Very high	96.2	Very high	112 Å²	112	55.6 Å²	55.6	52%	0.523	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-93.9	-6.3	-178.8	-61	171.8	156.9	0	0	113	D72 G73 Q80	D72-E75 HydrophobicContact CB-CG 4.01Å; D72-E75 PolarHBondContact N-OE2 3.21Å; D72-E75 VanDerWaalsContact N-OE2 3.13Å; D72-E75 WeakPolarHBondContact O-CB 3.43Å; D72-E75 PolarHBondContact O-N 2.88Å; G73-E75 PolarHBondContact O-N 3.05Å; E75-Q80 PolarHBondContact O-OE1 3.23Å
76	L	96.8	Very high	96.4	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.037	29%	0.291	C	S	.	.			trans	-125	100.8	-172	-174.8	66.6	0	0	0	111.8	L71 G73 Q80 F81 F85 I93 Y181	L71-L76 HydrophobicContact CD1-CB 4.41Å; L71-L76 HydrophobicContact CD1-CD1 4.1Å; L71-L76 HydrophobicContact CD1-CD2 4.37Å; G73-L76 PolarHBondContact O-N 2.89Å; L76-Q80 HydrophobicContact CD1-CB 3.85Å; L76-F81 HydrophobicContact CD1-CB 4.27Å; L76-F81 HydrophobicContact CD2-CB 4.34Å; L76-F81 HydrophobicContact CD2-CD2 4.38Å; L76-F81 HydrophobicContact CG-CB 4.23Å; L76-F85 HydrophobicContact CD1-CD2 4Å; L76-F85 HydrophobicContact CD1-CE2 3.81Å; L76-F85 HydrophobicContact CD2-CD2 4.49Å; L76-I93 HydrophobicContact CD2-CD1 3.69Å; L76-I93 HydrophobicContact CD2-CG1 4.03Å; L76-Y181 WeakPolarHBondContact CB-OH 3.33Å; L76-Y181 HydrophobicContact CD2-CE1 4.21Å; L76-Y181 HydrophobicContact CD2-CE2 4.27Å; L76-Y181 HydrophobicContact CG-CE1 4.04Å; L76-Y181 VanDerWaalsContact O-CE1 3.26Å; L76-Y181 WeakPolarHBondContact O-CE1 3.38Å; L76-Y181 PolarHBondContact O-OH 3.4Å
77	S	97.8	Very high	96.5	Very high	54 Å²	54	57 Å²	57	38%	0.378	30%	0.297	S	S	.	.			trans	-74.5	161.4	169.5	66.4	0	0	0	0	112.4	Q79 Q80 F81	S77-Q79 VanDerWaalsContact C-N 3.27Å; S77-Q79 PolarHBondContact O-N 2.76Å; S77-Q80 PolarHBondContact O-N 3.26Å; S77-Q80 WeakPolarHBondContact OG-CG 3.32Å; S77-Q80 PolarHBondContact OG-N 2.97Å; S77-Q80 PolarHBondContact OG-OE1 2.89Å; S77-F81 WeakPolarHBondContact O-CB 3.48Å; S77-F81 PolarHBondContact O-N 2.78Å
78	Q	97.8	Very high	96.5	Very high	46 Å²	46	56.5 Å²	56.5	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-55	-40.6	173.4	173.6	59.1	20.8	0	0	112.6	F81 L82 Y181 F182	Q78-F81 PolarHBondContact O-N 2.9Å; Q78-L82 WeakPolarHBondContact O-CG 3.4Å; Q78-L82 PolarHBondContact O-N 2.96Å; Q78-Y181 VanDerWaalsContact OE1-CA 3.27Å; Q78-F182 HydrophobicContact CG-CD1 4.42Å; Q78-F182 HydrophobicContact CG-CE1 3.86Å; Q78-F182 HydrophobicContact CG-CZ 4.19Å; Q78-F182 PolarHBondContact NE2-O 3.03Å
79	Q	98.1	Very high	96.5	Very high	126 Å²	126	60.4 Å²	60.4	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-65	-48	178.3	-179.5	177	-1.1	0	0	111.3	S77 F81 L82 E83	S77-Q79 VanDerWaalsContact C-N 3.27Å; S77-Q79 PolarHBondContact O-N 2.76Å; Q79-F81 VanDerWaalsContact C-N 3.28Å; Q79-F81 PolarHBondContact O-N 3.21Å; Q79-L82 PolarHBondContact O-N 3.01Å; Q79-E83 HydrophobicContact CG-CG 4.42Å; Q79-E83 VanDerWaalsContact CG-OE1 3.24Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.24Å; Q79-E83 PolarHBondContact NE2-OE1 3.49Å; Q79-E83 WeakPolarHBondContact O-CG 3.36Å; Q79-E83 PolarHBondContact O-N 3.35Å
80	Q	98.1	Very high	96.6	Very high	73 Å²	73	57.8 Å²	57.8	34%	0.341	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-36.3	177.4	-71.4	164.2	-47.6	0	0	111.8	E75 L76 S77 R84	E75-Q80 PolarHBondContact O-OE1 3.23Å; L76-Q80 HydrophobicContact CD1-CB 3.85Å; S77-Q80 PolarHBondContact O-N 3.26Å; S77-Q80 WeakPolarHBondContact OG-CG 3.32Å; S77-Q80 PolarHBondContact OG-N 2.97Å; S77-Q80 PolarHBondContact OG-OE1 2.89Å; Q80-R84 WeakPolarHBondContact O-CB 3.38Å; Q80-R84 WeakPolarHBondContact O-CG 3.21Å; Q80-R84 PolarHBondContact O-N 3.23Å
81	F	98.4	Very high	96.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-49.7	173.5	169.3	-102.9	0	0	0	111.4	L76 S77 Q78 Q79 E83 F85 A86 Y181 L183 F210 Y293	L76-F81 HydrophobicContact CD1-CB 4.27Å; L76-F81 HydrophobicContact CD2-CB 4.34Å; L76-F81 HydrophobicContact CD2-CD2 4.38Å; L76-F81 HydrophobicContact CG-CB 4.23Å; S77-F81 WeakPolarHBondContact O-CB 3.48Å; S77-F81 PolarHBondContact O-N 2.78Å; Q78-F81 PolarHBondContact O-N 2.9Å; Q79-F81 VanDerWaalsContact C-N 3.28Å; Q79-F81 PolarHBondContact O-N 3.21Å; F81-E83 PolarHBondContact O-N 3.11Å; F81-F85 HydrophobicContact CD2-CB 4.19Å; F81-F85 HydrophobicContact CE2-CB 4.41Å; F81-F85 PolarHBondContact O-N 3.08Å; F81-A86 HydrophobicContact CD1-CB 4.29Å; F81-A86 HydrophobicContact CE1-CB 3.91Å; F81-A86 HydrophobicContact CZ-CB 4.16Å; F81-A86 PolarHBondContact O-N 3.15Å; F81-Y181 HydrophobicContact CB-CD1 3.74Å; F81-Y181 HydrophobicContact CB-CE1 4.09Å; F81-Y181 HydrophobicContact CB-CG 4.4Å; F81-Y181 HydrophobicContact CD1-CD1 4.17Å; F81-Y181 HydrophobicContact CD1-CG 4.19Å; F81-Y181 HydrophobicContact CD2-CD1 4.41Å; F81-Y181 HydrophobicContact CD2-CG 4.25Å; F81-Y181 AromaticContact CG-CD1 3.84Å; F81-Y181 HydrophobicContact CG-CD1 3.84Å; F81-Y181 HydrophobicContact CG-CG 4.01Å; F81-L183 HydrophobicContact CE1-CD2 4.08Å; F81-F210 HydrophobicContact CE1-CZ 4.49Å; F81-F210 HydrophobicContact CE2-CE1 4.24Å; F81-F210 HydrophobicContact CE2-CZ 4.03Å; F81-F210 HydrophobicContact CZ-CE1 4.38Å; F81-F210 AromaticContact CZ-CZ 3.74Å; F81-F210 HydrophobicContact CZ-CZ 3.74Å; F81-Y293 AromaticContact CE2-CD1 3.71Å; F81-Y293 HydrophobicContact CE2-CD1 3.71Å; F81-Y293 AromaticContact CE2-CD2 3.91Å; F81-Y293 HydrophobicContact CE2-CD2 3.91Å; F81-Y293 AromaticContact CE2-CE1 3.88Å; F81-Y293 HydrophobicContact CE2-CE1 3.88Å; F81-Y293 HydrophobicContact CE2-CE2 4.07Å; F81-Y293 AromaticContact CE2-CG 3.72Å; F81-Y293 HydrophobicContact CE2-CG 3.72Å; F81-Y293 HydrophobicContact CZ-CD1 4.16Å; F81-Y293 AromaticContact CZ-CD2 3.83Å; F81-Y293 HydrophobicContact CZ-CD2 3.83Å; F81-Y293 AromaticContact CZ-CE1 3.93Å; F81-Y293 HydrophobicContact CZ-CE1 3.93Å; F81-Y293 AromaticContact CZ-CE2 3.58Å; F81-Y293 HydrophobicContact CZ-CE2 3.58Å; F81-Y293 HydrophobicContact CZ-CG 4.1Å; F81-Y293 AromaticContact CZ-CZ 3.62Å
82	L	98.3	Very high	96.8	Very high	46 Å²	46	54.3 Å²	54.3	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-44.3	178.3	-70.3	176.7	0	0	0	112.7	Q78 Q79 A86 F87 L183	Q78-L82 WeakPolarHBondContact O-CG 3.4Å; Q78-L82 PolarHBondContact O-N 2.96Å; Q79-L82 PolarHBondContact O-N 3.01Å; L82-A86 HydrophobicContact CD2-CB 3.99Å; L82-F87 HydrophobicContact CD2-CE2 4.29Å; L82-L183 HydrophobicContact CD2-CD2 3.91Å
83	E	97.7	Very high	97	Very high	131 Å²	131	52 Å²	52	61%	0.612	26%	0.263	S	S	*	.	H	α-helix	trans	-74.2	-37.5	-176.2	-70.9	171.7	-178.7	0	0	112.9	Q79 F81	Q79-E83 HydrophobicContact CG-CG 4.42Å; Q79-E83 VanDerWaalsContact CG-OE1 3.24Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.24Å; Q79-E83 PolarHBondContact NE2-OE1 3.49Å; Q79-E83 WeakPolarHBondContact O-CG 3.36Å; Q79-E83 PolarHBondContact O-N 3.35Å; F81-E83 PolarHBondContact O-N 3.11Å
84	R	97.9	Very high	97.1	Very high	89 Å²	89	54.9 Å²	54.9	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-102.1	-25.4	-168.6	-62.7	173	60.2	-157.1	-6.4	114.8	E69 Q80 S88	E69-R84 IonicContact OE1-CZ 2.79Å; E69-R84 IonicContact OE1-NH2 3.97Å; E69-R84 PolarHBondContact OE1-NH2 2.62Å; Q80-R84 WeakPolarHBondContact O-CB 3.38Å; Q80-R84 WeakPolarHBondContact O-CG 3.21Å; Q80-R84 PolarHBondContact O-N 3.23Å; R84-S88 PolarHBondContact O-OG 3.44Å
85	F	98.4	Very high	97	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.1	-45.8	-167	-60.1	-70.6	0	0	0	114.2	L71 L76 F81 F87 S88 R89 V91 Y293	L71-F85 HydrophobicContact CD1-CE2 3.66Å; L71-F85 HydrophobicContact CD1-CZ 3.7Å; L76-F85 HydrophobicContact CD1-CD2 4Å; L76-F85 HydrophobicContact CD1-CE2 3.81Å; L76-F85 HydrophobicContact CD2-CD2 4.49Å; F81-F85 HydrophobicContact CD2-CB 4.19Å; F81-F85 HydrophobicContact CE2-CB 4.41Å; F81-F85 PolarHBondContact O-N 3.08Å; F85-F87 PolarHBondContact O-N 2.97Å; F85-S88 VanDerWaalsContact CA-OG 3.27Å; F85-S88 WeakPolarHBondContact CA-OG 3.33Å; F85-S88 PolarHBondContact N-OG 3.36Å; F85-S88 PolarHBondContact O-N 3.4Å; F85-S88 PolarHBondContact O-OG 2.82Å; F85-R89 HydrophobicContact CD1-CG 3.82Å; F85-R89 HydrophobicContact CE1-CG 4.26Å; F85-R89 PolarHBondContact O-N 3.12Å; F85-V91 HydrophobicContact CB-CG1 4.03Å; F85-V91 HydrophobicContact CD1-CB 3.58Å; F85-V91 HydrophobicContact CD1-CG1 3.87Å; F85-V91 HydrophobicContact CD1-CG2 4.18Å; F85-V91 HydrophobicContact CD2-CG1 4.26Å; F85-V91 HydrophobicContact CE1-CB 3.7Å; F85-V91 HydrophobicContact CE1-CG1 4.37Å; F85-V91 HydrophobicContact CE1-CG2 3.83Å; F85-V91 HydrophobicContact CE2-CG2 4.33Å; F85-V91 HydrophobicContact CG-CB 4.02Å; F85-V91 HydrophobicContact CG-CG1 3.79Å; F85-V91 HydrophobicContact CZ-CB 4.24Å; F85-V91 HydrophobicContact CZ-CG2 3.92Å; F85-Y293 HydrophobicContact CB-CD1 4.49Å
86	A	97.3	Very high	96.9	Very high	1 Å²	1	48 Å²	48	1%	0.008	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47	-38.6	-168.7	0	0	0	0	0	114.6	F81 L82 L183 Y293	F81-A86 HydrophobicContact CD1-CB 4.29Å; F81-A86 HydrophobicContact CE1-CB 3.91Å; F81-A86 HydrophobicContact CZ-CB 4.16Å; F81-A86 PolarHBondContact O-N 3.15Å; L82-A86 HydrophobicContact CD2-CB 3.99Å; A86-L183 HydrophobicContact CB-CD2 3.63Å; A86-Y293 WeakPolarHBondContact CA-OH 3.39Å; A86-Y293 PolarHBondContact O-OH 3.13Å
87	F	96.7	Very high	96.5	Very high	139 Å²	139	48.5 Å²	48.5	61%	0.61	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.7	9.1	-176	-52	-71.1	0	0	0	113.7	L82 F85 L183	L82-F87 HydrophobicContact CD2-CE2 4.29Å; F85-F87 PolarHBondContact O-N 2.97Å; F87-L183 HydrophobicContact CE1-CD2 4.26Å; F87-L183 HydrophobicContact CZ-CD2 3.98Å
88	S	97.3	Very high	96.1	Very high	55 Å²	55	50.5 Å²	50.5	39%	0.385	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126	-56.2	-166.3	55.2	0	0	0	0	112.8	R84 F85 W298	R84-S88 PolarHBondContact O-OG 3.44Å; F85-S88 VanDerWaalsContact CA-OG 3.27Å; F85-S88 WeakPolarHBondContact CA-OG 3.33Å; F85-S88 PolarHBondContact N-OG 3.36Å; F85-S88 PolarHBondContact O-N 3.4Å; F85-S88 PolarHBondContact O-OG 2.82Å; S88-W298 WeakPolarHBondContact O-CZ2 3.47Å; S88-W298 PolarHBondContact O-NE1 2.98Å
89	R	98.1	Very high	95.8	Very high	90 Å²	90	48.4 Å²	48.4	34%	0.34	24%	0.239	S	C	.	.			trans	-158.1	155.4	-170.1	67.8	-168.7	177.4	110.4	-0.8	113.3	E69 F85 P295 W298	E69-R89 IonicContact OE1-NH2 3.77Å; E69-R89 IonicContact OE2-CZ 2.78Å; E69-R89 IonicContact OE2-NH1 3.55Å; E69-R89 PolarHBondContact OE2-NH1 3.2Å; E69-R89 IonicContact OE2-NH2 3.88Å; E69-R89 PolarHBondContact OE2-NH2 2.87Å; F85-R89 HydrophobicContact CD1-CG 3.82Å; F85-R89 HydrophobicContact CE1-CG 4.26Å; F85-R89 PolarHBondContact O-N 3.12Å; R89-P295 VanDerWaalsContact C-CG 3.46Å; R89-W298 HydrophobicContact CB-CH2 4.33Å; R89-W298 HydrophobicContact CB-CZ2 4.09Å
90	P	98.6	Very high	95.4	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.019	23%	0.229	C	C	.	.			trans	-69.7	158.2	177.5	29.7	-36.3	0	0	0	112.5	I68 L222 L255 L292 Y293 W298	I68-P90 HydrophobicContact CG2-CB 4.33Å; P90-L222 HydrophobicContact CB-CD2 4.01Å; P90-L222 HydrophobicContact CG-CD2 4.22Å; P90-L255 HydrophobicContact CG-CD1 3.68Å; P90-L292 HydrophobicContact CB-CD1 4.3Å; P90-Y293 WeakPolarHBondContact CA-O 3.46Å; P90-Y293 VanDerWaalsContact CB-O 3.24Å; P90-Y293 WeakPolarHBondContact CB-O 3.26Å; P90-W298 VanDerWaalsContact CD-CH2 3.42Å; P90-W298 VanDerWaalsContact CD-CZ3 3.41Å; P90-W298 HydrophobicContact CG-CE3 4.14Å; P90-W298 HydrophobicContact CG-CH2 4.33Å; P90-W298 HydrophobicContact CG-CZ3 3.9Å
91	V	98.4	Very high	95.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	145.3	177.3	60.3	0	0	0	0	110	E69 L71 F85 I93 Y293	E69-V91 WeakPolarHBondContact O-CG2 3.25Å; L71-V91 HydrophobicContact CD1-CG2 4.13Å; L71-V91 HydrophobicContact CG-CG2 4.21Å; F85-V91 HydrophobicContact CB-CG1 4.03Å; F85-V91 HydrophobicContact CD1-CB 3.58Å; F85-V91 HydrophobicContact CD1-CG1 3.87Å; F85-V91 HydrophobicContact CD1-CG2 4.18Å; F85-V91 HydrophobicContact CD2-CG1 4.26Å; F85-V91 HydrophobicContact CE1-CB 3.7Å; F85-V91 HydrophobicContact CE1-CG1 4.37Å; F85-V91 HydrophobicContact CE1-CG2 3.83Å; F85-V91 HydrophobicContact CE2-CG2 4.33Å; F85-V91 HydrophobicContact CG-CB 4.02Å; F85-V91 HydrophobicContact CG-CG1 3.79Å; F85-V91 HydrophobicContact CZ-CB 4.24Å; F85-V91 HydrophobicContact CZ-CG2 3.92Å; V91-I93 HydrophobicContact CG1-CD1 4.07Å; V91-I93 HydrophobicContact CG1-CG1 4Å; V91-I93 HydrophobicContact CG2-CG1 4.23Å; V91-Y293 HydrophobicContact CG1-CD1 4.39Å; V91-Y293 PolarHBondContact N-O 3.03Å; V91-Y293 PolarHBondContact O-N 3.32Å
92	I	97.6	Very high	94.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.5	167.7	-65.3	171.1	0	0	0	108.3	I68 E69 V70 L71 C257 Q290 V291 L292	I68-I92 HydrophobicContact CB-CD1 4.19Å; I68-I92 HydrophobicContact CB-CG1 4.41Å; I68-I92 HydrophobicContact CD1-CD1 4.49Å; I68-I92 HydrophobicContact CG2-CD1 4.31Å; I68-I92 HydrophobicContact CG2-CG1 3.97Å; E69-I92 PolarHBondContact O-N 3.2Å; V70-I92 CarbonylContact C-O 3.56Å; V70-I92 WeakPolarHBondContact CA-O 3.41Å; V70-I92 HydrophobicContact CB-CB 4.49Å; V70-I92 HydrophobicContact CG1-CB 4.35Å; V70-I92 HydrophobicContact CG1-CG2 4.1Å; V70-I92 HydrophobicContact CG2-CB 4.14Å; V70-I92 HydrophobicContact CG2-CD1 4.39Å; V70-I92 HydrophobicContact CG2-CG2 4.49Å; L71-I92 PolarHBondContact N-O 2.97Å; I92-C257 HydrophobicContact CD1-CB 3.49Å; I92-C257 VanDerWaalsContact CD1-CB 3.49Å; I92-C257 WeakPolarHBondContact CD1-SG 3.43Å; I92-Q290 HydrophobicContact CG2-CB 4Å; I92-Q290 HydrophobicContact CG2-CG 4.17Å; I92-V291 CarbonylContact C-O 3.57Å; I92-V291 WeakPolarHBondContact CA-O 2.96Å; I92-L292 HydrophobicContact CG1-CD1 4.05Å
93	I	96.2	Very high	94.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.4	-176.3	-46.7	168.4	0	0	0	107.8	L71 L76 V91 V96 Y181 F210 V291	L71-I93 WeakPolarHBondContact O-CA 3.11Å; L76-I93 HydrophobicContact CD2-CD1 3.69Å; L76-I93 HydrophobicContact CD2-CG1 4.03Å; V91-I93 HydrophobicContact CG1-CD1 4.07Å; V91-I93 HydrophobicContact CG1-CG1 4Å; V91-I93 HydrophobicContact CG2-CG1 4.23Å; I93-V96 HydrophobicContact CG2-CB 3.95Å; I93-V96 HydrophobicContact CG2-CG1 4.35Å; I93-V96 HydrophobicContact CG2-CG2 4.24Å; I93-Y181 HydrophobicContact CD1-CD2 3.88Å; I93-Y181 HydrophobicContact CD1-CE2 3.49Å; I93-Y181 VanDerWaalsContact CD1-CE2 3.49Å; I93-Y181 HydrophobicContact CG2-CE2 4.19Å; I93-F210 HydrophobicContact CD1-CE1 4.35Å; I93-V291 PolarHBondContact N-O 3.11Å; I93-V291 PolarHBondContact O-N 3.42Å
94	R	93.5	Very high	94.5	Very high	75 Å²	75	46.3 Å²	46.3	28%	0.283	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	141.3	-176	-75.7	-172.7	-57.3	173.1	5	111.7	V70 L71 G73 V96 E263 V288 R289 Q290	V70-R94 HydrophobicContact CG1-CG 3.94Å; L71-R94 PolarHBondContact O-N 2.57Å; G73-R94 WeakPolarHBondContact CA-O 3.24Å; G73-R94 PolarHBondContact N-O 2.63Å; R94-V96 PolarHBondContact O-N 2.77Å; R94-E263 IonicContact NH1-OE2 3.66Å; R94-V288 HydrophobicContact CB-CG1 3.67Å; R94-V288 HydrophobicContact CG-CG1 4.3Å; R94-R289 CarbonylContact C-O 3.5Å; R94-R289 VanDerWaalsContact CA-O 3.3Å; R94-R289 WeakPolarHBondContact CA-O 3.35Å; R94-Q290 HydrophobicContact CG-CG 3.99Å
95	G	90	Very high	94.3	Very high	45 Å²	45	44.7 Å²	44.7	46%	0.464	23%	0.227	S	C	.	.	S	Bend	trans	63.7	26.5	169.4	0	0	0	0	0	114.5	R289	G95-R289 PolarHBondContact N-O 3.22Å
96	V	91.2	Very high	94.3	Very high	27 Å²	27	44.7 Å²	44.7	16%	0.164	23%	0.227	C	C	.	.			trans	-85.6	-20.6	-176	74.6	0	0	0	0	113.4	I93 R94 P179 P180 Y181 V291	I93-V96 HydrophobicContact CG2-CB 3.95Å; I93-V96 HydrophobicContact CG2-CG1 4.35Å; I93-V96 HydrophobicContact CG2-CG2 4.24Å; R94-V96 PolarHBondContact O-N 2.77Å; V96-P179 HydrophobicContact CG1-CB 4.32Å; V96-P180 HydrophobicContact CG2-CG 3.77Å; V96-Y181 HydrophobicContact CG2-CE2 3.71Å; V96-V291 HydrophobicContact CG1-CB 4.48Å; V96-V291 HydrophobicContact CG1-CG2 4.02Å
97	T	89.6	Confident	94.2	Very high	18 Å²	18	45.7 Å²	45.7	11%	0.11	23%	0.233	C	C	.	.			trans	-138.5	146.5	-179.4	49.1	0	0	0	0	110.8	N99 Q177 A178	T97-N99 PolarHBondContact OG1-ND2 2.93Å; T97-Q177 HydrophobicContact CG2-CB 4.4Å; T97-Q177 VanDerWaalsContact CG2-O 3.23Å; T97-Q177 WeakPolarHBondContact CG2-O 3.3Å; T97-A178 WeakPolarHBondContact CG2-O 3.28Å
98	D	89.2	Confident	94.2	Very high	97 Å²	97	43 Å²	43	52%	0.519	22%	0.219	S	C	.	.			trans	-103.3	91.9	168.1	-178.7	12.6	0	0	0	110.5	T100 Q177 R289	D98-T100 VanDerWaalsContact OD1-CB 3.25Å; D98-T100 WeakPolarHBondContact OD1-CB 3.37Å; D98-T100 PolarHBondContact OD1-N 3.43Å; D98-T100 VanDerWaalsContact OD1-N 3.08Å; D98-T100 PolarHBondContact OD1-OG1 3.34Å; D98-Q177 PolarHBondContact O-NE2 2.93Å; D98-R289 IonicContact OD1-NH1 2.66Å
99	N	91.9	Very high	94.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.23	C	C	.	.			trans	-98.4	26.2	176.8	-78.4	-45.5	0	0	0	113	T97 R101 F102 Q103 Y176 Q177 E212	T97-N99 PolarHBondContact OG1-ND2 2.93Å; N99-R101 PolarHBondContact O-N 2.85Å; N99-F102 HydrophobicContact CB-CB 4.11Å; N99-F102 HydrophobicContact CB-CD1 4.46Å; N99-F102 WeakPolarHBondContact O-CB 3.47Å; N99-F102 PolarHBondContact O-N 2.81Å; N99-F102 VanDerWaalsContact O-N 3.11Å; N99-Q103 WeakPolarHBondContact O-CB 3.2Å; N99-Q103 PolarHBondContact O-N 3.49Å; N99-Y176 WeakPolarHBondContact ND2-CE2 3.23Å; N99-Q177 PolarHBondContact ND2-O 3.38Å; N99-Q177 WeakPolarHBondContact OD1-CB 3.23Å; N99-Q177 PolarHBondContact OD1-N 2.84Å; N99-E212 PolarHBondContact ND2-OE1 3.41Å; N99-E212 VanDerWaalsContact ND2-OE1 3.12Å; N99-E212 PolarHBondContact ND2-OE2 2.82Å; N99-E212 VanDerWaalsContact ND2-OE2 3.15Å
100	T	90.1	Very high	94	Very high	61 Å²	61	41.3 Å²	41.3	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-58.7	-48.9	-177.5	-55.9	0	0	0	0	112.6	D98 F102 Q103 D104 R289	D98-T100 VanDerWaalsContact OD1-CB 3.25Å; D98-T100 WeakPolarHBondContact OD1-CB 3.37Å; D98-T100 PolarHBondContact OD1-N 3.43Å; D98-T100 VanDerWaalsContact OD1-N 3.08Å; D98-T100 PolarHBondContact OD1-OG1 3.34Å; T100-F102 VanDerWaalsContact C-N 3.3Å; T100-F102 PolarHBondContact O-N 3.46Å; T100-Q103 WeakPolarHBondContact O-CB 3.45Å; T100-Q103 PolarHBondContact O-N 2.97Å; T100-D104 PolarHBondContact O-N 2.83Å; T100-D104 VanDerWaalsContact O-N 3.08Å; T100-R289 VanDerWaalsContact CA-NH2 3.26Å; T100-R289 PolarHBondContact OG1-NH1 2.88Å; T100-R289 PolarHBondContact OG1-NH2 2.92Å
101	R	91.4	Very high	93.9	Very high	161 Å²	161	41.2 Å²	41.2	61%	0.608	22%	0.224	S	C	*	.	H	α-helix	trans	-62.6	-37.1	174.8	-176.6	-178.8	-179.2	173.3	7	112.9	N99 Q103 L105	N99-R101 PolarHBondContact O-N 2.85Å; R101-Q103 VanDerWaalsContact C-N 3.35Å; R101-L105 WeakPolarHBondContact O-CG 3.21Å; R101-L105 PolarHBondContact O-N 3.38Å
102	F	94.4	Very high	93.9	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-66	-41.6	178	178.4	-104.4	0	0	0	110.7	N99 T100 L105 C106 L172 R175 Y176 F192 I214 I311	N99-F102 HydrophobicContact CB-CB 4.11Å; N99-F102 HydrophobicContact CB-CD1 4.46Å; N99-F102 WeakPolarHBondContact O-CB 3.47Å; N99-F102 PolarHBondContact O-N 2.81Å; N99-F102 VanDerWaalsContact O-N 3.11Å; T100-F102 VanDerWaalsContact C-N 3.3Å; T100-F102 PolarHBondContact O-N 3.46Å; F102-L105 WeakPolarHBondContact O-CB 3.46Å; F102-L105 PolarHBondContact O-N 2.66Å; F102-C106 PolarHBondContact O-N 3.02Å; F102-C106 PolarHBondContact O-SG 2.91Å; F102-C106 VanDerWaalsContact O-SG 3.33Å; F102-L172 HydrophobicContact CD2-CD1 4.22Å; F102-L172 HydrophobicContact CE2-CD1 3.89Å; F102-L172 HydrophobicContact CE2-CG 3.86Å; F102-L172 WeakPolarHBondContact CE2-O 3.39Å; F102-R175 HydrophobicContact CD2-CB 4.09Å; F102-Y176 AromaticContact CD1-CD2 3.75Å; F102-Y176 HydrophobicContact CD1-CD2 3.75Å; F102-Y176 AromaticContact CE1-CD2 3.68Å; F102-Y176 HydrophobicContact CE1-CD2 3.68Å; F102-Y176 HydrophobicContact CE1-CE2 4.43Å; F102-Y176 HydrophobicContact CE1-CG 4.39Å; F102-Y176 HydrophobicContact CG-CD2 4.2Å; F102-Y176 HydrophobicContact CZ-CD2 4.1Å; F102-Y176 HydrophobicContact CZ-CG 4.35Å; F102-F192 HydrophobicContact CZ-CD2 4.21Å; F102-F192 HydrophobicContact CZ-CE2 4.21Å; F102-I214 HydrophobicContact CD1-CD1 3.75Å; F102-I214 HydrophobicContact CD1-CG1 4.24Å; F102-I214 HydrophobicContact CE1-CD1 3.65Å; F102-I214 HydrophobicContact CE1-CG1 3.8Å; F102-I311 HydrophobicContact CE1-CG2 4.3Å; F102-I311 HydrophobicContact CZ-CD1 4Å
103	Q	93.6	Very high	93.9	Very high	10 Å²	10	51.1 Å²	51.1	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-58.2	-48	174.4	-177.3	176.6	37.4	0	0	111.7	N99 T100 R101 L105 C106 S107 I214 Y215	N99-Q103 WeakPolarHBondContact O-CB 3.2Å; N99-Q103 PolarHBondContact O-N 3.49Å; T100-Q103 WeakPolarHBondContact O-CB 3.45Å; T100-Q103 PolarHBondContact O-N 2.97Å; R101-Q103 VanDerWaalsContact C-N 3.35Å; Q103-L105 VanDerWaalsContact C-N 3.28Å; Q103-L105 PolarHBondContact O-N 2.89Å; Q103-C106 CarbonylContact O-C 3.59Å; Q103-C106 WeakPolarHBondContact O-CA 3.26Å; Q103-C106 WeakPolarHBondContact O-CB 3.22Å; Q103-C106 PolarHBondContact O-N 2.79Å; Q103-S107 PolarHBondContact O-N 3.03Å; Q103-I214 HydrophobicContact CB-CG2 3.84Å; Q103-I214 HydrophobicContact CG-CG2 3.8Å; Q103-I214 PolarHBondContact NE2-O 2.99Å; Q103-Y215 HydrophobicContact CG-CD1 4.48Å; Q103-Y215 HydrophobicContact CG-CE1 3.74Å; Q103-Y215 HydrophobicContact CG-CE2 3.86Å; Q103-Y215 VanDerWaalsContact CG-CZ 3.42Å; Q103-Y215 VanDerWaalsContact O-CE2 3.26Å; Q103-Y215 WeakPolarHBondContact O-CE2 3.38Å; Q103-Y215 PolarHBondContact O-OH 2.98Å; Q103-Y215 VanDerWaalsContact O-OH 3.06Å
104	D	92.6	Very high	93.9	Very high	99 Å²	99	58.3 Å²	58.3	53%	0.529	30%	0.298	S	S	.	.	H	α-helix	trans	-57.3	-41.8	177.4	-63.2	-24	0	0	0	112.4	T100 C106 S107	T100-D104 PolarHBondContact O-N 2.83Å; T100-D104 VanDerWaalsContact O-N 3.08Å; D104-C106 PolarHBondContact O-N 2.87Å; D104-S107 WeakPolarHBondContact O-CB 3.39Å; D104-S107 PolarHBondContact O-N 2.93Å; D104-S107 PolarHBondContact O-OG 3.09Å
105	L	95.3	Very high	94	Very high	56 Å²	56	55.1 Å²	55.1	29%	0.293	29%	0.286	S	S	.	.	H	α-helix	trans	-65.6	-25.8	175.9	-68.4	171.5	0	0	0	112.6	R101 F102 Q103 S107 L111 L172 R175	R101-L105 WeakPolarHBondContact O-CG 3.21Å; R101-L105 PolarHBondContact O-N 3.38Å; F102-L105 WeakPolarHBondContact O-CB 3.46Å; F102-L105 PolarHBondContact O-N 2.66Å; Q103-L105 VanDerWaalsContact C-N 3.28Å; Q103-L105 PolarHBondContact O-N 2.89Å; L105-S107 VanDerWaalsContact C-N 3.31Å; L105-L111 WeakPolarHBondContact O-CD2 3.46Å; L105-L172 HydrophobicContact CB-CD1 3.86Å; L105-R175 HydrophobicContact CD1-CB 4.04Å; L105-R175 HydrophobicContact CD1-CG 3.81Å
106	C	96.4	Very high	94.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	5.6	177.5	-72.5	0	0	0	0	113.9	W52 F102 Q103 D104 I214 Y215 V309	W52-C106 PolarHBondContact NE1-O 3.34Å; F102-C106 PolarHBondContact O-N 3.02Å; F102-C106 PolarHBondContact O-SG 2.91Å; F102-C106 VanDerWaalsContact O-SG 3.33Å; Q103-C106 CarbonylContact O-C 3.59Å; Q103-C106 WeakPolarHBondContact O-CA 3.26Å; Q103-C106 WeakPolarHBondContact O-CB 3.22Å; Q103-C106 PolarHBondContact O-N 2.79Å; D104-C106 PolarHBondContact O-N 2.87Å; C106-I214 HydrophobicContact CB-CG2 3.79Å; C106-Y215 HydrophobicContact CB-CD2 4.36Å; C106-Y215 HydrophobicContact CB-CE2 4.04Å; C106-Y215 WeakPolarHBondContact O-CE2 3.11Å; C106-V309 HydrophobicContact CB-CG1 4.13Å
107	S	96.1	Very high	94.6	Very high	21 Å²	21	57 Å²	57	15%	0.147	29%	0.293	C	S	.	.	S	Bend	trans	-58.5	151.8	170.9	58.6	0	0	0	0	111.7	G50 Q103 D104 L105 S109 G110 L111	G50-S107 CarbonylContact O-C 3.56Å; G50-S107 WeakPolarHBondContact O-CA 3.41Å; Q103-S107 PolarHBondContact O-N 3.03Å; D104-S107 WeakPolarHBondContact O-CB 3.39Å; D104-S107 PolarHBondContact O-N 2.93Å; D104-S107 PolarHBondContact O-OG 3.09Å; L105-S107 VanDerWaalsContact C-N 3.31Å; S107-S109 VanDerWaalsContact C-N 3.33Å; S107-S109 PolarHBondContact O-N 3.36Å; S107-G110 PolarHBondContact O-N 2.98Å; S107-G110 PolarHBondContact OG-N 3.39Å; S107-L111 PolarHBondContact O-N 3.4Å
108	R	96.3	Very high	94.9	Very high	84 Å²	84	58 Å²	58	32%	0.317	30%	0.298	S	S	.	.	H	α-helix	trans	-55.4	-48.6	-179.6	-174.7	-179.9	-174.9	-77.1	-3.8	111.7	G50 G51 W52 L112 D142	G50-R108 PolarHBondContact O-N 3.27Å; G51-R108 WeakPolarHBondContact O-CB 3.31Å; G51-R108 WeakPolarHBondContact O-CD 3.31Å; W52-R108 HydrophobicContact CD2-CB 3.82Å; W52-R108 HydrophobicContact CD2-CG 4.35Å; W52-R108 HydrophobicContact CE3-CB 4Å; W52-R108 HydrophobicContact CE3-CG 4.01Å; W52-R108 HydrophobicContact CG-CB 4.4Å; W52-R108 HydrophobicContact CH2-CB 4.07Å; W52-R108 HydrophobicContact CH2-CG 4.03Å; W52-R108 HydrophobicContact CZ2-CB 3.89Å; W52-R108 HydrophobicContact CZ2-CG 4.37Å; W52-R108 HydrophobicContact CZ3-CB 4.12Å; W52-R108 HydrophobicContact CZ3-CG 3.84Å; R108-L112 HydrophobicContact CG-CD1 3.96Å; R108-L112 WeakPolarHBondContact O-CB 3.36Å; R108-L112 VanDerWaalsContact O-CG 3.28Å; R108-L112 WeakPolarHBondContact O-CG 3.27Å; R108-L112 PolarHBondContact O-N 3.31Å; R108-D142 IonicContact CZ-OD1 2.68Å; R108-D142 IonicContact NH2-OD1 3.07Å; R108-D142 PolarHBondContact NH2-OD1 2.78Å
109	S	96	Very high	95.2	Very high	88 Å²	88	57.2 Å²	57.2	62%	0.615	30%	0.297	S	S	*	.	H	α-helix	trans	-65	-42.8	178.2	54.9	0	0	0	0	111.9	S107 Q113	S107-S109 VanDerWaalsContact C-N 3.33Å; S107-S109 PolarHBondContact O-N 3.36Å; S109-Q113 WeakPolarHBondContact O-CB 3.38Å; S109-Q113 PolarHBondContact O-N 3.49Å
110	G	95.7	Very high	95.4	Very high	21 Å²	21	57.3 Å²	57.3	22%	0.216	30%	0.298	C	S	.	.	H	α-helix	trans	-61.3	-47.6	178.2	0	0	0	0	0	112.7	S107 R114	S107-G110 PolarHBondContact O-N 2.98Å; S107-G110 PolarHBondContact OG-N 3.39Å; G110-R114 PolarHBondContact O-N 3.29Å
111	L	97.3	Very high	95.6	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-68.1	-44.3	178.7	-66.3	-173.7	0	0	0	112.1	W52 L105 S107 Q113 R114 Y115 F137 L172 F192 I194	W52-L111 HydrophobicContact CH2-CD1 4.26Å; W52-L111 HydrophobicContact CZ2-CD1 3.75Å; W52-L111 HydrophobicContact CZ2-CG 4.41Å; L105-L111 WeakPolarHBondContact O-CD2 3.46Å; S107-L111 PolarHBondContact O-N 3.4Å; L111-Q113 PolarHBondContact O-N 2.93Å; L111-R114 PolarHBondContact O-N 3.19Å; L111-Y115 HydrophobicContact CD2-CD2 3.93Å; L111-Y115 HydrophobicContact CD2-CE2 4.09Å; L111-Y115 WeakPolarHBondContact O-CA 3.19Å; L111-Y115 WeakPolarHBondContact O-CB 3.43Å; L111-Y115 PolarHBondContact O-N 3.38Å; L111-F137 HydrophobicContact CB-CE1 3.68Å; L111-F137 HydrophobicContact CB-CZ 4.02Å; L111-F137 HydrophobicContact CD1-CZ 4.25Å; L111-L172 HydrophobicContact CD2-CD1 4.43Å; L111-L172 HydrophobicContact CD2-CD2 3.77Å; L111-F192 HydrophobicContact CD1-CE1 4.19Å; L111-F192 HydrophobicContact CD1-CZ 3.88Å; L111-I194 HydrophobicContact CD1-CD1 3.62Å
112	L	97.4	Very high	95.6	Very high	31 Å²	31	51.8 Å²	51.8	16%	0.162	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-40.8	179.1	-74.5	176.1	0	0	0	112.3	R108 R114 G116 F137 Q138 V141	R108-L112 HydrophobicContact CG-CD1 3.96Å; R108-L112 WeakPolarHBondContact O-CB 3.36Å; R108-L112 VanDerWaalsContact O-CG 3.28Å; R108-L112 WeakPolarHBondContact O-CG 3.27Å; R108-L112 PolarHBondContact O-N 3.31Å; L112-R114 VanDerWaalsContact C-N 3.31Å; L112-R114 PolarHBondContact O-N 3.22Å; L112-G116 VanDerWaalsContact O-CA 3.25Å; L112-G116 WeakPolarHBondContact O-CA 3.33Å; L112-G116 PolarHBondContact O-N 2.87Å; L112-F137 HydrophobicContact CD2-CD1 4.16Å; L112-F137 HydrophobicContact CD2-CE1 4.06Å; L112-Q138 HydrophobicContact CD2-CB 4.19Å; L112-Q138 HydrophobicContact CD2-CG 4.31Å; L112-V141 HydrophobicContact CD1-CG1 4.13Å; L112-V141 HydrophobicContact CD2-CB 3.98Å; L112-V141 HydrophobicContact CD2-CG1 4.11Å; L112-V141 HydrophobicContact CD2-CG2 4.07Å; L112-V141 HydrophobicContact CG-CG1 4.43Å
113	Q	96.8	Very high	95.3	Very high	178 Å²	178	51.8 Å²	51.8	83%	0.832	27%	0.27	S	S	*	.	H	α-helix	trans	-61.3	-40	179	-179.2	-179.3	67.6	0	0	112.1	S109 L111	S109-Q113 WeakPolarHBondContact O-CB 3.38Å; S109-Q113 PolarHBondContact O-N 3.49Å; L111-Q113 PolarHBondContact O-N 2.93Å
114	R	96.4	Very high	94.8	Very high	150 Å²	150	51.4 Å²	51.4	57%	0.566	27%	0.269	S	S	*	.	H	α-helix	trans	-95.7	-35.4	-173	-178.4	170	-90.1	-170.3	-8	114	G110 L111 L112	G110-R114 PolarHBondContact O-N 3.29Å; L111-R114 PolarHBondContact O-N 3.19Å; L112-R114 VanDerWaalsContact C-N 3.31Å; L112-R114 PolarHBondContact O-N 3.22Å
115	Y	96.9	Very high	94	Very high	9 Å²	9	46.7 Å²	46.7	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-118.1	-4.2	-171	-54.4	-83.1	0	0	0	113	L111 S117 L118 F137 W169 L172	L111-Y115 HydrophobicContact CD2-CD2 3.93Å; L111-Y115 HydrophobicContact CD2-CE2 4.09Å; L111-Y115 WeakPolarHBondContact O-CA 3.19Å; L111-Y115 WeakPolarHBondContact O-CB 3.43Å; L111-Y115 PolarHBondContact O-N 3.38Å; Y115-S117 VanDerWaalsContact C-N 3.3Å; Y115-S117 PolarHBondContact O-N 3.29Å; Y115-S117 VanDerWaalsContact O-N 3.17Å; Y115-L118 HydrophobicContact CD1-CD1 3.63Å; Y115-L118 HydrophobicContact CG-CD1 4.39Å; Y115-L118 WeakPolarHBondContact O-CB 3.38Å; Y115-L118 PolarHBondContact O-N 3.25Å; Y115-F137 WeakPolarHBondContact O-CB 3.38Å; Y115-W169 HydrophobicContact CD1-CD2 4.24Å; Y115-W169 HydrophobicContact CD1-CE3 4.19Å; Y115-W169 HydrophobicContact CD1-CH2 4.43Å; Y115-W169 HydrophobicContact CD1-CZ2 4.46Å; Y115-W169 HydrophobicContact CD1-CZ3 4.3Å; Y115-W169 HydrophobicContact CD2-CZ3 4.37Å; Y115-W169 HydrophobicContact CE1-CE3 4.4Å; Y115-W169 HydrophobicContact CG-CE3 4.44Å; Y115-W169 HydrophobicContact CG-CH2 4.1Å; Y115-W169 HydrophobicContact CG-CZ2 4.44Å; Y115-W169 HydrophobicContact CG-CZ3 4.1Å; Y115-L172 HydrophobicContact CE2-CB 4.36Å; Y115-L172 HydrophobicContact CE2-CD2 4.48Å; Y115-L172 WeakPolarHBondContact OH-CB 3.36Å; Y115-L172 PolarHBondContact OH-N 3.06Å
116	G	96.9	Very high	93.1	Very high	3 Å²	3	44.3 Å²	44.3	3%	0.031	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-40.9	-173.9	0	0	0	0	0	115.2	L112 F137 Q138	L112-G116 VanDerWaalsContact O-CA 3.25Å; L112-G116 WeakPolarHBondContact O-CA 3.33Å; L112-G116 PolarHBondContact O-N 2.87Å; G116-F137 PolarHBondContact O-N 2.91Å; G116-Q138 VanDerWaalsContact O-CB 3.3Å; G116-Q138 WeakPolarHBondContact O-CB 3.22Å; G116-Q138 PolarHBondContact O-N 3.35Å
117	S	96.7	Very high	91.8	Very high	107 Å²	107	45.3 Å²	45.3	75%	0.748	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-8	-179.5	62.7	0	0	0	0	114.4	Y115	Y115-S117 VanDerWaalsContact C-N 3.3Å; Y115-S117 PolarHBondContact O-N 3.29Å; Y115-S117 VanDerWaalsContact O-N 3.17Å
118	L	95.9	Very high	90.7	Very high	40 Å²	40	49.5 Å²	49.5	21%	0.209	25%	0.254	C	S	.	.	S	Bend	trans	-77.7	150.1	-178.6	-60	-177.9	0	0	0	111	Y115 A136 F137 E168	Y115-L118 HydrophobicContact CD1-CD1 3.63Å; Y115-L118 HydrophobicContact CG-CD1 4.39Å; Y115-L118 WeakPolarHBondContact O-CB 3.38Å; Y115-L118 PolarHBondContact O-N 3.25Å; L118-A136 CarbonylContact O-C 3.52Å; L118-A136 WeakPolarHBondContact O-CA 3.26Å; L118-F137 PolarHBondContact O-N 2.85Å; L118-E168 HydrophobicContact CD1-CB 4.08Å
119	T	95.6	Very high	89.4	Confident	81 Å²	81	46.5 Å²	46.5	50%	0.497	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	128.3	173.7	-58.3	0	0	0	0	110	D134 V135	T119-D134 HydrophobicContact CG2-CB 3.74Å; T119-V135 CarbonylContact C-O 3.51Å; T119-V135 WeakPolarHBondContact CA-O 3.47Å
120	V	95.3	Very high	88.1	Confident	3 Å²	3	50 Å²	50	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.2	169.2	-66.2	0	0	0	0	110.1	L122 D134 V135 F137 F160 W169	V120-L122 HydrophobicContact CG2-CD2 4.16Å; V120-D134 WeakPolarHBondContact O-CA 3.35Å; V120-V135 HydrophobicContact CG2-CG2 3.97Å; V120-V135 PolarHBondContact N-O 2.98Å; V120-V135 PolarHBondContact O-N 2.85Å; V120-F137 HydrophobicContact CG1-CB 3.94Å; V120-F137 HydrophobicContact CG1-CD2 3.98Å; V120-F137 HydrophobicContact CG1-CG 4.32Å; V120-F137 HydrophobicContact CG2-CB 4.36Å; V120-F137 HydrophobicContact CG2-CD2 4.37Å; V120-F160 HydrophobicContact CB-CD2 3.99Å; V120-F160 HydrophobicContact CB-CE2 3.8Å; V120-F160 HydrophobicContact CB-CZ 4.14Å; V120-F160 HydrophobicContact CG1-CD2 4.42Å; V120-F160 HydrophobicContact CG1-CE1 4.1Å; V120-F160 HydrophobicContact CG1-CE2 3.9Å; V120-F160 HydrophobicContact CG1-CZ 3.7Å; V120-W169 HydrophobicContact CG1-CH2 4.43Å; V120-W169 HydrophobicContact CG1-CZ2 3.55Å
121	R	94	Very high	87.3	Confident	105 Å²	105	56.4 Å²	56.4	40%	0.396	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	115.2	175.4	-178.3	159.5	-69	153.3	3.9	110	K132 D134 D163	R121-K132 HydrophobicContact CG-CB 4.07Å; R121-K132 HydrophobicContact CG-CD 4.14Å; R121-K132 HydrophobicContact CG-CG 4.47Å; R121-D134 WeakPolarHBondContact CA-OD1 3.3Å; R121-D134 WeakPolarHBondContact CB-OD1 3.32Å; R121-D134 WeakPolarHBondContact CG-OD1 3.29Å; R121-D134 IonicContact CZ-OD1 3.26Å; R121-D134 IonicContact CZ-OD2 2.77Å; R121-D134 IonicContact NE-OD1 3.64Å; R121-D134 PolarHBondContact NE-OD1 3.08Å; R121-D134 IonicContact NE-OD2 3.46Å; R121-D134 IonicContact NH2-OD1 2.81Å; R121-D134 PolarHBondContact NH2-OD1 3.06Å; R121-D134 IonicContact NH2-OD2 3.68Å; R121-D134 PolarHBondContact NH2-OD2 2.9Å; R121-D163 HydrophobicContact CB-CB 4.11Å; R121-D163 HydrophobicContact CG-CB 4.18Å
122	L	91.5	Very high	86.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	147.4	174.6	-52	-177.8	0	0	0	110.4	V120 K132 V133 V135 Y140 L144 L158 F160	V120-L122 HydrophobicContact CG2-CD2 4.16Å; L122-K132 VanDerWaalsContact O-CA 3.26Å; L122-K132 WeakPolarHBondContact O-CA 3.36Å; L122-V133 WeakPolarHBondContact CB-O 3.45Å; L122-V133 PolarHBondContact N-O 3.29Å; L122-V133 PolarHBondContact O-N 3.01Å; L122-V135 HydrophobicContact CD1-CG1 4.41Å; L122-V135 HydrophobicContact CD1-CG2 3.69Å; L122-V135 HydrophobicContact CD2-CG2 4.41Å; L122-V135 HydrophobicContact CG-CG2 3.93Å; L122-Y140 HydrophobicContact CD1-CD2 3.57Å; L122-Y140 HydrophobicContact CD1-CE2 4.13Å; L122-Y140 HydrophobicContact CD1-CG 4.37Å; L122-Y140 HydrophobicContact CD2-CD1 4.31Å; L122-Y140 HydrophobicContact CD2-CD2 3.51Å; L122-Y140 HydrophobicContact CD2-CE2 3.81Å; L122-Y140 HydrophobicContact CD2-CG 3.81Å; L122-Y140 HydrophobicContact CG-CD2 4.19Å; L122-L144 HydrophobicContact CD1-CD1 3.66Å; L122-L158 HydrophobicContact CB-CB 4.28Å; L122-L158 HydrophobicContact CB-CD2 4.32Å; L122-L158 HydrophobicContact CD1-CB 4.21Å; L122-L158 HydrophobicContact CD1-CD1 4.43Å; L122-F160 HydrophobicContact CD2-CB 3.71Å; L122-F160 HydrophobicContact CD2-CG 4.48Å
123	S	88.3	Confident	86.4	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	149.6	178.3	-63	0	0	0	0	110.7	K132 L158 Y159	S123-K132 WeakPolarHBondContact OG-CD 3.49Å; S123-K132 PolarHBondContact OG-NZ 2.96Å; S123-L158 WeakPolarHBondContact O-CA 3.42Å; S123-Y159 PolarHBondContact N-O 2.86Å; S123-Y159 PolarHBondContact O-N 3.22Å; S123-Y159 VanDerWaalsContact O-N 3.07Å
124	T	83.4	Confident	86.3	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	144	167.5	50.7	0	0	0	0	111.4	N126 S129 Y130 R131 S155 T157 L158	T124-N126 WeakPolarHBondContact CB-OD1 3.46Å; T124-N126 PolarHBondContact O-N 2.82Å; T124-N126 PolarHBondContact OG1-OD1 3.17Å; T124-S129 WeakPolarHBondContact O-CA 3.25Å; T124-S129 WeakPolarHBondContact O-CB 3.3Å; T124-S129 PolarHBondContact O-OG 2.89Å; T124-S129 WeakPolarHBondContact OG1-CA 3.43Å; T124-Y130 PolarHBondContact OG1-N 3Å; T124-R131 HydrophobicContact CG2-CB 3.72Å; T124-R131 HydrophobicContact CG2-CG 4.48Å; T124-R131 PolarHBondContact N-O 3.35Å; T124-R131 PolarHBondContact OG1-N 2.8Å; T124-S155 WeakPolarHBondContact CG2-O 3.47Å; T124-T157 CarbonylContact C-O 3.58Å; T124-T157 VanDerWaalsContact CA-O 3.29Å; T124-T157 WeakPolarHBondContact CA-O 3.46Å; T124-L158 HydrophobicContact CG2-CD2 3.95Å
125	A	76.7	Confident	86.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-82.8	21.6	-177.9	0	0	0	0	0	113.8	G154 T157 Y159 G200 P202	A125-G154 CarbonylContact C-O 3.59Å; A125-G154 WeakPolarHBondContact CA-O 3.44Å; A125-G154 PolarHBondContact N-O 3.46Å; A125-T157 HydrophobicContact CB-CG2 3.83Å; A125-T157 PolarHBondContact N-O 2.99Å; A125-Y159 HydrophobicContact CB-CD1 3.84Å; A125-Y159 HydrophobicContact CB-CE1 3.87Å; A125-G200 WeakPolarHBondContact CB-O 3.4Å; A125-P202 WeakPolarHBondContact O-CD 3.35Å
126	N	75.6	Confident	86.3	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.027	26%	0.257	C	S	.	.	S	Bend	trans	-92.1	166.2	170.4	63.9	-19.1	0	0	0	111.1	T124 H128 S129 G154	T124-N126 WeakPolarHBondContact CB-OD1 3.46Å; T124-N126 PolarHBondContact O-N 2.82Å; T124-N126 PolarHBondContact OG1-OD1 3.17Å; N126-H128 PolarHBondContact O-N 3.01Å; N126-S129 PolarHBondContact O-N 3.06Å; N126-S129 WeakPolarHBondContact OD1-CA 3.41Å; N126-S129 PolarHBondContact OD1-N 3.33Å; N126-G154 PolarHBondContact N-O 3.08Å
127	T	70.2	Confident	86.3	Confident	22 Å²	22	51.2 Å²	51.2	14%	0.135	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-30.4	-172.4	-67.6	0	0	0	0	115.3	F203 H204 P233	T127-F203 PolarHBondContact OG1-O 3.18Å; T127-H204 HydrophobicContact CG2-CB 3.98Å; T127-P233 HydrophobicContact CG2-CB 4.43Å; T127-P233 PolarHBondContact N-O 3.42Å; T127-P233 VanDerWaalsContact N-O 3.15Å; T127-P233 WeakPolarHBondContact OG1-CA 3.46Å; T127-P233 PolarHBondContact OG1-O 3.27Å
128	H	71.5	Confident	86.3	Confident	108 Å²	108	50.8 Å²	50.8	50%	0.5	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-1.2	-176.1	-59.5	-70.5	0	0	0	114.5	N126 Y130	N126-H128 PolarHBondContact O-N 3.01Å; H128-Y130 HydrophobicContact CB-CD1 3.84Å; H128-Y130 HydrophobicContact CB-CD2 3.86Å; H128-Y130 HydrophobicContact CB-CE1 3.41Å; H128-Y130 VanDerWaalsContact CB-CE1 3.41Å; H128-Y130 HydrophobicContact CB-CE2 3.44Å; H128-Y130 VanDerWaalsContact CB-CE2 3.44Å; H128-Y130 HydrophobicContact CB-CG 4.05Å; H128-Y130 AromaticContact CD2-CE2 3.64Å; H128-Y130 AromaticContact CD2-CZ 3.46Å; H128-Y130 VanDerWaalsContact CD2-CZ 3.46Å; H128-Y130 PolarHBondContact CD2-OH 2.75Å; H128-Y130 AromaticContact CG-CE1 3.99Å; H128-Y130 AromaticContact CG-CE2 3.83Å; H128-Y130 AromaticContact CG-CZ 3.41Å; H128-Y130 VanDerWaalsContact CG-CZ 3.41Å; H128-Y130 PolarHBondContact O-N 2.88Å; H128-Y130 VanDerWaalsContact O-N 3.08Å
129	S	70.3	Confident	86.3	Confident	22 Å²	22	52.5 Å²	52.5	15%	0.154	25%	0.251	C	S	.	.			trans	48.2	39.9	177.9	-63.4	0	0	0	0	115.1	T124 N126 R131 K132	T124-S129 WeakPolarHBondContact O-CA 3.25Å; T124-S129 WeakPolarHBondContact O-CB 3.3Å; T124-S129 PolarHBondContact O-OG 2.89Å; T124-S129 WeakPolarHBondContact OG1-CA 3.43Å; N126-S129 PolarHBondContact O-N 3.06Å; N126-S129 WeakPolarHBondContact OD1-CA 3.41Å; N126-S129 PolarHBondContact OD1-N 3.33Å; S129-R131 VanDerWaalsContact C-N 3.32Å; S129-R131 PolarHBondContact O-N 2.84Å; S129-K132 WeakPolarHBondContact O-CE 3.34Å
130	Y	68.3	Low	86.3	Confident	161 Å²	161	48.7 Å²	48.7	63%	0.631	23%	0.228	S	C	*	.			trans	-59.1	-34.5	-166.9	-68.9	-58.5	0	0	0	115.1	T124 H128	T124-Y130 PolarHBondContact OG1-N 3Å; H128-Y130 HydrophobicContact CB-CD1 3.84Å; H128-Y130 HydrophobicContact CB-CD2 3.86Å; H128-Y130 HydrophobicContact CB-CE1 3.41Å; H128-Y130 VanDerWaalsContact CB-CE1 3.41Å; H128-Y130 HydrophobicContact CB-CE2 3.44Å; H128-Y130 VanDerWaalsContact CB-CE2 3.44Å; H128-Y130 HydrophobicContact CB-CG 4.05Å; H128-Y130 AromaticContact CD2-CE2 3.64Å; H128-Y130 AromaticContact CD2-CZ 3.46Å; H128-Y130 VanDerWaalsContact CD2-CZ 3.46Å; H128-Y130 PolarHBondContact CD2-OH 2.75Å; H128-Y130 AromaticContact CG-CE1 3.99Å; H128-Y130 AromaticContact CG-CE2 3.83Å; H128-Y130 AromaticContact CG-CZ 3.41Å; H128-Y130 VanDerWaalsContact CG-CZ 3.41Å; H128-Y130 PolarHBondContact O-N 2.88Å; H128-Y130 VanDerWaalsContact O-N 3.08Å
131	R	78.4	Confident	86.3	Confident	156 Å²	156	48.9 Å²	48.9	59%	0.589	23%	0.229	S	C	*	.			trans	-97.5	127.6	-179.5	-179.3	-174.9	-179.4	-162.3	0.8	109.5	T124 S129 V133	T124-R131 HydrophobicContact CG2-CB 3.72Å; T124-R131 HydrophobicContact CG2-CG 4.48Å; T124-R131 PolarHBondContact N-O 3.35Å; T124-R131 PolarHBondContact OG1-N 2.8Å; S129-R131 VanDerWaalsContact C-N 3.32Å; S129-R131 PolarHBondContact O-N 2.84Å; R131-V133 HydrophobicContact CG-CG2 4.18Å
132	K	86.4	Confident	86.3	Confident	89 Å²	89	47.9 Å²	47.9	39%	0.387	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.3	173.1	-57	-68.1	179.1	159.6	0	109.7	R121 L122 S123 S129 D163	R121-K132 HydrophobicContact CG-CB 4.07Å; R121-K132 HydrophobicContact CG-CD 4.14Å; R121-K132 HydrophobicContact CG-CG 4.47Å; L122-K132 VanDerWaalsContact O-CA 3.26Å; L122-K132 WeakPolarHBondContact O-CA 3.36Å; S123-K132 WeakPolarHBondContact OG-CD 3.49Å; S123-K132 PolarHBondContact OG-NZ 2.96Å; S129-K132 WeakPolarHBondContact O-CE 3.34Å; K132-D163 WeakPolarHBondContact CE-OD2 3.23Å; K132-D163 IonicContact NZ-OD2 3.29Å; K132-D163 PolarHBondContact NZ-OD2 2.79Å
133	V	90.1	Very high	86.3	Confident	34 Å²	34	56.3 Å²	56.3	21%	0.206	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	122.2	179	-175.1	0	0	0	0	108.7	L122 R131 V135 L158	L122-V133 WeakPolarHBondContact CB-O 3.45Å; L122-V133 PolarHBondContact N-O 3.29Å; L122-V133 PolarHBondContact O-N 3.01Å; R131-V133 HydrophobicContact CG-CG2 4.18Å; V133-V135 HydrophobicContact CG1-CG1 4.02Å; V133-L158 HydrophobicContact CB-CD1 4.31Å; V133-L158 HydrophobicContact CG2-CD1 4.04Å; V133-L158 HydrophobicContact CG2-CD2 4.01Å
134	D	94.4	Very high	86.5	Confident	81 Å²	81	59.1 Å²	59.1	43%	0.433	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.4	177.7	-68.6	-10.3	0	0	0	109.4	T119 V120 R121	T119-D134 HydrophobicContact CG2-CB 3.74Å; V120-D134 WeakPolarHBondContact O-CA 3.35Å; R121-D134 WeakPolarHBondContact CA-OD1 3.3Å; R121-D134 WeakPolarHBondContact CB-OD1 3.32Å; R121-D134 WeakPolarHBondContact CG-OD1 3.29Å; R121-D134 IonicContact CZ-OD1 3.26Å; R121-D134 IonicContact CZ-OD2 2.77Å; R121-D134 IonicContact NE-OD1 3.64Å; R121-D134 PolarHBondContact NE-OD1 3.08Å; R121-D134 IonicContact NE-OD2 3.46Å; R121-D134 IonicContact NH2-OD1 2.81Å; R121-D134 PolarHBondContact NH2-OD1 3.06Å; R121-D134 IonicContact NH2-OD2 3.68Å; R121-D134 PolarHBondContact NH2-OD2 2.9Å
135	V	95.3	Very high	86.9	Confident	30 Å²	30	59.4 Å²	59.4	18%	0.182	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	162.3	179.1	-59.7	0	0	0	0	110.4	T119 V120 L122 V133 L144	T119-V135 CarbonylContact C-O 3.51Å; T119-V135 WeakPolarHBondContact CA-O 3.47Å; V120-V135 HydrophobicContact CG2-CG2 3.97Å; V120-V135 PolarHBondContact N-O 2.98Å; V120-V135 PolarHBondContact O-N 2.85Å; L122-V135 HydrophobicContact CD1-CG1 4.41Å; L122-V135 HydrophobicContact CD1-CG2 3.69Å; L122-V135 HydrophobicContact CD2-CG2 4.41Å; L122-V135 HydrophobicContact CG-CG2 3.93Å; V133-V135 HydrophobicContact CG1-CG1 4.02Å; V135-L144 HydrophobicContact CG1-CD1 4.43Å
136	A	96.7	Very high	87.6	Confident	28 Å²	28	67.4 Å²	67.4	23%	0.231	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	141.4	166.8	0	0	0	0	0	110.1	L118 Q138 D139 Y140	L118-A136 CarbonylContact O-C 3.52Å; L118-A136 WeakPolarHBondContact O-CA 3.26Å; A136-Q138 PolarHBondContact O-N 3.13Å; A136-D139 HydrophobicContact CB-CB 4.29Å; A136-D139 WeakPolarHBondContact O-CB 3.15Å; A136-D139 PolarHBondContact O-N 2.91Å; A136-Y140 PolarHBondContact O-N 3.38Å
137	F	96.9	Very high	88.3	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.2	-39.4	179.5	179.4	-119.7	0	0	0	112	W52 L111 L112 Y115 G116 L118 V120 Y140 V141 F160 W169 I194	W52-F137 HydrophobicContact CH2-CZ 4.41Å; L111-F137 HydrophobicContact CB-CE1 3.68Å; L111-F137 HydrophobicContact CB-CZ 4.02Å; L111-F137 HydrophobicContact CD1-CZ 4.25Å; L112-F137 HydrophobicContact CD2-CD1 4.16Å; L112-F137 HydrophobicContact CD2-CE1 4.06Å; Y115-F137 WeakPolarHBondContact O-CB 3.38Å; G116-F137 PolarHBondContact O-N 2.91Å; L118-F137 PolarHBondContact O-N 2.85Å; V120-F137 HydrophobicContact CG1-CB 3.94Å; V120-F137 HydrophobicContact CG1-CD2 3.98Å; V120-F137 HydrophobicContact CG1-CG 4.32Å; V120-F137 HydrophobicContact CG2-CB 4.36Å; V120-F137 HydrophobicContact CG2-CD2 4.37Å; F137-Y140 HydrophobicContact CD2-CD1 4.5Å; F137-Y140 HydrophobicContact CE2-CD1 4.44Å; F137-Y140 WeakPolarHBondContact O-CB 3.36Å; F137-Y140 PolarHBondContact O-N 2.83Å; F137-V141 HydrophobicContact CD2-CG2 4.21Å; F137-V141 HydrophobicContact CE1-CG2 4.02Å; F137-V141 HydrophobicContact CE2-CG2 3.71Å; F137-V141 HydrophobicContact CZ-CG2 3.6Å; F137-V141 WeakPolarHBondContact O-CG2 3.41Å; F137-V141 PolarHBondContact O-N 2.93Å; F137-F160 HydrophobicContact CE2-CD1 4.27Å; F137-F160 HydrophobicContact CE2-CE1 4.37Å; F137-W169 HydrophobicContact CD2-CH2 4.35Å; F137-W169 HydrophobicContact CE2-CH2 4.42Å; F137-W169 HydrophobicContact CG-CH2 4.48Å; F137-I194 HydrophobicContact CE2-CD1 3.74Å; F137-I194 HydrophobicContact CZ-CD1 3.57Å
138	Q	97.3	Very high	89.2	Confident	98 Å²	98	69.8 Å²	69.8	46%	0.458	32%	0.324	S	S	.	.	H	α-helix	trans	-61.4	-44.9	175.1	-178	169.5	10.5	0	0	112.2	L112 G116 A136 Y140 V141 D142	L112-Q138 HydrophobicContact CD2-CB 4.19Å; L112-Q138 HydrophobicContact CD2-CG 4.31Å; G116-Q138 VanDerWaalsContact O-CB 3.3Å; G116-Q138 WeakPolarHBondContact O-CB 3.22Å; G116-Q138 PolarHBondContact O-N 3.35Å; A136-Q138 PolarHBondContact O-N 3.13Å; Q138-Y140 VanDerWaalsContact C-N 3.28Å; Q138-Y140 PolarHBondContact O-N 3.49Å; Q138-V141 PolarHBondContact O-N 2.84Å; Q138-D142 VanDerWaalsContact CG-OD2 3.3Å; Q138-D142 WeakPolarHBondContact CG-OD2 3.35Å; Q138-D142 PolarHBondContact NE2-OD2 3.02Å; Q138-D142 WeakPolarHBondContact O-CB 3.01Å; Q138-D142 PolarHBondContact O-N 2.82Å
139	D	96.5	Very high	90	Very high	76 Å²	76	69.8 Å²	69.8	41%	0.406	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-37.6	177.1	-77.1	-37.8	0	0	0	111.8	A136 R143	A136-D139 HydrophobicContact CB-CB 4.29Å; A136-D139 WeakPolarHBondContact O-CB 3.15Å; A136-D139 PolarHBondContact O-N 2.91Å; D139-R143 VanDerWaalsContact O-CB 3.29Å; D139-R143 WeakPolarHBondContact O-CB 3.33Å; D139-R143 PolarHBondContact O-N 2.79Å
140	Y	95.6	Very high	90.7	Very high	1 Å²	1	72.3 Å²	72.3	0%	0.004	35%	0.35	C	S	.	.	I	π-helix	trans	-59.7	-54	173.2	174.1	-116.6	0	0	0	111.1	L122 A136 F137 Q138 D142 L144 L145 F160 I194	L122-Y140 HydrophobicContact CD1-CD2 3.57Å; L122-Y140 HydrophobicContact CD1-CE2 4.13Å; L122-Y140 HydrophobicContact CD1-CG 4.37Å; L122-Y140 HydrophobicContact CD2-CD1 4.31Å; L122-Y140 HydrophobicContact CD2-CD2 3.51Å; L122-Y140 HydrophobicContact CD2-CE2 3.81Å; L122-Y140 HydrophobicContact CD2-CG 3.81Å; L122-Y140 HydrophobicContact CG-CD2 4.19Å; A136-Y140 PolarHBondContact O-N 3.38Å; F137-Y140 HydrophobicContact CD2-CD1 4.5Å; F137-Y140 HydrophobicContact CE2-CD1 4.44Å; F137-Y140 WeakPolarHBondContact O-CB 3.36Å; F137-Y140 PolarHBondContact O-N 2.83Å; Q138-Y140 VanDerWaalsContact C-N 3.28Å; Q138-Y140 PolarHBondContact O-N 3.49Å; Y140-D142 PolarHBondContact O-N 2.83Å; Y140-L144 HydrophobicContact CD2-CB 3.68Å; Y140-L144 HydrophobicContact CD2-CD1 4.29Å; Y140-L144 HydrophobicContact CE2-CB 4.1Å; Y140-L144 CarbonylContact O-C 3.56Å; Y140-L144 WeakPolarHBondContact O-CA 3.46Å; Y140-L144 PolarHBondContact O-N 2.89Å; Y140-L145 HydrophobicContact CE1-CB 4.38Å; Y140-L145 HydrophobicContact CE1-CD1 4.04Å; Y140-L145 PolarHBondContact O-N 2.81Å; Y140-L145 WeakPolarHBondContact OH-CD1 3.35Å; Y140-F160 HydrophobicContact CD1-CB 4.04Å; Y140-F160 HydrophobicContact CE1-CB 3.54Å; Y140-F160 PolarHBondContact OH-N 2.97Å; Y140-I194 HydrophobicContact CE1-CB 4.32Å; Y140-I194 PolarHBondContact OH-O 3.21Å
141	V	95.2	Very high	91.5	Very high	7 Å²	7	68.9 Å²	68.9	4%	0.042	35%	0.354	C	S	.	.	I	π-helix	trans	-63.9	-40.2	-176.7	172.7	0	0	0	0	112.3	W52 L112 F137 Q138 L145	W52-V141 HydrophobicContact CH2-CG2 4.44Å; W52-V141 HydrophobicContact CZ3-CG1 4.14Å; W52-V141 HydrophobicContact CZ3-CG2 4.3Å; L112-V141 HydrophobicContact CD1-CG1 4.13Å; L112-V141 HydrophobicContact CD2-CB 3.98Å; L112-V141 HydrophobicContact CD2-CG1 4.11Å; L112-V141 HydrophobicContact CD2-CG2 4.07Å; L112-V141 HydrophobicContact CG-CG1 4.43Å; F137-V141 HydrophobicContact CD2-CG2 4.21Å; F137-V141 HydrophobicContact CE1-CG2 4.02Å; F137-V141 HydrophobicContact CE2-CG2 3.71Å; F137-V141 HydrophobicContact CZ-CG2 3.6Å; F137-V141 WeakPolarHBondContact O-CG2 3.41Å; F137-V141 PolarHBondContact O-N 2.93Å; Q138-V141 PolarHBondContact O-N 2.84Å; V141-L145 HydrophobicContact CG1-CD2 4.37Å; V141-L145 HydrophobicContact CG2-CD2 4.45Å
142	D	93.8	Very high	91.8	Very high	83 Å²	83	62.4 Å²	62.4	44%	0.444	33%	0.334	S	S	.	.	I	π-helix	trans	-83.9	-25	-174	-70.3	-21.6	0	0	0	113.1	R108 Q138 Y140	R108-D142 IonicContact CZ-OD1 2.68Å; R108-D142 IonicContact NH2-OD1 3.07Å; R108-D142 PolarHBondContact NH2-OD1 2.78Å; Q138-D142 VanDerWaalsContact CG-OD2 3.3Å; Q138-D142 WeakPolarHBondContact CG-OD2 3.35Å; Q138-D142 PolarHBondContact NE2-OD2 3.02Å; Q138-D142 WeakPolarHBondContact O-CB 3.01Å; Q138-D142 PolarHBondContact O-N 2.82Å; Y140-D142 PolarHBondContact O-N 2.83Å
143	R	91.2	Very high	91.6	Very high	178 Å²	178	61.8 Å²	61.8	67%	0.672	34%	0.335	S	S	*	.	I	π-helix	trans	-125.1	-27.1	-168.5	-49.7	179.5	75.5	161.6	3	115	D139	D139-R143 VanDerWaalsContact O-CB 3.29Å; D139-R143 WeakPolarHBondContact O-CB 3.33Å; D139-R143 PolarHBondContact O-N 2.79Å
144	L	91.8	Very high	90.9	Very high	61 Å²	61	60.2 Å²	60.2	32%	0.319	33%	0.325	S	S	.	.	I	π-helix	trans	-116.1	-24.6	-171.1	-59.8	179	0	0	0	113.1	L122 V135 Y140 R146	L122-L144 HydrophobicContact CD1-CD1 3.66Å; V135-L144 HydrophobicContact CG1-CD1 4.43Å; Y140-L144 HydrophobicContact CD2-CB 3.68Å; Y140-L144 HydrophobicContact CD2-CD1 4.29Å; Y140-L144 HydrophobicContact CE2-CB 4.1Å; Y140-L144 CarbonylContact O-C 3.56Å; Y140-L144 WeakPolarHBondContact O-CA 3.46Å; Y140-L144 PolarHBondContact O-N 2.89Å; L144-R146 VanDerWaalsContact C-N 3.31Å; L144-R146 PolarHBondContact O-N 3.08Å
145	L	92.9	Very high	90	Very high	8 Å²	8	58.3 Å²	58.3	4%	0.042	32%	0.318	C	S	.	.			trans	-76.6	81	176.1	-174.2	67.6	0	0	0	110.5	W52 Q54 Y140 V141 I194 T307	W52-L145 HydrophobicContact CE3-CD2 4.13Å; W52-L145 HydrophobicContact CZ3-CD2 3.85Å; Q54-L145 PolarHBondContact NE2-O 2.98Å; Y140-L145 HydrophobicContact CE1-CB 4.38Å; Y140-L145 HydrophobicContact CE1-CD1 4.04Å; Y140-L145 PolarHBondContact O-N 2.81Å; Y140-L145 WeakPolarHBondContact OH-CD1 3.35Å; V141-L145 HydrophobicContact CG1-CD2 4.37Å; V141-L145 HydrophobicContact CG2-CD2 4.45Å; L145-I194 HydrophobicContact CD1-CG2 3.91Å; L145-I194 HydrophobicContact CD2-CG2 3.82Å; L145-T307 HydrophobicContact CD1-CG2 4.35Å; L145-T307 HydrophobicContact CD2-CG2 3.88Å; L145-T307 HydrophobicContact CG-CG2 4.27Å
146	R	90.4	Very high	89.3	Confident	167 Å²	167	63.1 Å²	63.1	63%	0.63	34%	0.339	S	S	*	.			trans	-136.7	163.8	-176.4	67.4	-170.9	-177.8	-171	3.1	111.3	L144	L144-R146 VanDerWaalsContact C-N 3.31Å; L144-R146 PolarHBondContact O-N 3.08Å
147	P	90.9	Very high	88.6	Confident	56 Å²	56	62.4 Å²	62.4	36%	0.364	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-55.2	141.3	173	-26	36.1	0	0	0	112	P197	P147-P197 CarbonylContact C-O 3.54Å; P147-P197 WeakPolarHBondContact CA-O 3.4Å; P147-P197 HydrophobicContact CB-CB 4.39Å; P147-P197 HydrophobicContact CG-CG 4.25Å
148	Q	89.1	Confident	88	Confident	22 Å²	22	64.1 Å²	64.1	10%	0.103	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-69.9	133.6	175.5	-163	-174	-86.9	0	0	110.3	T157 P197 G198 T199 T236 L238	Q148-T157 HydrophobicContact CG-CG2 4.22Å; Q148-T157 PolarHBondContact OE1-OG1 2.66Å; Q148-P197 PolarHBondContact N-O 2.85Å; Q148-G198 VanDerWaalsContact CD-O 3.29Å; Q148-G198 PolarHBondContact NE2-O 3.2Å; Q148-G198 PolarHBondContact OE1-O 2.71Å; Q148-T199 HydrophobicContact CB-CG2 3.95Å; Q148-T199 HydrophobicContact CG-CG2 4.45Å; Q148-T236 VanDerWaalsContact NE2-CB 3.33Å; Q148-T236 VanDerWaalsContact NE2-CG2 3.33Å; Q148-T236 PolarHBondContact NE2-OG1 2.67Å; Q148-L238 HydrophobicContact CB-CD2 4.45Å
149	D	87.7	Confident	87.5	Confident	108 Å²	108	59.7 Å²	59.7	58%	0.578	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-67.5	131.7	167	-172.4	-23.6	0	0	0	109.4	A151 A152	D149-A151 PolarHBondContact O-N 2.76Å; D149-A151 PolarHBondContact OD1-N 3.4Å; D149-A152 HydrophobicContact CB-CB 4.03Å; D149-A152 WeakPolarHBondContact O-CB 3.34Å; D149-A152 PolarHBondContact O-N 3.26Å; D149-A152 VanDerWaalsContact O-N 3.07Å
150	A	85.6	Confident	87.2	Confident	75 Å²	75	56.1 Å²	56.1	62%	0.62	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28	178.4	0	0	0	0	0	112.7
151	A	84.7	Confident	86.8	Confident	88 Å²	88	58.2 Å²	58.2	73%	0.727	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.5	177.7	0	0	0	0	0	113.7	D149	D149-A151 PolarHBondContact O-N 2.76Å; D149-A151 PolarHBondContact OD1-N 3.4Å
152	A	84.9	Confident	86.1	Confident	20 Å²	20	58.3 Å²	58.3	17%	0.165	31%	0.312	C	S	.	.			trans	-71.7	142.9	-176.6	0	0	0	0	0	112.4	D149 T236	D149-A152 HydrophobicContact CB-CB 4.03Å; D149-A152 WeakPolarHBondContact O-CB 3.34Å; D149-A152 PolarHBondContact O-N 3.26Å; D149-A152 VanDerWaalsContact O-N 3.07Å; A152-T236 WeakPolarHBondContact O-CG2 3.25Å
153	L	82.7	Confident	85.7	Confident	77 Å²	77	58.6 Å²	58.6	40%	0.403	31%	0.314	S	S	.	.			trans	-78.9	153.1	171.1	-63.6	177.3	0	0	0	111	S155 E156 T157	L153-S155 PolarHBondContact O-N 3.34Å; L153-E156 HydrophobicContact CB-CG 4.27Å; L153-E156 PolarHBondContact O-N 3.37Å; L153-T157 PolarHBondContact O-N 3.28Å; L153-T157 PolarHBondContact O-OG1 3.4Å
154	G	75.8	Confident	85.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.6	176.7	0	0	0	0	0	112.6	A125 N126 E156 N234 T236	A125-G154 CarbonylContact C-O 3.59Å; A125-G154 WeakPolarHBondContact CA-O 3.44Å; A125-G154 PolarHBondContact N-O 3.46Å; N126-G154 PolarHBondContact N-O 3.08Å; G154-E156 PolarHBondContact O-N 3.07Å; G154-N234 PolarHBondContact N-O 3.39Å; G154-N234 VanDerWaalsContact N-O 3.11Å; G154-T236 VanDerWaalsContact N-CG2 3.28Å
155	S	75.7	Confident	85.5	Confident	42 Å²	42	51.2 Å²	51.2	29%	0.294	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-12.7	173.4	50.6	0	0	0	0	114.4	T124 L153	T124-S155 WeakPolarHBondContact CG2-O 3.47Å; L153-S155 PolarHBondContact O-N 3.34Å
156	E	79.3	Confident	85.2	Confident	130 Å²	130	55.8 Å²	55.8	61%	0.607	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-18.1	-178.7	-63.2	174.6	176.5	0	0	112	L153 G154	L153-E156 HydrophobicContact CB-CG 4.27Å; L153-E156 PolarHBondContact O-N 3.37Å; G154-E156 PolarHBondContact O-N 3.07Å
157	T	82.3	Confident	85.2	Confident	13 Å²	13	53.1 Å²	53.1	8%	0.08	31%	0.314	C	S	.	.			trans	-81.8	118.3	174.1	-58.2	0	0	0	0	110.7	T124 A125 Q148 L153 T199	T124-T157 CarbonylContact C-O 3.58Å; T124-T157 VanDerWaalsContact CA-O 3.29Å; T124-T157 WeakPolarHBondContact CA-O 3.46Å; A125-T157 HydrophobicContact CB-CG2 3.83Å; A125-T157 PolarHBondContact N-O 2.99Å; Q148-T157 HydrophobicContact CG-CG2 4.22Å; Q148-T157 PolarHBondContact OE1-OG1 2.66Å; L153-T157 PolarHBondContact O-N 3.28Å; L153-T157 PolarHBondContact O-OG1 3.4Å; T157-T199 HydrophobicContact CG2-CG2 3.67Å
158	L	84.9	Confident	85.3	Confident	36 Å²	36	54.1 Å²	54.1	19%	0.188	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.2	173.2	-67.9	171.5	0	0	0	110.7	L122 S123 T124 V133	L122-L158 HydrophobicContact CB-CB 4.28Å; L122-L158 HydrophobicContact CB-CD2 4.32Å; L122-L158 HydrophobicContact CD1-CB 4.21Å; L122-L158 HydrophobicContact CD1-CD1 4.43Å; S123-L158 WeakPolarHBondContact O-CA 3.42Å; T124-L158 HydrophobicContact CG2-CD2 3.95Å; V133-L158 HydrophobicContact CB-CD1 4.31Å; V133-L158 HydrophobicContact CG2-CD1 4.04Å; V133-L158 HydrophobicContact CG2-CD2 4.01Å
159	Y	86.3	Confident	85.5	Confident	6 Å²	6	53.1 Å²	53.1	2%	0.024	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	157.6	171.3	75.9	-64.4	0	0	0	111.4	S123 A125 F161 A195 V201 F310	S123-Y159 PolarHBondContact N-O 2.86Å; S123-Y159 PolarHBondContact O-N 3.22Å; S123-Y159 VanDerWaalsContact O-N 3.07Å; A125-Y159 HydrophobicContact CB-CD1 3.84Å; A125-Y159 HydrophobicContact CB-CE1 3.87Å; Y159-F161 HydrophobicContact CD2-CB 3.81Å; Y159-F161 HydrophobicContact CE2-CB 3.22Å; Y159-F161 HydrophobicContact CE2-CD1 4.17Å; Y159-F161 AromaticContact CE2-CG 3.84Å; Y159-F161 HydrophobicContact CE2-CG 3.84Å; Y159-F161 VanDerWaalsContact OH-CD1 3.25Å; Y159-F161 WeakPolarHBondContact OH-CD1 3.33Å; Y159-A195 HydrophobicContact CD2-CB 3.85Å; Y159-A195 HydrophobicContact CG-CB 4.42Å; Y159-V201 HydrophobicContact CE1-CG2 4.35Å; Y159-V201 WeakPolarHBondContact OH-CG2 3.35Å; Y159-F310 HydrophobicContact CE2-CZ 4.41Å
160	F	91.4	Very high	85.8	Confident	1 Å²	1	52.7 Å²	52.7	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	108.8	-178.3	177.6	-140.8	0	0	0	109.6	V120 L122 F137 Y140 N164 W169 F192 G193 I194	V120-F160 HydrophobicContact CB-CD2 3.99Å; V120-F160 HydrophobicContact CB-CE2 3.8Å; V120-F160 HydrophobicContact CB-CZ 4.14Å; V120-F160 HydrophobicContact CG1-CD2 4.42Å; V120-F160 HydrophobicContact CG1-CE1 4.1Å; V120-F160 HydrophobicContact CG1-CE2 3.9Å; V120-F160 HydrophobicContact CG1-CZ 3.7Å; L122-F160 HydrophobicContact CD2-CB 3.71Å; L122-F160 HydrophobicContact CD2-CG 4.48Å; F137-F160 HydrophobicContact CE2-CD1 4.27Å; F137-F160 HydrophobicContact CE2-CE1 4.37Å; Y140-F160 HydrophobicContact CD1-CB 4.04Å; Y140-F160 HydrophobicContact CE1-CB 3.54Å; Y140-F160 PolarHBondContact OH-N 2.97Å; F160-N164 WeakPolarHBondContact CE2-ND2 3.42Å; F160-N164 WeakPolarHBondContact CZ-ND2 3.25Å; F160-W169 AromaticContact CE1-CH2 3.89Å; F160-W169 HydrophobicContact CE1-CH2 3.89Å; F160-W169 HydrophobicContact CE1-CZ2 4.12Å; F160-W169 HydrophobicContact CE1-CZ3 4.41Å; F160-W169 HydrophobicContact CZ-CH2 4.14Å; F160-W169 AromaticContact CZ-CZ2 3.95Å; F160-W169 HydrophobicContact CZ-CZ2 3.95Å; F160-F192 HydrophobicContact CE1-CD1 4.07Å; F160-F192 HydrophobicContact CE1-CE1 4.35Å; F160-G193 CarbonylContact O-C 3.53Å; F160-G193 WeakPolarHBondContact O-CA 3.48Å; F160-I194 HydrophobicContact CD1-CB 4.5Å; F160-I194 HydrophobicContact CD1-CG1 4.34Å; F160-I194 PolarHBondContact N-O 2.85Å; F160-I194 PolarHBondContact O-N 2.83Å; F160-I194 VanDerWaalsContact O-O 3.12Å
161	F	85.8	Confident	86.2	Confident	44 Å²	44	53.8 Å²	53.8	19%	0.193	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	121.6	177.9	174.4	-118.1	0	0	0	110.9	Y159 S191 F310 F314	Y159-F161 HydrophobicContact CD2-CB 3.81Å; Y159-F161 HydrophobicContact CE2-CB 3.22Å; Y159-F161 HydrophobicContact CE2-CD1 4.17Å; Y159-F161 AromaticContact CE2-CG 3.84Å; Y159-F161 HydrophobicContact CE2-CG 3.84Å; Y159-F161 VanDerWaalsContact OH-CD1 3.25Å; Y159-F161 WeakPolarHBondContact OH-CD1 3.33Å; F161-S191 WeakPolarHBondContact CD2-OG 3.49Å; F161-S191 VanDerWaalsContact CE2-OG 3.23Å; F161-S191 WeakPolarHBondContact CE2-OG 3.46Å; F161-F310 HydrophobicContact CB-CZ 4.39Å; F161-F310 HydrophobicContact CD2-CD2 4.3Å; F161-F310 AromaticContact CD2-CE2 3.27Å; F161-F310 HydrophobicContact CD2-CE2 3.27Å; F161-F310 AromaticContact CD2-CZ 3.86Å; F161-F310 HydrophobicContact CD2-CZ 3.86Å; F161-F310 HydrophobicContact CE2-CD2 4.32Å; F161-F310 AromaticContact CE2-CE2 3.57Å; F161-F310 HydrophobicContact CE2-CE2 3.57Å; F161-F310 HydrophobicContact CG-CE2 4.19Å; F161-F310 HydrophobicContact CG-CZ 4.4Å; F161-F314 HydrophobicContact CZ-CZ 4.1Å
162	G	81.9	Confident	86.7	Confident	10 Å²	10	49.8 Å²	49.8	10%	0.103	27%	0.266	C	S	.	.	S	Bend	trans	66	-165.8	-178.4	0	0	0	0	0	112.4	N164 S191 F192	G162-N164 PolarHBondContact O-N 3.01Å; G162-S191 WeakPolarHBondContact CA-OG 3.07Å; G162-S191 PolarHBondContact N-OG 3.37Å; G162-S191 VanDerWaalsContact N-OG 3.08Å; G162-F192 PolarHBondContact N-O 2.86Å
163	D	83.9	Confident	87.2	Confident	89 Å²	89	49.2 Å²	49.2	48%	0.476	26%	0.26	S	S	.	.			trans	48	29	-170.5	-66.2	-34.4	0	0	0	112.6	R121 K132 N165	R121-D163 HydrophobicContact CB-CB 4.11Å; R121-D163 HydrophobicContact CG-CB 4.18Å; K132-D163 WeakPolarHBondContact CE-OD2 3.23Å; K132-D163 IonicContact NZ-OD2 3.29Å; K132-D163 PolarHBondContact NZ-OD2 2.79Å; D163-N165 PolarHBondContact O-N 3.47Å
164	N	89.1	Confident	87.8	Confident	15 Å²	15	50.5 Å²	50.5	8%	0.08	27%	0.267	C	S	.	.			trans	-65.1	132.9	179.6	-50.1	118.1	0	0	0	108.1	F160 G162 L166 F192	F160-N164 WeakPolarHBondContact CE2-ND2 3.42Å; F160-N164 WeakPolarHBondContact CZ-ND2 3.25Å; G162-N164 PolarHBondContact O-N 3.01Å; N164-L166 VanDerWaalsContact C-N 3.34Å; N164-L166 PolarHBondContact O-N 3.15Å; N164-F192 PolarHBondContact ND2-O 2.98Å; N164-F192 PolarHBondContact OD1-N 3.45Å; N164-F192 PolarHBondContact OD1-O 3Å
165	N	89.4	Confident	88.8	Confident	68 Å²	68	55.7 Å²	55.7	36%	0.364	29%	0.287	S	S	.	.			trans	-68.2	96.9	169.6	-177.9	-19.3	0	0	0	108.5	D163 T167 E168 W169	D163-N165 PolarHBondContact O-N 3.47Å; N165-T167 PolarHBondContact O-N 2.78Å; N165-T167 PolarHBondContact OD1-N 3.23Å; N165-E168 HydrophobicContact CB-CB 4.14Å; N165-E168 HydrophobicContact CB-CG 4.37Å; N165-E168 WeakPolarHBondContact ND2-CG 3.35Å; N165-E168 PolarHBondContact ND2-OE2 2.87Å; N165-E168 PolarHBondContact O-N 3.26Å; N165-E168 PolarHBondContact OD1-N 3.23Å; N165-W169 WeakPolarHBondContact O-CB 3.45Å; N165-W169 VanDerWaalsContact O-CD1 3.29Å; N165-W169 PolarHBondContact O-N 3.01Å
166	L	87.5	Confident	89.8	Confident	104 Å²	104	54.2 Å²	54.2	55%	0.545	28%	0.275	S	S	.	.	H	α-helix	trans	-58.5	-25.8	-172.4	-61.8	-178	0	0	0	112.9	N164 Q170 L173	N164-L166 VanDerWaalsContact C-N 3.34Å; N164-L166 PolarHBondContact O-N 3.15Å; L166-Q170 WeakPolarHBondContact O-CA 3.18Å; L166-Q170 WeakPolarHBondContact O-CB 3.24Å; L166-Q170 PolarHBondContact O-N 3.38Å; L166-L173 HydrophobicContact CD2-CD1 3.72Å
167	T	90.9	Very high	90.5	Very high	111 Å²	111	53.3 Å²	53.3	68%	0.681	27%	0.27	S	S	*	.	H	α-helix	trans	-73.3	-48.2	176.6	-53.1	0	0	0	0	111.1	N165	N165-T167 PolarHBondContact O-N 2.78Å; N165-T167 PolarHBondContact OD1-N 3.23Å
168	E	93.1	Very high	91.1	Very high	78 Å²	78	54.1 Å²	54.1	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-70.9	-34.8	-178.4	-70.9	179	157.9	0	0	112.3	L118 N165	L118-E168 HydrophobicContact CD1-CB 4.08Å; N165-E168 HydrophobicContact CB-CB 4.14Å; N165-E168 HydrophobicContact CB-CG 4.37Å; N165-E168 WeakPolarHBondContact ND2-CG 3.35Å; N165-E168 PolarHBondContact ND2-OE2 2.87Å; N165-E168 PolarHBondContact O-N 3.26Å; N165-E168 PolarHBondContact OD1-N 3.23Å
169	W	93.4	Very high	91.6	Very high	1 Å²	1	52.9 Å²	52.9	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-92.8	-3.8	-177.6	-68.9	77.5	0	0	0	113.4	Y115 V120 F137 F160 N165 N171 L172 L173 F192	Y115-W169 HydrophobicContact CD1-CD2 4.24Å; Y115-W169 HydrophobicContact CD1-CE3 4.19Å; Y115-W169 HydrophobicContact CD1-CH2 4.43Å; Y115-W169 HydrophobicContact CD1-CZ2 4.46Å; Y115-W169 HydrophobicContact CD1-CZ3 4.3Å; Y115-W169 HydrophobicContact CD2-CZ3 4.37Å; Y115-W169 HydrophobicContact CE1-CE3 4.4Å; Y115-W169 HydrophobicContact CG-CE3 4.44Å; Y115-W169 HydrophobicContact CG-CH2 4.1Å; Y115-W169 HydrophobicContact CG-CZ2 4.44Å; Y115-W169 HydrophobicContact CG-CZ3 4.1Å; V120-W169 HydrophobicContact CG1-CH2 4.43Å; V120-W169 HydrophobicContact CG1-CZ2 3.55Å; F137-W169 HydrophobicContact CD2-CH2 4.35Å; F137-W169 HydrophobicContact CE2-CH2 4.42Å; F137-W169 HydrophobicContact CG-CH2 4.48Å; F160-W169 AromaticContact CE1-CH2 3.89Å; F160-W169 HydrophobicContact CE1-CH2 3.89Å; F160-W169 HydrophobicContact CE1-CZ2 4.12Å; F160-W169 HydrophobicContact CE1-CZ3 4.41Å; F160-W169 HydrophobicContact CZ-CH2 4.14Å; F160-W169 AromaticContact CZ-CZ2 3.95Å; F160-W169 HydrophobicContact CZ-CZ2 3.95Å; N165-W169 WeakPolarHBondContact O-CB 3.45Å; N165-W169 VanDerWaalsContact O-CD1 3.29Å; N165-W169 PolarHBondContact O-N 3.01Å; W169-N171 VanDerWaalsContact C-N 3.28Å; W169-N171 PolarHBondContact O-N 3.02Å; W169-N171 VanDerWaalsContact O-N 3.16Å; W169-L172 HydrophobicContact CE3-CD2 3.91Å; W169-L172 HydrophobicContact CZ3-CD2 3.99Å; W169-L172 PolarHBondContact O-N 2.87Å; W169-L173 HydrophobicContact CB-CD1 4.11Å; W169-L173 HydrophobicContact CB-CG 4.33Å; W169-L173 WeakPolarHBondContact O-CG 3.48Å; W169-L173 PolarHBondContact O-N 2.76Å; W169-F192 HydrophobicContact CE3-CD1 4.27Å; W169-F192 AromaticContact CZ3-CD1 3.98Å; W169-F192 HydrophobicContact CZ3-CD1 3.98Å; W169-F192 AromaticContact CZ3-CE1 3.88Å; W169-F192 HydrophobicContact CZ3-CE1 3.88Å
170	Q	93.3	Very high	92	Very high	99 Å²	99	56.6 Å²	56.6	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-49.6	-46.9	-175.9	-171.9	143.6	41.2	0	0	112.7	L166 L172 L173 D174	L166-Q170 WeakPolarHBondContact O-CA 3.18Å; L166-Q170 WeakPolarHBondContact O-CB 3.24Å; L166-Q170 PolarHBondContact O-N 3.38Å; Q170-L172 PolarHBondContact O-N 3.27Å; Q170-L172 VanDerWaalsContact O-N 3.1Å; Q170-L173 PolarHBondContact O-N 2.97Å; Q170-L173 VanDerWaalsContact O-N 3.12Å; Q170-D174 WeakPolarHBondContact CG-OD2 3.1Å; Q170-D174 WeakPolarHBondContact O-CB 3.38Å; Q170-D174 VanDerWaalsContact O-CG 3.26Å; Q170-D174 PolarHBondContact O-N 3.28Å
171	N	93.9	Very high	92.3	Very high	98 Å²	98	57.1 Å²	57.1	52%	0.524	30%	0.3	S	S	.	.	H	α-helix	trans	-59.6	-26.7	-177.8	-78.3	-50.4	0	0	0	114.4	W169 R175	W169-N171 VanDerWaalsContact C-N 3.28Å; W169-N171 PolarHBondContact O-N 3.02Å; W169-N171 VanDerWaalsContact O-N 3.16Å; N171-R175 VanDerWaalsContact O-CG 3.31Å; N171-R175 WeakPolarHBondContact O-CG 3.45Å
172	L	95.5	Very high	92.8	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-84.9	-49.7	173.5	-178.3	64.6	0	0	0	109.9	F102 L105 L111 Y115 W169 Q170 D174 R175 F192	F102-L172 HydrophobicContact CD2-CD1 4.22Å; F102-L172 HydrophobicContact CE2-CD1 3.89Å; F102-L172 HydrophobicContact CE2-CG 3.86Å; F102-L172 WeakPolarHBondContact CE2-O 3.39Å; L105-L172 HydrophobicContact CB-CD1 3.86Å; L111-L172 HydrophobicContact CD2-CD1 4.43Å; L111-L172 HydrophobicContact CD2-CD2 3.77Å; Y115-L172 HydrophobicContact CE2-CB 4.36Å; Y115-L172 HydrophobicContact CE2-CD2 4.48Å; Y115-L172 WeakPolarHBondContact OH-CB 3.36Å; Y115-L172 PolarHBondContact OH-N 3.06Å; W169-L172 HydrophobicContact CE3-CD2 3.91Å; W169-L172 HydrophobicContact CZ3-CD2 3.99Å; W169-L172 PolarHBondContact O-N 2.87Å; Q170-L172 PolarHBondContact O-N 3.27Å; Q170-L172 VanDerWaalsContact O-N 3.1Å; L172-D174 VanDerWaalsContact C-N 3.32Å; L172-D174 PolarHBondContact O-N 2.97Å; L172-R175 VanDerWaalsContact O-CB 3.31Å; L172-R175 WeakPolarHBondContact O-CB 3.47Å; L172-R175 PolarHBondContact O-N 2.98Å; L172-F192 HydrophobicContact CD2-CE1 4.22Å; L172-F192 HydrophobicContact CD2-CE2 4.32Å; L172-F192 HydrophobicContact CD2-CZ 4.11Å
173	L	95.1	Very high	93.5	Very high	8 Å²	8	60.5 Å²	60.5	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-37.1	-175.1	-64.2	177.6	0	0	0	112.6	L166 W169 Q170 R175 Y176 Y190 F192 I311	L166-L173 HydrophobicContact CD2-CD1 3.72Å; W169-L173 HydrophobicContact CB-CD1 4.11Å; W169-L173 HydrophobicContact CB-CG 4.33Å; W169-L173 WeakPolarHBondContact O-CG 3.48Å; W169-L173 PolarHBondContact O-N 2.76Å; Q170-L173 PolarHBondContact O-N 2.97Å; Q170-L173 VanDerWaalsContact O-N 3.12Å; L173-R175 PolarHBondContact O-N 2.86Å; L173-R175 VanDerWaalsContact O-N 3.09Å; L173-Y176 WeakPolarHBondContact O-CB 3.47Å; L173-Y176 PolarHBondContact O-N 3.33Å; L173-Y176 VanDerWaalsContact O-N 3.08Å; L173-Y190 HydrophobicContact CB-CD2 4.24Å; L173-F192 HydrophobicContact CD2-CB 4.02Å; L173-I311 HydrophobicContact CD2-CD1 4.09Å
174	D	95.4	Very high	94	Very high	105 Å²	105	60.4 Å²	60.4	56%	0.561	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-10.8	176.2	-70.5	-8	0	0	0	113.3	Q170 L172	Q170-D174 WeakPolarHBondContact CG-OD2 3.1Å; Q170-D174 WeakPolarHBondContact O-CB 3.38Å; Q170-D174 VanDerWaalsContact O-CG 3.26Å; Q170-D174 PolarHBondContact O-N 3.28Å; L172-D174 VanDerWaalsContact C-N 3.32Å; L172-D174 PolarHBondContact O-N 2.97Å
175	R	96.5	Very high	94.2	Very high	109 Å²	109	64 Å²	64	41%	0.411	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-13.2	176.6	-53.3	-59.6	-176.8	153.3	-2.9	112.8	F102 L105 N171 L172 L173	F102-R175 HydrophobicContact CD2-CB 4.09Å; L105-R175 HydrophobicContact CD1-CB 4.04Å; L105-R175 HydrophobicContact CD1-CG 3.81Å; N171-R175 VanDerWaalsContact O-CG 3.31Å; N171-R175 WeakPolarHBondContact O-CG 3.45Å; L172-R175 VanDerWaalsContact O-CB 3.31Å; L172-R175 WeakPolarHBondContact O-CB 3.47Å; L172-R175 PolarHBondContact O-N 2.98Å; L173-R175 PolarHBondContact O-N 2.86Å; L173-R175 VanDerWaalsContact O-N 3.09Å
176	Y	96.3	Very high	94.4	Very high	11 Å²	11	65.1 Å²	65.1	4%	0.043	36%	0.356	C	S	.	.			trans	-76.7	128.1	178.2	-179.3	-115.6	0	0	0	110.3	N99 F102 L173 A178 Y190 E212 I311	N99-Y176 WeakPolarHBondContact ND2-CE2 3.23Å; F102-Y176 AromaticContact CD1-CD2 3.75Å; F102-Y176 HydrophobicContact CD1-CD2 3.75Å; F102-Y176 AromaticContact CE1-CD2 3.68Å; F102-Y176 HydrophobicContact CE1-CD2 3.68Å; F102-Y176 HydrophobicContact CE1-CE2 4.43Å; F102-Y176 HydrophobicContact CE1-CG 4.39Å; F102-Y176 HydrophobicContact CG-CD2 4.2Å; F102-Y176 HydrophobicContact CZ-CD2 4.1Å; F102-Y176 HydrophobicContact CZ-CG 4.35Å; L173-Y176 WeakPolarHBondContact O-CB 3.47Å; L173-Y176 PolarHBondContact O-N 3.33Å; L173-Y176 VanDerWaalsContact O-N 3.08Å; Y176-A178 HydrophobicContact CD1-CB 4.33Å; Y176-A178 HydrophobicContact CE1-CB 3.92Å; Y176-Y190 HydrophobicContact CD1-CD1 4.26Å; Y176-Y190 AromaticContact CD1-CE1 3.86Å; Y176-Y190 HydrophobicContact CD1-CE1 3.86Å; Y176-Y190 AromaticContact CD1-CZ 4Å; Y176-Y190 HydrophobicContact CE1-CD1 4.5Å; Y176-Y190 HydrophobicContact CE1-CE1 4.13Å; Y176-E212 WeakPolarHBondContact CE2-OE2 3.42Å; Y176-E212 PolarHBondContact OH-OE2 3.29Å; Y176-I311 HydrophobicContact CD1-CD1 3.73Å; Y176-I311 HydrophobicContact CD1-CG1 4.44Å; Y176-I311 HydrophobicContact CD1-CG2 4.49Å; Y176-I311 HydrophobicContact CD2-CD1 4.21Å; Y176-I311 HydrophobicContact CD2-CG2 3.86Å; Y176-I311 HydrophobicContact CE1-CD1 4.19Å; Y176-I311 HydrophobicContact CE1-CG1 4.41Å; Y176-I311 HydrophobicContact CE1-CG2 4.06Å; Y176-I311 HydrophobicContact CE2-CG2 3.36Å; Y176-I311 HydrophobicContact CG-CD1 3.75Å; Y176-I311 HydrophobicContact CG-CG2 4.4Å; Y176-I311 VanDerWaalsContact CZ-CG2 3.49Å
177	Q	95.2	Very high	94.6	Very high	110 Å²	110	64 Å²	64	51%	0.514	36%	0.357	S	S	.	.			trans	-93.8	107.3	169.3	-63.4	-176.5	60.2	0	0	108.2	T97 D98 N99	T97-Q177 HydrophobicContact CG2-CB 4.4Å; T97-Q177 VanDerWaalsContact CG2-O 3.23Å; T97-Q177 WeakPolarHBondContact CG2-O 3.3Å; D98-Q177 PolarHBondContact O-NE2 2.93Å; N99-Q177 PolarHBondContact ND2-O 3.38Å; N99-Q177 WeakPolarHBondContact OD1-CB 3.23Å; N99-Q177 PolarHBondContact OD1-N 2.84Å
178	A	95.1	Very high	94.7	Very high	30 Å²	30	61.7 Å²	61.7	25%	0.248	35%	0.349	C	S	.	.			trans	-70.7	154.8	175	0	0	0	0	0	111.3	T97 Y176 Y190	T97-A178 WeakPolarHBondContact CG2-O 3.28Å; Y176-A178 HydrophobicContact CD1-CB 4.33Å; Y176-A178 HydrophobicContact CE1-CB 3.92Å; A178-Y190 HydrophobicContact CB-CE1 4.02Å
179	P	94.9	Very high	94.7	Very high	10 Å²	10	60.5 Å²	60.5	7%	0.065	35%	0.353	C	S	.	.			trans	-52.7	140.9	171.6	-24.7	33.7	0	0	0	111.3	V96 Y181 F210 V291	V96-P179 HydrophobicContact CG1-CB 4.32Å; P179-Y181 HydrophobicContact CB-CD2 4.15Å; P179-Y181 PolarHBondContact O-N 2.84Å; P179-F210 HydrophobicContact CB-CD1 4.1Å; P179-F210 HydrophobicContact CB-CD2 4.36Å; P179-F210 HydrophobicContact CB-CE1 4.19Å; P179-F210 HydrophobicContact CB-CE2 4.44Å; P179-F210 HydrophobicContact CB-CG 4.21Å; P179-F210 HydrophobicContact CB-CZ 4.41Å; P179-F210 HydrophobicContact CG-CB 3.98Å; P179-F210 HydrophobicContact CG-CD1 3.91Å; P179-F210 HydrophobicContact CG-CD2 4.23Å; P179-F210 HydrophobicContact CG-CE1 4.5Å; P179-F210 HydrophobicContact CG-CG 3.77Å; P179-V291 HydrophobicContact CG-CB 4.44Å; P179-V291 HydrophobicContact CG-CG1 3.69Å; P179-V291 HydrophobicContact CG-CG2 4.29Å
180	P	95.3	Very high	94.8	Very high	84 Å²	84	64 Å²	64	55%	0.545	37%	0.366	S	S	.	.	S	Bend	trans	-75.1	7.3	-172.5	33.4	-37.6	0	0	0	113.8	V96	V96-P180 HydrophobicContact CG2-CG 3.77Å
181	Y	97.2	Very high	94.9	Very high	13 Å²	13	59.5 Å²	59.5	5%	0.051	35%	0.346	C	S	.	.			trans	-92.9	136.4	-177.5	-55.4	-68.1	0	0	0	111	L76 Q78 F81 I93 V96 P179 F210	L76-Y181 WeakPolarHBondContact CB-OH 3.33Å; L76-Y181 HydrophobicContact CD2-CE1 4.21Å; L76-Y181 HydrophobicContact CD2-CE2 4.27Å; L76-Y181 HydrophobicContact CG-CE1 4.04Å; L76-Y181 VanDerWaalsContact O-CE1 3.26Å; L76-Y181 WeakPolarHBondContact O-CE1 3.38Å; L76-Y181 PolarHBondContact O-OH 3.4Å; Q78-Y181 VanDerWaalsContact OE1-CA 3.27Å; F81-Y181 HydrophobicContact CB-CD1 3.74Å; F81-Y181 HydrophobicContact CB-CE1 4.09Å; F81-Y181 HydrophobicContact CB-CG 4.4Å; F81-Y181 HydrophobicContact CD1-CD1 4.17Å; F81-Y181 HydrophobicContact CD1-CG 4.19Å; F81-Y181 HydrophobicContact CD2-CD1 4.41Å; F81-Y181 HydrophobicContact CD2-CG 4.25Å; F81-Y181 AromaticContact CG-CD1 3.84Å; F81-Y181 HydrophobicContact CG-CD1 3.84Å; F81-Y181 HydrophobicContact CG-CG 4.01Å; I93-Y181 HydrophobicContact CD1-CD2 3.88Å; I93-Y181 HydrophobicContact CD1-CE2 3.49Å; I93-Y181 VanDerWaalsContact CD1-CE2 3.49Å; I93-Y181 HydrophobicContact CG2-CE2 4.19Å; V96-Y181 HydrophobicContact CG2-CE2 3.71Å; P179-Y181 HydrophobicContact CB-CD2 4.15Å; P179-Y181 PolarHBondContact O-N 2.84Å; Y181-F210 HydrophobicContact CD2-CE1 4.16Å; Y181-F210 HydrophobicContact CD2-CZ 4.17Å; Y181-F210 HydrophobicContact CG-CZ 4.36Å
182	F	95.6	Very high	95	Very high	120 Å²	120	54.9 Å²	54.9	53%	0.526	32%	0.321	S	S	.	.			trans	-132.9	159.3	-178.2	64.7	-87.8	0	0	0	112.1	Q78	Q78-F182 HydrophobicContact CG-CD1 4.42Å; Q78-F182 HydrophobicContact CG-CE1 3.86Å; Q78-F182 HydrophobicContact CG-CZ 4.19Å; Q78-F182 PolarHBondContact NE2-O 3.03Å
183	L	96.5	Very high	95	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	32%	0.32	C	S	.	.			trans	-105.7	132.7	170.6	-62.1	178.9	0	0	0	109.2	F81 L82 A86 F87 G185 R186 P208 L315	F81-L183 HydrophobicContact CE1-CD2 4.08Å; L82-L183 HydrophobicContact CD2-CD2 3.91Å; A86-L183 HydrophobicContact CB-CD2 3.63Å; F87-L183 HydrophobicContact CE1-CD2 4.26Å; F87-L183 HydrophobicContact CZ-CD2 3.98Å; L183-G185 PolarHBondContact O-N 3.07Å; L183-R186 HydrophobicContact CB-CB 4.16Å; L183-R186 HydrophobicContact CB-CG 4.05Å; L183-R186 PolarHBondContact O-N 2.99Å; L183-P208 HydrophobicContact CD1-CB 4.03Å; L183-P208 HydrophobicContact CD1-CG 3.4Å; L183-P208 VanDerWaalsContact CD1-CG 3.4Å; L183-L315 HydrophobicContact CD1-CB 4.05Å; L183-L315 HydrophobicContact CD1-CD1 3.8Å; L183-L315 HydrophobicContact CG-CD1 3.76Å
184	P	94.4	Very high	95	Very high	87 Å²	87	54.3 Å²	54.3	57%	0.565	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	130.9	178.2	-26.8	34.9	0	0	0	112.2	R186	P184-R186 VanDerWaalsContact C-N 3.28Å; P184-R186 PolarHBondContact O-N 2.65Å
185	G	93.6	Very high	95	Very high	91 Å²	91	49.3 Å²	49.3	94%	0.938	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	9.4	177	0	0	0	0	0	115.5	L183	L183-G185 PolarHBondContact O-N 3.07Å
186	R	93.5	Very high	94.8	Very high	92 Å²	92	44.2 Å²	44.2	35%	0.347	27%	0.273	S	S	.	.			trans	-113.8	156.6	177.9	-57.8	-157.2	-176.3	-150.3	-0.3	112.2	L183 P184 L315 G316	L183-R186 HydrophobicContact CB-CB 4.16Å; L183-R186 HydrophobicContact CB-CG 4.05Å; L183-R186 PolarHBondContact O-N 2.99Å; P184-R186 VanDerWaalsContact C-N 3.28Å; P184-R186 PolarHBondContact O-N 2.65Å; R186-L315 WeakPolarHBondContact CD-O 3.37Å; R186-L315 PolarHBondContact NH1-O 3.48Å; R186-G316 CarbonylContact C-O 3.55Å; R186-G316 WeakPolarHBondContact CA-O 3.45Å
187	S	92.5	Very high	94.7	Very high	80 Å²	80	43.9 Å²	43.9	56%	0.559	27%	0.272	S	S	*	.			trans	-113.2	152.8	178	62.1	0	0	0	0	111.1	L315 G316	S187-L315 CarbonylContact O-C 3.57Å; S187-L315 WeakPolarHBondContact O-CA 3.48Å; S187-G316 PolarHBondContact N-O 3.18Å; S187-G316 PolarHBondContact O-N 3.5Å; S187-G316 PolarHBondContact OG-O 3.36Å; S187-G316 VanDerWaalsContact OG-O 3.1Å
188	A	93.3	Very high	94.6	Very high	62 Å²	62	38.8 Å²	38.8	51%	0.512	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.7	176.6	0	0	0	0	0	110.6	T313 F314 L315	A188-T313 HydrophobicContact CB-CG2 3.7Å; A188-F314 CarbonylContact C-O 3.59Å; A188-F314 WeakPolarHBondContact CA-O 3.25Å; A188-L315 HydrophobicContact CB-CD2 4.43Å
189	A	93.3	Very high	94.5	Very high	54 Å²	54	37.6 Å²	37.6	45%	0.446	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.1	170.6	0	0	0	0	0	110.3	T313 F314	A189-T313 CarbonylContact O-C 3.59Å; A189-T313 WeakPolarHBondContact O-CA 3.19Å; A189-F314 PolarHBondContact N-O 3.13Å; A189-F314 PolarHBondContact O-N 2.74Å
190	Y	94.8	Very high	94.4	Very high	74 Å²	74	37.1 Å²	37.1	29%	0.29	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	143.8	-178.5	-60	-37.9	0	0	0	112.6	L173 Y176 A178 I311 S312 T313	L173-Y190 HydrophobicContact CB-CD2 4.24Å; Y176-Y190 HydrophobicContact CD1-CD1 4.26Å; Y176-Y190 AromaticContact CD1-CE1 3.86Å; Y176-Y190 HydrophobicContact CD1-CE1 3.86Å; Y176-Y190 AromaticContact CD1-CZ 4Å; Y176-Y190 HydrophobicContact CE1-CD1 4.5Å; Y176-Y190 HydrophobicContact CE1-CE1 4.13Å; A178-Y190 HydrophobicContact CB-CE1 4.02Å; Y190-I311 HydrophobicContact CG-CD1 4.47Å; Y190-S312 CarbonylContact C-O 3.59Å; Y190-S312 WeakPolarHBondContact CA-O 3.25Å; Y190-T313 HydrophobicContact CD1-CG2 4.12Å; Y190-T313 HydrophobicContact CE1-CG2 3.88Å; Y190-T313 WeakPolarHBondContact CE1-OG1 3.47Å
191	S	94.1	Very high	94.3	Very high	5 Å²	5	33.5 Å²	33.5	4%	0.035	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	106.2	168.4	177	0	0	0	0	108.6	F161 G162 I311 S312	F161-S191 WeakPolarHBondContact CD2-OG 3.49Å; F161-S191 VanDerWaalsContact CE2-OG 3.23Å; F161-S191 WeakPolarHBondContact CE2-OG 3.46Å; G162-S191 WeakPolarHBondContact CA-OG 3.07Å; G162-S191 PolarHBondContact N-OG 3.37Å; G162-S191 VanDerWaalsContact N-OG 3.08Å; S191-I311 CarbonylContact O-C 3.54Å; S191-I311 WeakPolarHBondContact O-CA 3.44Å; S191-S312 PolarHBondContact N-O 3.21Å; S191-S312 PolarHBondContact O-N 2.61Å
192	F	96	Very high	94.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	143	175.4	-179.6	-99.7	0	0	0	109.9	F102 L111 F160 G162 N164 W169 L172 L173 I194 V309 I311	F102-F192 HydrophobicContact CZ-CD2 4.21Å; F102-F192 HydrophobicContact CZ-CE2 4.21Å; L111-F192 HydrophobicContact CD1-CE1 4.19Å; L111-F192 HydrophobicContact CD1-CZ 3.88Å; F160-F192 HydrophobicContact CE1-CD1 4.07Å; F160-F192 HydrophobicContact CE1-CE1 4.35Å; G162-F192 PolarHBondContact N-O 2.86Å; N164-F192 PolarHBondContact ND2-O 2.98Å; N164-F192 PolarHBondContact OD1-N 3.45Å; N164-F192 PolarHBondContact OD1-O 3Å; W169-F192 HydrophobicContact CE3-CD1 4.27Å; W169-F192 AromaticContact CZ3-CD1 3.98Å; W169-F192 HydrophobicContact CZ3-CD1 3.98Å; W169-F192 AromaticContact CZ3-CE1 3.88Å; W169-F192 HydrophobicContact CZ3-CE1 3.88Å; L172-F192 HydrophobicContact CD2-CE1 4.22Å; L172-F192 HydrophobicContact CD2-CE2 4.32Å; L172-F192 HydrophobicContact CD2-CZ 4.11Å; L173-F192 HydrophobicContact CD2-CB 4.02Å; F192-I194 HydrophobicContact CE1-CD1 4.25Å; F192-I194 HydrophobicContact CE1-CG1 4.07Å; F192-I194 HydrophobicContact CZ-CD1 4.47Å; F192-I194 HydrophobicContact CZ-CG1 4.31Å; F192-V309 HydrophobicContact CE2-CG1 3.61Å; F192-V309 HydrophobicContact CZ-CG1 3.52Å; F192-I311 HydrophobicContact CD2-CB 4.34Å; F192-I311 HydrophobicContact CD2-CD1 4.48Å
193	G	95.8	Very high	94.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	158	-177.9	0	0	0	0	0	114.6	F160 F310	F160-G193 CarbonylContact O-C 3.53Å; F160-G193 WeakPolarHBondContact O-CA 3.48Å; G193-F310 PolarHBondContact N-O 3.22Å; G193-F310 PolarHBondContact O-N 3.43Å
194	I	95.8	Very high	94.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135.2	172.8	-50.2	-175.7	0	0	0	107.1	W52 L111 F137 Y140 L145 F160 F192 T307 S308 V309	W52-I194 HydrophobicContact CE3-CG2 4.5Å; W52-I194 HydrophobicContact CH2-CD1 3.59Å; W52-I194 HydrophobicContact CH2-CG2 4.43Å; W52-I194 HydrophobicContact CZ2-CD1 3.95Å; W52-I194 HydrophobicContact CZ3-CD1 4.28Å; W52-I194 HydrophobicContact CZ3-CG2 4.14Å; L111-I194 HydrophobicContact CD1-CD1 3.62Å; F137-I194 HydrophobicContact CE2-CD1 3.74Å; F137-I194 HydrophobicContact CZ-CD1 3.57Å; Y140-I194 HydrophobicContact CE1-CB 4.32Å; Y140-I194 PolarHBondContact OH-O 3.21Å; L145-I194 HydrophobicContact CD1-CG2 3.91Å; L145-I194 HydrophobicContact CD2-CG2 3.82Å; F160-I194 HydrophobicContact CD1-CB 4.5Å; F160-I194 HydrophobicContact CD1-CG1 4.34Å; F160-I194 PolarHBondContact N-O 2.85Å; F160-I194 PolarHBondContact O-N 2.83Å; F160-I194 VanDerWaalsContact O-O 3.12Å; F192-I194 HydrophobicContact CE1-CD1 4.25Å; F192-I194 HydrophobicContact CE1-CG1 4.07Å; F192-I194 HydrophobicContact CZ-CD1 4.47Å; F192-I194 HydrophobicContact CZ-CG1 4.31Å; I194-T307 HydrophobicContact CG2-CG2 4.5Å; I194-S308 VanDerWaalsContact CA-O 3.29Å; I194-S308 WeakPolarHBondContact CA-O 3.42Å; I194-V309 HydrophobicContact CD1-CG2 4.28Å; I194-V309 HydrophobicContact CG1-CG1 4.29Å; I194-V309 HydrophobicContact CG1-CG2 4.13Å; I194-V309 HydrophobicContact CG2-CG2 4.21Å
195	A	94.7	Very high	94.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	149.2	-175.4	0	0	0	0	0	111.7	Y159 T199 N304 T307 S308 F310	Y159-A195 HydrophobicContact CD2-CB 3.85Å; Y159-A195 HydrophobicContact CG-CB 4.42Å; A195-T199 WeakPolarHBondContact CB-OG1 3.43Å; A195-N304 WeakPolarHBondContact CB-ND2 3.48Å; A195-T307 CarbonylContact O-C 3.54Å; A195-T307 WeakPolarHBondContact O-CA 3.45Å; A195-S308 PolarHBondContact N-O 3.43Å; A195-S308 PolarHBondContact O-N 2.96Å; A195-F310 HydrophobicContact CB-CE1 3.85Å; A195-F310 HydrophobicContact CB-CZ 4.44Å
196	G	93.3	Very high	94.3	Very high	2 Å²	2	28.8 Å²	28.8	2%	0.021	16%	0.155	C	C	.	.			trans	-81.4	163.4	179.9	0	0	0	0	0	112.7	T199	G196-T199 WeakPolarHBondContact O-CB 3.22Å; G196-T199 WeakPolarHBondContact O-CG2 3.49Å; G196-T199 PolarHBondContact O-N 3.15Å; G196-T199 PolarHBondContact O-OG1 2.88Å
197	P	93.7	Very high	94.4	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.019	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	145.8	174.6	-21.8	30	0	0	0	112.9	S58 P147 Q148 T199 N304	S58-P197 WeakPolarHBondContact O-CB 3.32Å; P147-P197 CarbonylContact C-O 3.54Å; P147-P197 WeakPolarHBondContact CA-O 3.4Å; P147-P197 HydrophobicContact CB-CB 4.39Å; P147-P197 HydrophobicContact CG-CG 4.25Å; Q148-P197 PolarHBondContact N-O 2.85Å; P197-T199 PolarHBondContact O-N 3.4Å; P197-T199 VanDerWaalsContact O-N 3.09Å; P197-N304 CarbonylContact C-O 3.57Å
198	G	93.3	Very high	94.6	Very high	3 Å²	3	22 Å²	22	3%	0.031	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	-9.1	179.5	0	0	0	0	0	115.1	Q148 L303 N304	Q148-G198 VanDerWaalsContact CD-O 3.29Å; Q148-G198 PolarHBondContact NE2-O 3.2Å; Q148-G198 PolarHBondContact OE1-O 2.71Å; G198-L303 WeakPolarHBondContact O-CD1 3.43Å; G198-N304 PolarHBondContact N-O 3.07Å
199	T	93.7	Very high	94.9	Very high	5 Å²	5	19 Å²	19	3%	0.031	10%	0.101	C	C	.	.			trans	-82	159.2	174.3	70.5	0	0	0	0	111.4	Q148 T157 A195 G196 P197 N304	Q148-T199 HydrophobicContact CB-CG2 3.95Å; Q148-T199 HydrophobicContact CG-CG2 4.45Å; T157-T199 HydrophobicContact CG2-CG2 3.67Å; A195-T199 WeakPolarHBondContact CB-OG1 3.43Å; G196-T199 WeakPolarHBondContact O-CB 3.22Å; G196-T199 WeakPolarHBondContact O-CG2 3.49Å; G196-T199 PolarHBondContact O-N 3.15Å; G196-T199 PolarHBondContact O-OG1 2.88Å; P197-T199 PolarHBondContact O-N 3.4Å; P197-T199 VanDerWaalsContact O-N 3.09Å; T199-N304 PolarHBondContact O-N 3.24Å; T199-N304 PolarHBondContact O-ND2 2.81Å; T199-N304 PolarHBondContact OG1-ND2 2.91Å
200	G	92.8	Very high	95.1	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.01	8%	0.08	C	C	.	.			trans	165	176.2	174.1	0	0	0	0	0	111.4	A125 T302	A125-G200 WeakPolarHBondContact CB-O 3.4Å; G200-T302 CarbonylContact C-O 3.55Å; G200-T302 VanDerWaalsContact CA-O 3.27Å; G200-T302 WeakPolarHBondContact CA-O 3.34Å
201	V	92.3	Very high	95.2	Very high	7 Å²	7	13 Å²	13	4%	0.042	7%	0.066	C	C	.	.			trans	-100.4	129.6	-179.1	-166	0	0	0	0	109.8	Y159 H204 T237 A301 T302	Y159-V201 HydrophobicContact CE1-CG2 4.35Å; Y159-V201 WeakPolarHBondContact OH-CG2 3.35Å; V201-H204 VanDerWaalsContact CG1-CE1 3.4Å; V201-H204 WeakPolarHBondContact CG1-CE1 3.2Å; V201-H204 WeakPolarHBondContact CG1-ND1 3.49Å; V201-T237 PolarHBondContact O-OG1 3.47Å; V201-A301 CarbonylContact O-C 3.46Å; V201-A301 VanDerWaalsContact O-CA 3.23Å; V201-A301 WeakPolarHBondContact O-CA 3.41Å; V201-T302 PolarHBondContact N-O 3.15Å; V201-T302 PolarHBondContact N-OG1 3.09Å; V201-T302 PolarHBondContact O-N 2.66Å
202	P	94.4	Very high	95.2	Very high	5 Å²	5	12.8 Å²	12.8	3%	0.032	7%	0.065	C	C	.	.			trans	-59.2	175.5	171.1	-23.7	33	0	0	0	112	A125 H204 F231 R235 T237	A125-P202 WeakPolarHBondContact O-CD 3.35Å; P202-H204 PolarHBondContact O-N 3.21Å; P202-H204 PolarHBondContact O-ND1 3.05Å; P202-F231 HydrophobicContact CB-CD2 4.2Å; P202-F231 HydrophobicContact CB-CE2 4.44Å; P202-R235 WeakPolarHBondContact CG-O 3.29Å; P202-T237 WeakPolarHBondContact CA-OG1 3.24Å
203	F	96.8	Very high	95.2	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.009	7%	0.065	C	C	.	.	S	Bend	trans	-56	130.3	179.9	-68.9	-78.3	0	0	0	112	T127 F221 Y223 P229 F231 W240 W299 H300 A301	T127-F203 PolarHBondContact OG1-O 3.18Å; F203-F221 HydrophobicContact CE1-CB 3.8Å; F203-F221 WeakPolarHBondContact CE1-O 3.45Å; F203-F221 HydrophobicContact CZ-CB 3.62Å; F203-F221 HydrophobicContact CZ-CG 4.49Å; F203-Y223 HydrophobicContact CD1-CD2 4.19Å; F203-Y223 HydrophobicContact CD1-CE2 4.46Å; F203-Y223 AromaticContact CE1-CD2 3.62Å; F203-Y223 HydrophobicContact CE1-CD2 3.62Å; F203-Y223 AromaticContact CE1-CE2 3.63Å; F203-Y223 HydrophobicContact CE1-CE2 3.63Å; F203-Y223 HydrophobicContact CE2-CE2 4.43Å; F203-Y223 HydrophobicContact CZ-CD2 4.12Å; F203-Y223 AromaticContact CZ-CE2 3.62Å; F203-Y223 HydrophobicContact CZ-CE2 3.62Å; F203-P229 HydrophobicContact CB-CG 3.59Å; F203-P229 HydrophobicContact CD1-CB 4.2Å; F203-P229 HydrophobicContact CD1-CG 3.72Å; F203-P229 HydrophobicContact CD2-CB 3.99Å; F203-P229 HydrophobicContact CD2-CG 3.94Å; F203-P229 HydrophobicContact CE1-CB 4.44Å; F203-P229 HydrophobicContact CE1-CG 4.4Å; F203-P229 HydrophobicContact CE2-CB 4.25Å; F203-P229 HydrophobicContact CG-CB 3.97Å; F203-P229 HydrophobicContact CG-CG 3.45Å; F203-P229 VanDerWaalsContact CG-CG 3.45Å; F203-P229 HydrophobicContact CZ-CB 4.46Å; F203-F231 HydrophobicContact CB-CD1 3.77Å; F203-F231 HydrophobicContact CB-CD2 4.04Å; F203-F231 HydrophobicContact CB-CE1 3.74Å; F203-F231 HydrophobicContact CB-CE2 4Å; F203-F231 HydrophobicContact CB-CG 3.93Å; F203-F231 HydrophobicContact CB-CZ 3.85Å; F203-F231 HydrophobicContact CD2-CB 3.93Å; F203-F231 HydrophobicContact CD2-CD1 4.25Å; F203-F231 AromaticContact CD2-CG 3.99Å; F203-F231 HydrophobicContact CD2-CG 3.99Å; F203-F231 HydrophobicContact CG-CD1 4.39Å; F203-F231 HydrophobicContact CG-CG 4.44Å; F203-F231 WeakPolarHBondContact O-CE2 3.24Å; F203-F231 WeakPolarHBondContact O-CZ 3.18Å; F203-W240 AromaticContact CE2-CD2 3.87Å; F203-W240 HydrophobicContact CE2-CD2 3.87Å; F203-W240 AromaticContact CE2-CE2 3.55Å; F203-W240 HydrophobicContact CE2-CE3 4.13Å; F203-W240 AromaticContact CE2-CH2 3.8Å; F203-W240 HydrophobicContact CE2-CH2 3.8Å; F203-W240 AromaticContact CE2-CZ2 3.52Å; F203-W240 HydrophobicContact CE2-CZ2 3.52Å; F203-W240 HydrophobicContact CE2-CZ3 4.11Å; F203-W240 AromaticContact CZ-CH2 3.71Å; F203-W240 HydrophobicContact CZ-CH2 3.71Å; F203-W240 AromaticContact CZ-CZ2 3.79Å; F203-W240 HydrophobicContact CZ-CZ2 3.79Å; F203-W240 HydrophobicContact CZ-CZ3 4.16Å; F203-W299 HydrophobicContact CB-CE3 4.29Å; F203-W299 HydrophobicContact CD1-CB 4.42Å; F203-H300 WeakPolarHBondContact CA-O 3.28Å; F203-A301 HydrophobicContact CD1-CB 3.66Å; F203-A301 HydrophobicContact CD2-CB 3.88Å; F203-A301 HydrophobicContact CE1-CB 3.65Å; F203-A301 HydrophobicContact CE2-CB 3.86Å; F203-A301 HydrophobicContact CG-CB 3.78Å; F203-A301 HydrophobicContact CZ-CB 3.75Å
204	H	95.3	Very high	95.2	Very high	28 Å²	28	12.9 Å²	12.9	13%	0.13	7%	0.065	C	C	.	.	B	Isolated β-bridge	trans	-157.9	177.3	174.7	65	-69.3	0	0	0	108.3	T127 V201 P202 H206 W299 H300	T127-H204 HydrophobicContact CG2-CB 3.98Å; V201-H204 VanDerWaalsContact CG1-CE1 3.4Å; V201-H204 WeakPolarHBondContact CG1-CE1 3.2Å; V201-H204 WeakPolarHBondContact CG1-ND1 3.49Å; P202-H204 PolarHBondContact O-N 3.21Å; P202-H204 PolarHBondContact O-ND1 3.05Å; H204-H206 AromaticContact CD2-CD2 3.84Å; H204-H206 AromaticContact NE2-CD2 3.9Å; H204-H206 AromaticContact NE2-NE2 3.76Å; H204-W299 CarbonylContact O-C 3.44Å; H204-W299 WeakPolarHBondContact O-CA 2.93Å; H204-H300 AromaticContact CD2-NE2 3.9Å; H204-H300 AromaticContact CE1-CD2 3.64Å; H204-H300 AromaticContact CE1-NE2 3.55Å; H204-H300 PolarHBondContact N-O 3.24Å; H204-H300 VanDerWaalsContact N-O 3.15Å; H204-H300 PolarHBondContact ND1-O 2.92Å; H204-H300 AromaticContact NE2-CD2 3.93Å; H204-H300 AromaticContact NE2-NE2 3.34Å; H204-H300 PolarHBondContact NE2-NE2 3.44Å; H204-H300 PolarHBondContact O-N 2.86Å; H204-H300 PolarHBondContact O-ND1 2.91Å
205	W	95.6	Very high	95.1	Very high	128 Å²	128	13.5 Å²	13.5	49%	0.485	7%	0.068	S	C	.	.			trans	-146.6	157.3	174.7	61.1	-98.3	0	0	0	110.6	R297 W298 W299	W205-R297 HydrophobicContact CE3-CB 4.27Å; W205-R297 HydrophobicContact CE3-CG 3.9Å; W205-R297 HydrophobicContact CZ3-CG 4.09Å; W205-W298 WeakPolarHBondContact CB-O 3.46Å; W205-W299 AromaticContact CD1-CD2 3.88Å; W205-W299 AromaticContact CD1-CE2 3.82Å; W205-W299 AromaticContact CD1-CE3 3.77Å; W205-W299 AromaticContact CD1-CH2 3.63Å; W205-W299 AromaticContact CD1-CZ2 3.71Å; W205-W299 AromaticContact CD1-CZ3 3.66Å; W205-W299 AromaticContact NE1-CH2 3.81Å; W205-W299 AromaticContact NE1-CZ2 3.9Å
206	H	94.7	Very high	95	Very high	53 Å²	53	14.4 Å²	14.4	25%	0.245	8%	0.077	C	C	.	.			trans	-160.7	-162.4	173.8	50.8	48.5	0	0	0	108.7	H204 F294 R297 H300 F314	H204-H206 AromaticContact CD2-CD2 3.84Å; H204-H206 AromaticContact NE2-CD2 3.9Å; H204-H206 AromaticContact NE2-NE2 3.76Å; H206-F294 AromaticContact CE1-CE2 3.38Å; H206-F294 WeakPolarHBondContact CE1-CE2 3.44Å; H206-F294 AromaticContact CE1-CZ 3.63Å; H206-F294 AromaticContact ND1-CE2 3.8Å; H206-R297 PolarHBondContact O-N 2.92Å; H206-H300 AromaticContact CE1-CE1 3.4Å; H206-H300 PolarHBondContact CE1-CE1 2.77Å; H206-H300 VanDerWaalsContact CE1-CE1 3.4Å; H206-H300 AromaticContact CE1-NE2 3.4Å; H206-H300 PolarHBondContact CE1-NE2 3.24Å; H206-H300 AromaticContact ND1-CE1 3.88Å; H206-H300 AromaticContact NE2-CE1 3.59Å; H206-H300 AromaticContact NE2-NE2 3.26Å; H206-H300 PolarHBondContact NE2-NE2 3.22Å; H206-F314 AromaticContact CE1-CD1 3.96Å; H206-F314 AromaticContact CE1-CE1 3.35Å; H206-F314 WeakPolarHBondContact CE1-CE1 3.36Å; H206-F314 AromaticContact NE2-CE1 3.57Å
207	G	95.9	Very high	95	Very high	28 Å²	28	16.8 Å²	16.8	29%	0.289	9%	0.086	S	C	.	.	S	Bend	trans	-55.6	163.6	173.5	0	0	0	0	0	113.6	F294 D296	G207-F294 WeakPolarHBondContact O-CE2 2.88Å; G207-D296 WeakPolarHBondContact CA-OD1 3.26Å
208	P	97.8	Very high	95.1	Very high	1 Å²	1	17 Å²	17	1%	0.006	9%	0.086	C	C	.	.			trans	-65.8	156.8	178.6	24.3	-25.7	0	0	0	111.6	L183 Y293 F294 D296 L315	L183-P208 HydrophobicContact CD1-CB 4.03Å; L183-P208 HydrophobicContact CD1-CG 3.4Å; L183-P208 VanDerWaalsContact CD1-CG 3.4Å; P208-Y293 HydrophobicContact CB-CE2 4.18Å; P208-Y293 WeakPolarHBondContact CB-OH 3.15Å; P208-F294 WeakPolarHBondContact CA-O 3.4Å; P208-D296 HydrophobicContact CG-CB 4.24Å; P208-L315 HydrophobicContact CG-CB 4.19Å; P208-L315 PolarHBondContact O-N 2.91Å
209	G	97.9	Very high	95.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	168.6	177.4	0	0	0	0	0	114.6	Y293 F294 T313	G209-Y293 WeakPolarHBondContact O-CA 3.29Å; G209-Y293 WeakPolarHBondContact O-CD2 3.28Å; G209-F294 PolarHBondContact N-O 3.29Å; G209-F294 VanDerWaalsContact N-O 3.09Å; G209-F294 WeakPolarHBondContact O-CD1 3.13Å; G209-F294 PolarHBondContact O-N 2.81Å; G209-T313 CarbonylContact C-O 3.48Å; G209-T313 WeakPolarHBondContact CA-O 3.41Å
210	F	97.8	Very high	95.5	Very high	2 Å²	2	17 Å²	17	1%	0.009	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	148	169.1	-62.7	-81.3	0	0	0	110.1	F81 I93 P179 Y181 V291 L292 Y293 S312 T313 L315	F81-F210 HydrophobicContact CE1-CZ 4.49Å; F81-F210 HydrophobicContact CE2-CE1 4.24Å; F81-F210 HydrophobicContact CE2-CZ 4.03Å; F81-F210 HydrophobicContact CZ-CE1 4.38Å; F81-F210 AromaticContact CZ-CZ 3.74Å; F81-F210 HydrophobicContact CZ-CZ 3.74Å; I93-F210 HydrophobicContact CD1-CE1 4.35Å; P179-F210 HydrophobicContact CB-CD1 4.1Å; P179-F210 HydrophobicContact CB-CD2 4.36Å; P179-F210 HydrophobicContact CB-CE1 4.19Å; P179-F210 HydrophobicContact CB-CE2 4.44Å; P179-F210 HydrophobicContact CB-CG 4.21Å; P179-F210 HydrophobicContact CB-CZ 4.41Å; P179-F210 HydrophobicContact CG-CB 3.98Å; P179-F210 HydrophobicContact CG-CD1 3.91Å; P179-F210 HydrophobicContact CG-CD2 4.23Å; P179-F210 HydrophobicContact CG-CE1 4.5Å; P179-F210 HydrophobicContact CG-CG 3.77Å; Y181-F210 HydrophobicContact CD2-CE1 4.16Å; Y181-F210 HydrophobicContact CD2-CZ 4.17Å; Y181-F210 HydrophobicContact CG-CZ 4.36Å; F210-V291 HydrophobicContact CB-CG1 3.84Å; F210-V291 HydrophobicContact CD1-CG1 3.85Å; F210-V291 HydrophobicContact CG-CG1 4.27Å; F210-L292 CarbonylContact C-O 3.57Å; F210-L292 WeakPolarHBondContact CA-O 3.42Å; F210-Y293 AromaticContact CD1-CD2 3.79Å; F210-Y293 HydrophobicContact CD1-CD2 3.79Å; F210-Y293 HydrophobicContact CD1-CG 4.28Å; F210-Y293 HydrophobicContact CD2-CD2 4.41Å; F210-Y293 AromaticContact CE1-CD2 3.4Å; F210-Y293 HydrophobicContact CE1-CD2 3.4Å; F210-Y293 HydrophobicContact CE1-CE2 4.39Å; F210-Y293 AromaticContact CE1-CG 3.84Å; F210-Y293 HydrophobicContact CE1-CG 3.84Å; F210-Y293 HydrophobicContact CE2-CD2 4.08Å; F210-Y293 HydrophobicContact CE2-CE2 4.43Å; F210-Y293 HydrophobicContact CG-CD2 4.26Å; F210-Y293 AromaticContact CZ-CD2 3.52Å; F210-Y293 HydrophobicContact CZ-CD2 3.52Å; F210-Y293 HydrophobicContact CZ-CE2 4.08Å; F210-Y293 HydrophobicContact CZ-CG 4.3Å; F210-S312 CarbonylContact O-C 3.57Å; F210-S312 WeakPolarHBondContact O-CA 3.3Å; F210-S312 WeakPolarHBondContact O-CB 3.38Å; F210-T313 PolarHBondContact N-O 2.76Å; F210-T313 PolarHBondContact O-N 3.12Å; F210-L315 HydrophobicContact CD2-CD1 4.29Å; F210-L315 HydrophobicContact CE2-CD1 3.75Å; F210-L315 HydrophobicContact CE2-CG 4.47Å
211	S	97	Very high	95.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.5	168.6	-169.2	0	0	0	0	111.3	W220 L292 S312	S211-W220 VanDerWaalsContact CB-CZ2 3.43Å; S211-W220 WeakPolarHBondContact OG-CZ2 3.4Å; S211-L292 PolarHBondContact N-O 3.09Å; S211-L292 PolarHBondContact O-N 3.29Å; S211-S312 PolarHBondContact OG-OG 3.44Å
212	E	95.7	Very high	96.1	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140	178.3	-171.2	175.7	159.1	0	0	109.7	N99 Y176 I214 R289 V291 F310 I311	N99-E212 PolarHBondContact ND2-OE1 3.41Å; N99-E212 VanDerWaalsContact ND2-OE1 3.12Å; N99-E212 PolarHBondContact ND2-OE2 2.82Å; N99-E212 VanDerWaalsContact ND2-OE2 3.15Å; Y176-E212 WeakPolarHBondContact CE2-OE2 3.42Å; Y176-E212 PolarHBondContact OH-OE2 3.29Å; E212-I214 HydrophobicContact CG-CD1 4.16Å; E212-R289 WeakPolarHBondContact OE1-CD 3.21Å; E212-V291 HydrophobicContact CB-CG2 4.19Å; E212-V291 HydrophobicContact CG-CG2 4.07Å; E212-F310 WeakPolarHBondContact O-CA 3.44Å; E212-F310 VanDerWaalsContact O-CB 3.29Å; E212-F310 WeakPolarHBondContact O-CB 3.35Å; E212-I311 HydrophobicContact CB-CG2 4.2Å; E212-I311 PolarHBondContact N-O 3.39Å; E212-I311 PolarHBondContact O-N 3.02Å
213	V	95.3	Very high	96.3	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123.2	174.5	-176.2	0	0	0	0	108.3	Y215 G216 K218 V259 P261	V213-Y215 WeakPolarHBondContact CG1-O 3.21Å; V213-G216 VanDerWaalsContact CG1-O 3.24Å; V213-G216 WeakPolarHBondContact CG1-O 3.38Å; V213-K218 HydrophobicContact CG2-CB 3.71Å; V213-V259 HydrophobicContact CB-CG1 4.48Å; V213-V259 HydrophobicContact CG2-CB 4.15Å; V213-V259 HydrophobicContact CG2-CG1 3.95Å; V213-P261 WeakPolarHBondContact O-CB 2.96Å
214	I	94.9	Very high	96.4	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-42.1	-177.2	-51.5	-56.3	0	0	0	110.8	F102 Q103 C106 E212 P261 V309 I311	F102-I214 HydrophobicContact CD1-CD1 3.75Å; F102-I214 HydrophobicContact CD1-CG1 4.24Å; F102-I214 HydrophobicContact CE1-CD1 3.65Å; F102-I214 HydrophobicContact CE1-CG1 3.8Å; Q103-I214 HydrophobicContact CB-CG2 3.84Å; Q103-I214 HydrophobicContact CG-CG2 3.8Å; Q103-I214 PolarHBondContact NE2-O 2.99Å; C106-I214 HydrophobicContact CB-CG2 3.79Å; E212-I214 HydrophobicContact CG-CD1 4.16Å; I214-P261 WeakPolarHBondContact O-CB 3.46Å; I214-V309 WeakPolarHBondContact CA-O 3.34Å; I214-V309 HydrophobicContact CB-CB 4.28Å; I214-V309 HydrophobicContact CB-CG1 4.14Å; I214-V309 WeakPolarHBondContact CB-O 3.07Å; I214-V309 PolarHBondContact N-O 3.2Å; I214-I311 HydrophobicContact CD1-CG2 4.16Å; I214-I311 HydrophobicContact CG1-CG2 4.45Å
215	Y	93.9	Very high	96.4	Very high	13 Å²	13	20 Å²	20	5%	0.051	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	150.5	171.1	-69.7	-68.3	0	0	0	109.7	E48 D49 G50 W52 Q103 C106 V213 S308 V309	E48-Y215 VanDerWaalsContact O-CE1 3.23Å; E48-Y215 WeakPolarHBondContact O-CE1 3.38Å; D49-Y215 VanDerWaalsContact C-CD1 3.44Å; D49-Y215 WeakPolarHBondContact O-CD1 3.1Å; G50-Y215 VanDerWaalsContact CA-CE1 3.49Å; G50-Y215 VanDerWaalsContact CA-CZ 3.44Å; G50-Y215 VanDerWaalsContact N-CE1 3.29Å; W52-Y215 AromaticContact CD1-CD2 3.55Å; W52-Y215 AromaticContact CD1-CG 3.74Å; W52-Y215 AromaticContact NE1-CD2 3.61Å; Q103-Y215 HydrophobicContact CG-CD1 4.48Å; Q103-Y215 HydrophobicContact CG-CE1 3.74Å; Q103-Y215 HydrophobicContact CG-CE2 3.86Å; Q103-Y215 VanDerWaalsContact CG-CZ 3.42Å; Q103-Y215 VanDerWaalsContact O-CE2 3.26Å; Q103-Y215 WeakPolarHBondContact O-CE2 3.38Å; Q103-Y215 PolarHBondContact O-OH 2.98Å; Q103-Y215 VanDerWaalsContact O-OH 3.06Å; C106-Y215 HydrophobicContact CB-CD2 4.36Å; C106-Y215 HydrophobicContact CB-CE2 4.04Å; C106-Y215 WeakPolarHBondContact O-CE2 3.11Å; V213-Y215 WeakPolarHBondContact CG1-O 3.21Å; Y215-S308 CarbonylContact O-C 3.51Å; Y215-S308 VanDerWaalsContact O-CA 3.25Å; Y215-S308 WeakPolarHBondContact O-CA 3.45Å; Y215-V309 HydrophobicContact CD2-CB 4.2Å; Y215-V309 HydrophobicContact CD2-CG2 4.17Å; Y215-V309 PolarHBondContact N-O 3.12Å; Y215-V309 VanDerWaalsContact N-O 3.15Å; Y215-V309 PolarHBondContact O-N 3.2Å
216	G	92.8	Very high	96.5	Very high	20 Å²	20	20.9 Å²	20.9	21%	0.206	12%	0.12	C	C	.	.	S	Bend	trans	78.1	-165.6	-177.9	0	0	0	0	0	113.7	V213 P261	V213-G216 VanDerWaalsContact CG1-O 3.24Å; V213-G216 WeakPolarHBondContact CG1-O 3.38Å; G216-P261 WeakPolarHBondContact O-CD 3.46Å
217	R	93.9	Very high	96.5	Very high	51 Å²	51	22.5 Å²	22.5	19%	0.192	12%	0.124	C	C	.	.			trans	-130.4	138	-179.5	-61.3	170.2	-68.1	154.6	10.6	110.3	L60 E63 T258 R260 L305 D306 S308	L60-R217 PolarHBondContact O-NH2 3.02Å; E63-R217 WeakPolarHBondContact OE1-CD 3.04Å; E63-R217 IonicContact OE1-CZ 3.07Å; E63-R217 IonicContact OE1-NE 2.71Å; E63-R217 IonicContact OE1-NH1 2.66Å; E63-R217 PolarHBondContact OE1-NH1 3.05Å; R217-T258 HydrophobicContact CB-CG2 3.9Å; R217-R260 HydrophobicContact CG-CB 4.14Å; R217-L305 HydrophobicContact CB-CB 4.13Å; R217-L305 HydrophobicContact CB-CD1 4.2Å; R217-L305 HydrophobicContact CB-CG 4.43Å; R217-L305 PolarHBondContact O-N 3.45Å; R217-D306 VanDerWaalsContact CB-OD2 3.3Å; R217-D306 WeakPolarHBondContact CB-OD2 3.38Å; R217-D306 VanDerWaalsContact CG-OD2 3.28Å; R217-D306 WeakPolarHBondContact CG-OD2 3.36Å; R217-D306 IonicContact CZ-OD1 3.85Å; R217-D306 IonicContact CZ-OD2 3.24Å; R217-D306 PolarHBondContact N-OD2 3Å; R217-D306 IonicContact NE-OD1 3.44Å; R217-D306 IonicContact NE-OD2 3.22Å; R217-D306 PolarHBondContact NE-OD2 2.9Å; R217-D306 IonicContact NH2-OD1 3.8Å; R217-D306 PolarHBondContact NH2-OD1 3.37Å; R217-D306 IonicContact NH2-OD2 3.05Å; R217-D306 PolarHBondContact NH2-OD2 3.49Å; R217-S308 PolarHBondContact O-OG 2.95Å
218	K	95.8	Very high	96.5	Very high	7 Å²	7	28 Å²	28	3%	0.03	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	119.8	176.6	-175.6	178.5	-75.4	-168.5	0	111	V213 W220 V259 T302 L303 N304	V213-K218 HydrophobicContact CG2-CB 3.71Å; K218-W220 HydrophobicContact CD-CZ2 3.99Å; K218-V259 PolarHBondContact N-O 2.92Å; K218-V259 PolarHBondContact O-N 2.92Å; K218-T302 HydrophobicContact CD-CG2 4.19Å; K218-L303 CarbonylContact C-O 3.57Å; K218-L303 WeakPolarHBondContact CA-O 3.39Å; K218-N304 WeakPolarHBondContact CE-OD1 3.44Å
219	R	97.6	Very high	96.4	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.008	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135	173	-168.3	168.3	174.9	-175.1	-4.3	110.3	D62 G64 F221 E256 T258 T302 L303 L305	D62-R219 VanDerWaalsContact CG-NH1 3.3Å; D62-R219 PolarHBondContact O-NH1 3.07Å; D62-R219 VanDerWaalsContact O-NH1 3.15Å; D62-R219 IonicContact OD1-NH1 3.58Å; D62-R219 IonicContact OD2-CZ 3.52Å; D62-R219 IonicContact OD2-NH1 2.72Å; D62-R219 PolarHBondContact OD2-NH1 3.16Å; D62-R219 IonicContact OD2-NH2 3.47Å; G64-R219 VanDerWaalsContact CA-NH2 3.29Å; R219-F221 HydrophobicContact CG-CE1 4.18Å; R219-F221 HydrophobicContact CG-CE2 4.02Å; R219-F221 HydrophobicContact CG-CZ 3.68Å; R219-F221 VanDerWaalsContact NE-CZ 3.34Å; R219-E256 IonicContact CZ-OE2 3.58Å; R219-E256 VanDerWaalsContact CZ-OE2 3.29Å; R219-E256 IonicContact NE-OE2 3.98Å; R219-E256 PolarHBondContact NE-OE2 3.31Å; R219-E256 VanDerWaalsContact NE-OE2 3.07Å; R219-E256 IonicContact NH2-OE1 3.62Å; R219-E256 IonicContact NH2-OE2 2.81Å; R219-E256 PolarHBondContact NH2-OE2 3.08Å; R219-T258 WeakPolarHBondContact CB-OG1 3.29Å; R219-T258 WeakPolarHBondContact CG-OG1 3.49Å; R219-T302 CarbonylContact O-C 3.49Å; R219-T302 WeakPolarHBondContact O-CA 3.09Å; R219-L303 HydrophobicContact CB-CB 4.42Å; R219-L303 PolarHBondContact N-O 3.15Å; R219-L303 PolarHBondContact O-N 2.91Å; R219-L305 HydrophobicContact CB-CD1 4.42Å; R219-L305 HydrophobicContact CB-CD2 4.13Å; R219-L305 HydrophobicContact CB-CG 4.35Å
220	W	98.4	Very high	96.1	Very high	8 Å²	8	35.7 Å²	35.7	3%	0.03	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.5	178.8	-73.6	78.4	0	0	0	110.2	S211 K218 L222 E256 C257 L292 F294 H300 T302	S211-W220 VanDerWaalsContact CB-CZ2 3.43Å; S211-W220 WeakPolarHBondContact OG-CZ2 3.4Å; K218-W220 HydrophobicContact CD-CZ2 3.99Å; W220-L222 HydrophobicContact CB-CD1 3.99Å; W220-E256 WeakPolarHBondContact O-CA 3.3Å; W220-E256 WeakPolarHBondContact O-CB 3.36Å; W220-C257 PolarHBondContact N-O 3.38Å; W220-C257 PolarHBondContact O-N 3.04Å; W220-L292 HydrophobicContact CB-CD2 3.98Å; W220-L292 HydrophobicContact CD2-CD2 3.2Å; W220-L292 HydrophobicContact CE3-CD2 3.43Å; W220-L292 VanDerWaalsContact CE3-CD2 3.43Å; W220-L292 HydrophobicContact CG-CD2 3.46Å; W220-L292 VanDerWaalsContact CG-CD2 3.46Å; W220-L292 HydrophobicContact CH2-CD2 4.44Å; W220-L292 HydrophobicContact CZ2-CD2 4.29Å; W220-L292 HydrophobicContact CZ3-CD2 4.03Å; W220-F294 HydrophobicContact CH2-CD1 4.32Å; W220-F294 HydrophobicContact CH2-CE1 4.05Å; W220-F294 HydrophobicContact CZ3-CD1 4.06Å; W220-F294 HydrophobicContact CZ3-CE1 4.17Å; W220-H300 HydrophobicContact CE3-CB 4.3Å; W220-H300 HydrophobicContact CZ3-CB 4.27Å; W220-H300 AromaticContact CZ3-CD2 3.78Å; W220-T302 HydrophobicContact CD2-CG2 3.64Å; W220-T302 HydrophobicContact CE3-CG2 3.59Å; W220-T302 HydrophobicContact CG-CG2 4.42Å; W220-T302 HydrophobicContact CH2-CG2 3.62Å; W220-T302 HydrophobicContact CZ2-CG2 3.63Å; W220-T302 HydrophobicContact CZ3-CG2 3.61Å
221	F	98.5	Very high	95.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.9	173	-51.8	-85.2	0	0	0	108	F203 R219 T237 W240 L241 Y245 P254 L255 E256 H300 A301 L303	F203-F221 HydrophobicContact CE1-CB 3.8Å; F203-F221 WeakPolarHBondContact CE1-O 3.45Å; F203-F221 HydrophobicContact CZ-CB 3.62Å; F203-F221 HydrophobicContact CZ-CG 4.49Å; R219-F221 HydrophobicContact CG-CE1 4.18Å; R219-F221 HydrophobicContact CG-CE2 4.02Å; R219-F221 HydrophobicContact CG-CZ 3.68Å; R219-F221 VanDerWaalsContact NE-CZ 3.34Å; F221-T237 HydrophobicContact CD2-CG2 4.12Å; F221-T237 HydrophobicContact CE2-CG2 3.97Å; F221-W240 HydrophobicContact CD1-CH2 4.18Å; F221-W240 AromaticContact CD1-CZ3 3.9Å; F221-W240 HydrophobicContact CD1-CZ3 3.9Å; F221-W240 HydrophobicContact CD2-CZ3 4.13Å; F221-W240 HydrophobicContact CE1-CZ3 4.06Å; F221-W240 HydrophobicContact CE2-CZ3 4.3Å; F221-W240 HydrophobicContact CG-CH2 4.3Å; F221-W240 AromaticContact CG-CZ3 3.92Å; F221-W240 HydrophobicContact CG-CZ3 3.92Å; F221-W240 HydrophobicContact CZ-CZ3 4.26Å; F221-L241 HydrophobicContact CE1-CD1 4.14Å; F221-L241 HydrophobicContact CZ-CD1 3.83Å; F221-L241 HydrophobicContact CZ-CD2 4.29Å; F221-Y245 HydrophobicContact CD1-CE2 4.49Å; F221-Y245 HydrophobicContact CE1-CE2 4.32Å; F221-P254 HydrophobicContact CB-CB 4.16Å; F221-P254 HydrophobicContact CB-CG 4.31Å; F221-P254 HydrophobicContact CD1-CG 3.91Å; F221-L255 CarbonylContact C-O 3.55Å; F221-L255 WeakPolarHBondContact CA-O 3Å; F221-E256 HydrophobicContact CD1-CB 3.95Å; F221-E256 HydrophobicContact CE1-CB 4.35Å; F221-E256 WeakPolarHBondContact CE1-OE2 3.43Å; F221-H300 CarbonylContact O-C 3.41Å; F221-H300 WeakPolarHBondContact O-CA 3.2Å; F221-A301 HydrophobicContact CB-CB 4.42Å; F221-A301 HydrophobicContact CD2-CB 4.34Å; F221-A301 PolarHBondContact N-O 3.09Å; F221-A301 PolarHBondContact O-N 3.08Å; F221-L303 HydrophobicContact CE2-CB 4.35Å
222	L	98.6	Very high	95.5	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.6	-174.4	-52.8	96.6	0	0	0	112.9	I68 P90 W220 L255 F294 W298 W299 H300	I68-L222 HydrophobicContact CD1-CD1 3.46Å; I68-L222 VanDerWaalsContact CD1-CD1 3.46Å; I68-L222 HydrophobicContact CG1-CD1 4.39Å; P90-L222 HydrophobicContact CB-CD2 4.01Å; P90-L222 HydrophobicContact CG-CD2 4.22Å; W220-L222 HydrophobicContact CB-CD1 3.99Å; L222-L255 HydrophobicContact CB-CB 4.37Å; L222-L255 PolarHBondContact N-O 2.75Å; L222-L255 PolarHBondContact O-N 3.25Å; L222-F294 HydrophobicContact CD2-CB 3.84Å; L222-W298 HydrophobicContact CB-CE3 4.07Å; L222-W298 HydrophobicContact CB-CZ3 4.42Å; L222-W299 CarbonylContact C-O 3.56Å; L222-W299 WeakPolarHBondContact CA-O 3.11Å; L222-H300 HydrophobicContact CD2-CB 4.21Å; L222-H300 HydrophobicContact CG-CB 4.15Å
223	Y	98.4	Very high	95.1	Very high	7 Å²	7	45.1 Å²	45.1	3%	0.027	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.9	170	-65.3	-98.2	0	0	0	110.7	F203 R227 P229 E252 P254 W298 W299	F203-Y223 HydrophobicContact CD1-CD2 4.19Å; F203-Y223 HydrophobicContact CD1-CE2 4.46Å; F203-Y223 AromaticContact CE1-CD2 3.62Å; F203-Y223 HydrophobicContact CE1-CD2 3.62Å; F203-Y223 AromaticContact CE1-CE2 3.63Å; F203-Y223 HydrophobicContact CE1-CE2 3.63Å; F203-Y223 HydrophobicContact CE2-CE2 4.43Å; F203-Y223 HydrophobicContact CZ-CD2 4.12Å; F203-Y223 AromaticContact CZ-CE2 3.62Å; F203-Y223 HydrophobicContact CZ-CE2 3.62Å; Y223-R227 VanDerWaalsContact CB-O 3.28Å; Y223-R227 WeakPolarHBondContact CB-O 3.29Å; Y223-R227 HydrophobicContact CD1-CG 4.04Å; Y223-P229 HydrophobicContact CD2-CB 3.68Å; Y223-P229 HydrophobicContact CD2-CG 4.12Å; Y223-P229 HydrophobicContact CE2-CB 3.58Å; Y223-P229 HydrophobicContact CE2-CG 4.46Å; Y223-P229 HydrophobicContact CG-CB 4.33Å; Y223-E252 VanDerWaalsContact CE1-O 3.26Å; Y223-E252 WeakPolarHBondContact CE1-O 3.39Å; Y223-E252 PolarHBondContact OH-O 2.82Å; Y223-P254 HydrophobicContact CD2-CB 4.18Å; Y223-P254 HydrophobicContact CE1-CB 4.3Å; Y223-P254 HydrophobicContact CE2-CB 3.54Å; Y223-P254 HydrophobicContact CE2-CG 4.49Å; Y223-P254 WeakPolarHBondContact OH-CD 3.16Å; Y223-W298 VanDerWaalsContact C-CE3 3.4Å; Y223-W299 PolarHBondContact N-O 2.92Å; Y223-W299 PolarHBondContact O-N 3.09Å
224	P	97.9	Very high	94.5	Very high	36 Å²	36	48.2 Å²	48.2	23%	0.234	24%	0.236	C	C	.	.			trans	-64.3	157.6	173.4	30.2	-35.9	0	0	0	110.9	D226 R227 W298	P224-D226 WeakPolarHBondContact CB-OD1 3.33Å; P224-D226 PolarHBondContact O-N 3.24Å; P224-D226 VanDerWaalsContact O-N 3.12Å; P224-R227 HydrophobicContact CG-CB 3.87Å; P224-R227 PolarHBondContact O-N 2.8Å; P224-W298 HydrophobicContact CB-CH2 3.79Å; P224-W298 HydrophobicContact CB-CZ2 3.81Å; P224-W298 HydrophobicContact CB-CZ3 4.22Å
225	P	97.1	Very high	94.2	Very high	61 Å²	61	52.6 Å²	52.6	40%	0.396	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.1	-171.2	-24.9	33.3	0	0	0	114.8	R227 R297 W299	P225-R227 VanDerWaalsContact C-N 3.29Å; P225-R297 HydrophobicContact CB-CB 4.14Å; P225-R297 HydrophobicContact CG-CB 4.12Å; P225-W299 PolarHBondContact O-NE1 2.82Å
226	D	95.8	Very high	94.1	Very high	146 Å²	146	52 Å²	52	78%	0.781	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.7	-179.2	63.3	-38.1	0	0	0	113.8	P224	P224-D226 WeakPolarHBondContact CB-OD1 3.33Å; P224-D226 PolarHBondContact O-N 3.24Å; P224-D226 VanDerWaalsContact O-N 3.12Å
227	R	95.9	Very high	94.2	Very high	88 Å²	88	51.2 Å²	51.2	33%	0.332	24%	0.241	S	C	.	.	S	Bend	trans	-120.8	84.6	179.9	-172.4	171.4	156.8	-164.6	-19.2	110.8	Y223 P224 P225 A251 E252 A253	Y223-R227 VanDerWaalsContact CB-O 3.28Å; Y223-R227 WeakPolarHBondContact CB-O 3.29Å; Y223-R227 HydrophobicContact CD1-CG 4.04Å; P224-R227 HydrophobicContact CG-CB 3.87Å; P224-R227 PolarHBondContact O-N 2.8Å; P225-R227 VanDerWaalsContact C-N 3.29Å; R227-A251 PolarHBondContact NH1-O 2.8Å; R227-A251 VanDerWaalsContact NH1-O 3.08Å; R227-A251 PolarHBondContact NH2-O 3.18Å; R227-E252 PolarHBondContact NH2-O 2.81Å; R227-A253 PolarHBondContact NH2-O 2.98Å
228	E	95	Very high	94.3	Very high	142 Å²	142	49.6 Å²	49.6	66%	0.664	24%	0.237	S	C	*	.			trans	-62	126.1	175.9	-173.8	172	-177	0	0	111	W299	E228-W299 HydrophobicContact CB-CZ2 4.34Å; E228-W299 HydrophobicContact CG-CH2 4.3Å; E228-W299 HydrophobicContact CG-CZ2 3.87Å
229	P	95.4	Very high	94.2	Very high	8 Å²	8	49.8 Å²	49.8	5%	0.052	24%	0.239	C	C	.	.			trans	-72.2	154.4	177.6	26	-30.4	0	0	0	112	F203 Y223 F231 W299	F203-P229 HydrophobicContact CB-CG 3.59Å; F203-P229 HydrophobicContact CD1-CB 4.2Å; F203-P229 HydrophobicContact CD1-CG 3.72Å; F203-P229 HydrophobicContact CD2-CB 3.99Å; F203-P229 HydrophobicContact CD2-CG 3.94Å; F203-P229 HydrophobicContact CE1-CB 4.44Å; F203-P229 HydrophobicContact CE1-CG 4.4Å; F203-P229 HydrophobicContact CE2-CB 4.25Å; F203-P229 HydrophobicContact CG-CB 3.97Å; F203-P229 HydrophobicContact CG-CG 3.45Å; F203-P229 VanDerWaalsContact CG-CG 3.45Å; F203-P229 HydrophobicContact CZ-CB 4.46Å; Y223-P229 HydrophobicContact CD2-CB 3.68Å; Y223-P229 HydrophobicContact CD2-CG 4.12Å; Y223-P229 HydrophobicContact CE2-CB 3.58Å; Y223-P229 HydrophobicContact CE2-CG 4.46Å; Y223-P229 HydrophobicContact CG-CB 4.33Å; P229-F231 HydrophobicContact CB-CD1 4.33Å; P229-F231 HydrophobicContact CG-CD1 3.85Å; P229-F231 HydrophobicContact CG-CE1 4.05Å; P229-F231 WeakPolarHBondContact O-CD1 3.33Å; P229-F231 PolarHBondContact O-N 2.95Å; P229-W299 HydrophobicContact CG-CB 4.18Å; P229-W299 HydrophobicContact CG-CD2 4.25Å; P229-W299 HydrophobicContact CG-CE3 4.3Å; P229-W299 HydrophobicContact CG-CG 4.21Å
230	R	92.3	Very high	94.1	Very high	156 Å²	156	50.3 Å²	50.3	59%	0.589	24%	0.241	S	C	*	.			trans	-81.4	108.5	167.9	-65.3	-177.2	-175.2	155.6	15.4	109.5	W240 E252	R230-W240 PolarHBondContact O-NE1 2.89Å; R230-E252 IonicContact CZ-OE1 3.14Å; R230-E252 IonicContact CZ-OE2 3.84Å; R230-E252 IonicContact NE-OE2 3.52Å; R230-E252 PolarHBondContact NE-OE2 3.25Å; R230-E252 IonicContact NH1-OE1 3.76Å; R230-E252 IonicContact NH1-OE2 3.37Å; R230-E252 PolarHBondContact NH1-OE2 2.91Å; R230-E252 IonicContact NH2-OE1 2.76Å; R230-E252 PolarHBondContact NH2-OE1 2.96Å; R230-E252 IonicContact NH2-OE2 2.61Å; R230-E252 PolarHBondContact NH2-OE2 3.27Å
231	F	93.6	Very high	94	Very high	52 Å²	52	50.9 Å²	50.9	23%	0.228	24%	0.244	C	C	.	.			trans	-155.3	170	175.9	76.9	-71.1	0	0	0	111.2	P202 F203 P229 P233 W299	P202-F231 HydrophobicContact CB-CD2 4.2Å; P202-F231 HydrophobicContact CB-CE2 4.44Å; F203-F231 HydrophobicContact CB-CD1 3.77Å; F203-F231 HydrophobicContact CB-CD2 4.04Å; F203-F231 HydrophobicContact CB-CE1 3.74Å; F203-F231 HydrophobicContact CB-CE2 4Å; F203-F231 HydrophobicContact CB-CG 3.93Å; F203-F231 HydrophobicContact CB-CZ 3.85Å; F203-F231 HydrophobicContact CD2-CB 3.93Å; F203-F231 HydrophobicContact CD2-CD1 4.25Å; F203-F231 AromaticContact CD2-CG 3.99Å; F203-F231 HydrophobicContact CD2-CG 3.99Å; F203-F231 HydrophobicContact CG-CD1 4.39Å; F203-F231 HydrophobicContact CG-CG 4.44Å; F203-F231 WeakPolarHBondContact O-CE2 3.24Å; F203-F231 WeakPolarHBondContact O-CZ 3.18Å; P229-F231 HydrophobicContact CB-CD1 4.33Å; P229-F231 HydrophobicContact CG-CD1 3.85Å; P229-F231 HydrophobicContact CG-CE1 4.05Å; P229-F231 WeakPolarHBondContact O-CD1 3.33Å; P229-F231 PolarHBondContact O-N 2.95Å; F231-P233 HydrophobicContact CE2-CB 4.2Å; F231-W299 HydrophobicContact CE1-CZ3 4.12Å; F231-W299 HydrophobicContact CZ-CZ3 4.14Å
232	H	88.8	Confident	93.8	Very high	101 Å²	101	55 Å²	55	47%	0.468	27%	0.269	S	S	.	.			trans	-115	125.6	172.9	-174.4	-78.2	0	0	0	109.7	N234 R235	H232-N234 PolarHBondContact ND1-N 3.1Å; H232-N234 PolarHBondContact O-N 2.81Å; H232-N234 VanDerWaalsContact O-N 3.09Å; H232-R235 HydrophobicContact CB-CB 4.07Å; H232-R235 HydrophobicContact CB-CG 3.8Å; H232-R235 PolarHBondContact O-N 3.05Å
233	P	86.7	Confident	93.5	Very high	48 Å²	48	58.9 Å²	58.9	31%	0.312	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19	-167.7	24.4	-34.8	0	0	0	115.2	T127 F231	T127-P233 HydrophobicContact CG2-CB 4.43Å; T127-P233 PolarHBondContact N-O 3.42Å; T127-P233 VanDerWaalsContact N-O 3.15Å; T127-P233 WeakPolarHBondContact OG1-CA 3.46Å; T127-P233 PolarHBondContact OG1-O 3.27Å; F231-P233 HydrophobicContact CE2-CB 4.2Å
234	N	84.2	Confident	93.3	Very high	65 Å²	65	60.4 Å²	60.4	35%	0.348	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-6.6	175.4	-63.6	-38.8	0	0	0	114.2	G154 H232	G154-N234 PolarHBondContact N-O 3.39Å; G154-N234 VanDerWaalsContact N-O 3.11Å; H232-N234 PolarHBondContact ND1-N 3.1Å; H232-N234 PolarHBondContact O-N 2.81Å; H232-N234 VanDerWaalsContact O-N 3.09Å
235	R	87.8	Confident	93.2	Very high	92 Å²	92	61.2 Å²	61.2	35%	0.347	30%	0.299	S	S	.	.	S	Bend	trans	-87.9	149.7	176	-71.4	-167.6	72.5	176.2	10.2	109.4	P202 H232 S239 D243	P202-R235 WeakPolarHBondContact CG-O 3.29Å; H232-R235 HydrophobicContact CB-CB 4.07Å; H232-R235 HydrophobicContact CB-CG 3.8Å; H232-R235 PolarHBondContact O-N 3.05Å; R235-S239 PolarHBondContact NE-OG 2.8Å; R235-D243 IonicContact CZ-OD2 3.59Å; R235-D243 IonicContact NH1-OD2 3.71Å; R235-D243 IonicContact NH2-OD2 2.7Å; R235-D243 PolarHBondContact NH2-OD2 3.46Å
236	T	92.4	Very high	93.1	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.006	31%	0.307	C	S	.	.			trans	-76.7	154.4	-178.3	60.8	0	0	0	0	111	Q148 A152 G154 L238 S239 W240	Q148-T236 VanDerWaalsContact NE2-CB 3.33Å; Q148-T236 VanDerWaalsContact NE2-CG2 3.33Å; Q148-T236 PolarHBondContact NE2-OG1 2.67Å; A152-T236 WeakPolarHBondContact O-CG2 3.25Å; G154-T236 VanDerWaalsContact N-CG2 3.28Å; T236-L238 PolarHBondContact O-N 3.28Å; T236-S239 PolarHBondContact N-OG 2.95Å; T236-S239 PolarHBondContact O-N 2.83Å; T236-S239 VanDerWaalsContact O-N 3.13Å; T236-S239 PolarHBondContact O-OG 2.86Å; T236-S239 WeakPolarHBondContact OG1-CB 3.3Å; T236-S239 PolarHBondContact OG1-N 2.98Å; T236-S239 VanDerWaalsContact OG1-N 3.09Å; T236-S239 PolarHBondContact OG1-OG 2.86Å; T236-W240 PolarHBondContact O-N 3.21Å
237	T	95.1	Very high	93.1	Very high	3 Å²	3	62 Å²	62	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-56	-37.3	170.4	-48.6	0	0	0	0	111.4	V201 P202 F221 W240 L241 A301 T302 L303	V201-T237 PolarHBondContact O-OG1 3.47Å; P202-T237 WeakPolarHBondContact CA-OG1 3.24Å; F221-T237 HydrophobicContact CD2-CG2 4.12Å; F221-T237 HydrophobicContact CE2-CG2 3.97Å; T237-W240 PolarHBondContact O-N 3.02Å; T237-L241 WeakPolarHBondContact O-CB 3.47Å; T237-L241 PolarHBondContact O-N 2.99Å; T237-A301 HydrophobicContact CG2-CB 4.04Å; T237-T302 VanDerWaalsContact CB-O 3.24Å; T237-T302 WeakPolarHBondContact CB-O 3.42Å; T237-T302 WeakPolarHBondContact CG2-O 3.41Å; T237-T302 PolarHBondContact OG1-O 3.39Å; T237-L303 HydrophobicContact CG2-CB 4.17Å
238	L	95	Very high	93	Very high	18 Å²	18	59.1 Å²	59.1	9%	0.094	30%	0.296	C	S	.	.	H	α-helix	trans	-56.9	-51.1	175	-179.2	59.2	0	0	0	111.4	L60 Q148 T236 W240 L241 T242 L303	L60-L238 HydrophobicContact CD1-CD1 4Å; Q148-L238 HydrophobicContact CB-CD2 4.45Å; T236-L238 PolarHBondContact O-N 3.28Å; L238-W240 VanDerWaalsContact C-N 3.3Å; L238-W240 PolarHBondContact O-N 2.8Å; L238-L241 PolarHBondContact O-N 2.96Å; L238-L241 VanDerWaalsContact O-N 3.16Å; L238-T242 PolarHBondContact O-N 2.62Å; L238-T242 PolarHBondContact O-OG1 3.05Å; L238-T242 VanDerWaalsContact O-OG1 3.1Å; L238-L303 HydrophobicContact CB-CD1 4.04Å; L238-L303 HydrophobicContact CD1-CD1 4.48Å
239	S	94.4	Very high	93	Very high	11 Å²	11	55.3 Å²	55.3	8%	0.077	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-33.6	178.8	72.7	0	0	0	0	113.1	R235 T236 T242 D243	R235-S239 PolarHBondContact NE-OG 2.8Å; T236-S239 PolarHBondContact N-OG 2.95Å; T236-S239 PolarHBondContact O-N 2.83Å; T236-S239 VanDerWaalsContact O-N 3.13Å; T236-S239 PolarHBondContact O-OG 2.86Å; T236-S239 WeakPolarHBondContact OG1-CB 3.3Å; T236-S239 PolarHBondContact OG1-N 2.98Å; T236-S239 VanDerWaalsContact OG1-N 3.09Å; T236-S239 PolarHBondContact OG1-OG 2.86Å; S239-T242 PolarHBondContact O-N 3.06Å; S239-D243 VanDerWaalsContact O-CB 3.25Å; S239-D243 WeakPolarHBondContact O-CB 3.41Å; S239-D243 PolarHBondContact O-N 2.94Å
240	W	95.3	Very high	92.9	Very high	13 Å²	13	63.8 Å²	63.8	5%	0.049	32%	0.322	C	S	.	.	H	α-helix	trans	-66.7	-41.9	172.9	173.9	87.3	0	0	0	111.9	F203 F221 R230 T236 T237 L238 T242 T244 Y245 L248 P254	F203-W240 AromaticContact CE2-CD2 3.87Å; F203-W240 HydrophobicContact CE2-CD2 3.87Å; F203-W240 AromaticContact CE2-CE2 3.55Å; F203-W240 HydrophobicContact CE2-CE3 4.13Å; F203-W240 AromaticContact CE2-CH2 3.8Å; F203-W240 HydrophobicContact CE2-CH2 3.8Å; F203-W240 AromaticContact CE2-CZ2 3.52Å; F203-W240 HydrophobicContact CE2-CZ2 3.52Å; F203-W240 HydrophobicContact CE2-CZ3 4.11Å; F203-W240 AromaticContact CZ-CH2 3.71Å; F203-W240 HydrophobicContact CZ-CH2 3.71Å; F203-W240 AromaticContact CZ-CZ2 3.79Å; F203-W240 HydrophobicContact CZ-CZ2 3.79Å; F203-W240 HydrophobicContact CZ-CZ3 4.16Å; F221-W240 HydrophobicContact CD1-CH2 4.18Å; F221-W240 AromaticContact CD1-CZ3 3.9Å; F221-W240 HydrophobicContact CD1-CZ3 3.9Å; F221-W240 HydrophobicContact CD2-CZ3 4.13Å; F221-W240 HydrophobicContact CE1-CZ3 4.06Å; F221-W240 HydrophobicContact CE2-CZ3 4.3Å; F221-W240 HydrophobicContact CG-CH2 4.3Å; F221-W240 AromaticContact CG-CZ3 3.92Å; F221-W240 HydrophobicContact CG-CZ3 3.92Å; F221-W240 HydrophobicContact CZ-CZ3 4.26Å; R230-W240 PolarHBondContact O-NE1 2.89Å; T236-W240 PolarHBondContact O-N 3.21Å; T237-W240 PolarHBondContact O-N 3.02Å; L238-W240 VanDerWaalsContact C-N 3.3Å; L238-W240 PolarHBondContact O-N 2.8Å; W240-T242 VanDerWaalsContact C-N 3.29Å; W240-T242 PolarHBondContact O-N 2.04Å; W240-T244 WeakPolarHBondContact O-CA 3.06Å; W240-T244 WeakPolarHBondContact O-CB 3.07Å; W240-T244 PolarHBondContact O-N 2.84Å; W240-Y245 AromaticContact CH2-CD2 3.47Å; W240-Y245 HydrophobicContact CH2-CD2 3.47Å; W240-Y245 VanDerWaalsContact CH2-CD2 3.47Å; W240-Y245 HydrophobicContact CH2-CE2 4.26Å; W240-Y245 HydrophobicContact CH2-CG 4.28Å; W240-Y245 HydrophobicContact CZ2-CD2 4.2Å; W240-Y245 AromaticContact CZ3-CD2 3.81Å; W240-Y245 HydrophobicContact CZ3-CD2 3.81Å; W240-Y245 HydrophobicContact CZ3-CG 4.29Å; W240-Y245 PolarHBondContact O-N 2.84Å; W240-L248 HydrophobicContact CH2-CD1 4.41Å; W240-L248 HydrophobicContact CZ2-CD1 3.82Å; W240-P254 HydrophobicContact CH2-CG 4.3Å
241	L	95.5	Very high	92.9	Very high	20 Å²	20	60.4 Å²	60.4	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-64.7	-34.1	177.4	-178.9	62.6	0	0	0	111.8	F221 T237 L238 Y245 P246 L303	F221-L241 HydrophobicContact CE1-CD1 4.14Å; F221-L241 HydrophobicContact CZ-CD1 3.83Å; F221-L241 HydrophobicContact CZ-CD2 4.29Å; T237-L241 WeakPolarHBondContact O-CB 3.47Å; T237-L241 PolarHBondContact O-N 2.99Å; L238-L241 PolarHBondContact O-N 2.96Å; L238-L241 VanDerWaalsContact O-N 3.16Å; L241-Y245 HydrophobicContact CD1-CD1 3.52Å; L241-Y245 HydrophobicContact CD1-CD2 4.41Å; L241-Y245 HydrophobicContact CD1-CE1 4.11Å; L241-Y245 HydrophobicContact CD1-CG 3.69Å; L241-Y245 WeakPolarHBondContact O-CB 3.27Å; L241-P246 WeakPolarHBondContact O-CD 3.24Å; L241-L303 HydrophobicContact CD2-CD2 3.4Å; L241-L303 VanDerWaalsContact CD2-CD2 3.4Å
242	T	93.9	Very high	92.9	Very high	86 Å²	86	60.5 Å²	60.5	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-81.7	-42.4	178.8	-53.7	0	0	0	0	112.6	L238 S239 W240	L238-T242 PolarHBondContact O-N 2.62Å; L238-T242 PolarHBondContact O-OG1 3.05Å; L238-T242 VanDerWaalsContact O-OG1 3.1Å; S239-T242 PolarHBondContact O-N 3.06Å; W240-T242 VanDerWaalsContact C-N 3.29Å; W240-T242 PolarHBondContact O-N 2.04Å
243	D	94.1	Very high	93.2	Very high	83 Å²	83	57.6 Å²	57.6	44%	0.444	32%	0.322	S	S	.	.	H	α-helix	trans	-107.9	-8.9	-165.1	-56.7	-18.4	0	0	0	114.4	R235 S239	R235-D243 IonicContact CZ-OD2 3.59Å; R235-D243 IonicContact NH1-OD2 3.71Å; R235-D243 IonicContact NH2-OD2 2.7Å; R235-D243 PolarHBondContact NH2-OD2 3.46Å; S239-D243 VanDerWaalsContact O-CB 3.25Å; S239-D243 WeakPolarHBondContact O-CB 3.41Å; S239-D243 PolarHBondContact O-N 2.94Å
244	T	94.2	Very high	93.7	Very high	39 Å²	39	55.7 Å²	55.7	24%	0.239	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129	-46.9	-176.2	-56	0	0	0	0	111.7	W240 P246 D247 L248	W240-T244 WeakPolarHBondContact O-CA 3.06Å; W240-T244 WeakPolarHBondContact O-CB 3.07Å; W240-T244 PolarHBondContact O-N 2.84Å; T244-P246 VanDerWaalsContact C-CD 3.45Å; T244-D247 PolarHBondContact O-N 2.95Å; T244-L248 HydrophobicContact CG2-CD2 4.28Å; T244-L248 PolarHBondContact O-N 3.38Å
245	Y	95.4	Very high	94.4	Very high	52 Å²	52	55.4 Å²	55.4	20%	0.204	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-53.9	-43.6	-178.1	-177.6	-101.8	0	0	0	114.8	F221 W240 L241 D247 L248 P254 E256	F221-Y245 HydrophobicContact CD1-CE2 4.49Å; F221-Y245 HydrophobicContact CE1-CE2 4.32Å; W240-Y245 AromaticContact CH2-CD2 3.47Å; W240-Y245 HydrophobicContact CH2-CD2 3.47Å; W240-Y245 VanDerWaalsContact CH2-CD2 3.47Å; W240-Y245 HydrophobicContact CH2-CE2 4.26Å; W240-Y245 HydrophobicContact CH2-CG 4.28Å; W240-Y245 HydrophobicContact CZ2-CD2 4.2Å; W240-Y245 AromaticContact CZ3-CD2 3.81Å; W240-Y245 HydrophobicContact CZ3-CD2 3.81Å; W240-Y245 HydrophobicContact CZ3-CG 4.29Å; W240-Y245 PolarHBondContact O-N 2.84Å; L241-Y245 HydrophobicContact CD1-CD1 3.52Å; L241-Y245 HydrophobicContact CD1-CD2 4.41Å; L241-Y245 HydrophobicContact CD1-CE1 4.11Å; L241-Y245 HydrophobicContact CD1-CG 3.69Å; L241-Y245 WeakPolarHBondContact O-CB 3.27Å; Y245-D247 PolarHBondContact O-N 2.89Å; Y245-L248 HydrophobicContact CD2-CD1 4.06Å; Y245-L248 PolarHBondContact O-N 2.88Å; Y245-P254 HydrophobicContact CD2-CG 4.41Å; Y245-P254 HydrophobicContact CE2-CG 3.77Å; Y245-E256 PolarHBondContact OH-OE1 3.15Å; Y245-E256 PolarHBondContact OH-OE2 3.31Å
246	P	94.9	Very high	94.9	Very high	88 Å²	88	51.9 Å²	51.9	57%	0.571	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-64.8	-24.4	-177.1	-22.7	36.6	0	0	0	113.7	L241 T244	L241-P246 WeakPolarHBondContact O-CD 3.24Å; T244-P246 VanDerWaalsContact C-CD 3.45Å
247	D	95	Very high	95.1	Very high	135 Å²	135	52.2 Å²	52.2	72%	0.722	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-98.3	2	-177.4	-62.8	-43.3	0	0	0	112.9	T244 Y245	T244-D247 PolarHBondContact O-N 2.95Å; Y245-D247 PolarHBondContact O-N 2.89Å
248	L	94.4	Very high	95.2	Very high	29 Å²	29	52.2 Å²	52.2	15%	0.152	30%	0.298	C	S	.	.			trans	-68.5	132.1	178.5	-71.2	178.6	0	0	0	111	W240 T244 Y245 E252	W240-L248 HydrophobicContact CH2-CD1 4.41Å; W240-L248 HydrophobicContact CZ2-CD1 3.82Å; T244-L248 HydrophobicContact CG2-CD2 4.28Å; T244-L248 PolarHBondContact O-N 3.38Å; Y245-L248 HydrophobicContact CD2-CD1 4.06Å; Y245-L248 PolarHBondContact O-N 2.88Å; L248-E252 HydrophobicContact CD2-CB 4.5Å
249	P	94.8	Very high	95.1	Very high	61 Å²	61	51.4 Å²	51.4	40%	0.396	29%	0.294	S	S	.	.			trans	-55.4	147	166.9	-24	32.3	0	0	0	111	A251 E252 A253	P249-A251 PolarHBondContact O-N 2.97Å; P249-A251 VanDerWaalsContact O-N 3.12Å; P249-E252 HydrophobicContact CB-CB 4.3Å; P249-E252 HydrophobicContact CB-CG 4.28Å; P249-E252 HydrophobicContact CG-CB 4.42Å; P249-E252 HydrophobicContact CG-CG 4.23Å; P249-E252 CarbonylContact O-C 3.44Å; P249-E252 VanDerWaalsContact O-CA 3.3Å; P249-E252 WeakPolarHBondContact O-CA 3.34Å; P249-E252 WeakPolarHBondContact O-CB 3.4Å; P249-E252 PolarHBondContact O-N 3.18Å; P249-A253 PolarHBondContact O-N 2.96Å; P249-A253 VanDerWaalsContact O-N 3.11Å
250	Q	92.7	Very high	95	Very high	187 Å²	187	53.7 Å²	53.7	87%	0.874	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-55	-36.4	178.1	-173.9	-178.7	4.2	0	0	112.7	E252 A253	Q250-E252 PolarHBondContact O-N 3.46Å; Q250-A253 VanDerWaalsContact O-CB 3.31Å; Q250-A253 WeakPolarHBondContact O-CB 3.39Å; Q250-A253 PolarHBondContact O-N 3.32Å
251	A	93.3	Very high	94.5	Very high	84 Å²	84	54 Å²	54	69%	0.694	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-67.3	-22.2	175.7	0	0	0	0	0	113.2	R227 P249	R227-A251 PolarHBondContact NH1-O 2.8Å; R227-A251 VanDerWaalsContact NH1-O 3.08Å; R227-A251 PolarHBondContact NH2-O 3.18Å; P249-A251 PolarHBondContact O-N 2.97Å; P249-A251 VanDerWaalsContact O-N 3.12Å
252	E	93.9	Very high	93.1	Very high	54 Å²	54	53.7 Å²	53.7	25%	0.252	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-95.7	-3.1	176.9	-67.1	-171.4	-150	0	0	113.1	Y223 R227 R230 L248 P249 Q250	Y223-E252 VanDerWaalsContact CE1-O 3.26Å; Y223-E252 WeakPolarHBondContact CE1-O 3.39Å; Y223-E252 PolarHBondContact OH-O 2.82Å; R227-E252 PolarHBondContact NH2-O 2.81Å; R230-E252 IonicContact CZ-OE1 3.14Å; R230-E252 IonicContact CZ-OE2 3.84Å; R230-E252 IonicContact NE-OE2 3.52Å; R230-E252 PolarHBondContact NE-OE2 3.25Å; R230-E252 IonicContact NH1-OE1 3.76Å; R230-E252 IonicContact NH1-OE2 3.37Å; R230-E252 PolarHBondContact NH1-OE2 2.91Å; R230-E252 IonicContact NH2-OE1 2.76Å; R230-E252 PolarHBondContact NH2-OE1 2.96Å; R230-E252 IonicContact NH2-OE2 2.61Å; R230-E252 PolarHBondContact NH2-OE2 3.27Å; L248-E252 HydrophobicContact CD2-CB 4.5Å; P249-E252 HydrophobicContact CB-CB 4.3Å; P249-E252 HydrophobicContact CB-CG 4.28Å; P249-E252 HydrophobicContact CG-CB 4.42Å; P249-E252 HydrophobicContact CG-CG 4.23Å; P249-E252 CarbonylContact O-C 3.44Å; P249-E252 VanDerWaalsContact O-CA 3.3Å; P249-E252 WeakPolarHBondContact O-CA 3.34Å; P249-E252 WeakPolarHBondContact O-CB 3.4Å; P249-E252 PolarHBondContact O-N 3.18Å; Q250-E252 PolarHBondContact O-N 3.46Å
253	A	95.1	Very high	91.2	Very high	40 Å²	40	53.2 Å²	53.2	33%	0.331	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-60.6	139	176.3	0	0	0	0	0	112.1	R227 P249 Q250	R227-A253 PolarHBondContact NH2-O 2.98Å; P249-A253 PolarHBondContact O-N 2.96Å; P249-A253 VanDerWaalsContact O-N 3.11Å; Q250-A253 VanDerWaalsContact O-CB 3.31Å; Q250-A253 WeakPolarHBondContact O-CB 3.39Å; Q250-A253 PolarHBondContact O-N 3.32Å
254	P	97.4	Very high	88.8	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.058	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-71.9	163.8	175.6	31.8	-35.8	0	0	0	111.7	F221 Y223 W240 Y245	F221-P254 HydrophobicContact CB-CB 4.16Å; F221-P254 HydrophobicContact CB-CG 4.31Å; F221-P254 HydrophobicContact CD1-CG 3.91Å; Y223-P254 HydrophobicContact CD2-CB 4.18Å; Y223-P254 HydrophobicContact CE1-CB 4.3Å; Y223-P254 HydrophobicContact CE2-CB 3.54Å; Y223-P254 HydrophobicContact CE2-CG 4.49Å; Y223-P254 WeakPolarHBondContact OH-CD 3.16Å; W240-P254 HydrophobicContact CH2-CG 4.3Å; Y245-P254 HydrophobicContact CD2-CG 4.41Å; Y245-P254 HydrophobicContact CE2-CG 3.77Å
255	L	98.3	Very high	86.3	Confident	59 Å²	59	54.4 Å²	54.4	31%	0.309	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133	151.6	-64.5	-177.1	0	0	0	108	S67 I68 P90 F221 L222 W298	S67-L255 WeakPolarHBondContact OG-CA 3.4Å; I68-L255 HydrophobicContact CG1-CB 4.12Å; P90-L255 HydrophobicContact CG-CD1 3.68Å; F221-L255 CarbonylContact C-O 3.55Å; F221-L255 WeakPolarHBondContact CA-O 3Å; L222-L255 HydrophobicContact CB-CB 4.37Å; L222-L255 PolarHBondContact N-O 2.75Å; L222-L255 PolarHBondContact O-N 3.25Å; L255-W298 HydrophobicContact CD1-CH2 4.11Å; L255-W298 HydrophobicContact CD1-CZ3 3.84Å
256	E	97.9	Very high	83.5	Confident	18 Å²	18	62.1 Å²	62.1	8%	0.084	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	153.4	179.4	62.8	166.1	174.5	0	0	112.1	G65 C66 S67 R219 W220 F221 Y245	G65-E256 PolarHBondContact N-OE1 3.04Å; C66-E256 CarbonylContact C-O 3.48Å; C66-E256 VanDerWaalsContact CA-O 3.29Å; C66-E256 WeakPolarHBondContact CA-O 3.48Å; S67-E256 PolarHBondContact N-O 2.75Å; S67-E256 PolarHBondContact OG-N 2.89Å; S67-E256 PolarHBondContact OG-O 2.92Å; R219-E256 IonicContact CZ-OE2 3.58Å; R219-E256 VanDerWaalsContact CZ-OE2 3.29Å; R219-E256 IonicContact NE-OE2 3.98Å; R219-E256 PolarHBondContact NE-OE2 3.31Å; R219-E256 VanDerWaalsContact NE-OE2 3.07Å; R219-E256 IonicContact NH2-OE1 3.62Å; R219-E256 IonicContact NH2-OE2 2.81Å; R219-E256 PolarHBondContact NH2-OE2 3.08Å; W220-E256 WeakPolarHBondContact O-CA 3.3Å; W220-E256 WeakPolarHBondContact O-CB 3.36Å; F221-E256 HydrophobicContact CD1-CB 3.95Å; F221-E256 HydrophobicContact CE1-CB 4.35Å; F221-E256 WeakPolarHBondContact CE1-OE2 3.43Å; Y245-E256 PolarHBondContact OH-OE1 3.15Å; Y245-E256 PolarHBondContact OH-OE2 3.31Å
257	C	96.9	Very high	80.8	Confident	7 Å²	7	62 Å²	62	5%	0.047	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	152	164.7	-162.3	0	0	0	0	110.6	C66 I68 I92 W220	C66-C257 HydrophobicContact CB-CB 3.93Å; C66-C257 WeakPolarHBondContact CB-SG 3.45Å; C66-C257 WeakPolarHBondContact SG-CB 3.16Å; C66-C257 CovalentContact SG-SG 2.04Å; C66-C257 PolarHBondContact SG-SG 3.47Å; I68-C257 HydrophobicContact CB-CB 4.34Å; I68-C257 HydrophobicContact CD1-CB 3.77Å; I68-C257 HydrophobicContact CG1-CB 4.19Å; I92-C257 HydrophobicContact CD1-CB 3.49Å; I92-C257 VanDerWaalsContact CD1-CB 3.49Å; I92-C257 WeakPolarHBondContact CD1-SG 3.43Å; W220-C257 PolarHBondContact N-O 3.38Å; W220-C257 PolarHBondContact O-N 3.04Å
258	T	96.5	Very high	78.2	Confident	4 Å²	4	67.7 Å²	67.7	3%	0.025	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	111.5	170.9	-69.3	0	0	0	0	111.1	E63 R217 R219 R260 L305	E63-T258 HydrophobicContact CB-CG2 4.38Å; E63-T258 HydrophobicContact CG-CG2 4.48Å; E63-T258 PolarHBondContact O-OG1 3.37Å; R217-T258 HydrophobicContact CB-CG2 3.9Å; R219-T258 WeakPolarHBondContact CB-OG1 3.29Å; R219-T258 WeakPolarHBondContact CG-OG1 3.49Å; T258-R260 PolarHBondContact O-NH2 3.3Å; T258-L305 HydrophobicContact CG2-CD1 3.7Å
259	V	94.4	Very high	75.6	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.006	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.6	177.3	-176.6	0	0	0	0	109.8	V213 K218 Q290 L292	V213-V259 HydrophobicContact CB-CG1 4.48Å; V213-V259 HydrophobicContact CG2-CB 4.15Å; V213-V259 HydrophobicContact CG2-CG1 3.95Å; K218-V259 PolarHBondContact N-O 2.92Å; K218-V259 PolarHBondContact O-N 2.92Å; V259-Q290 HydrophobicContact CG1-CB 3.95Å; V259-L292 HydrophobicContact CG2-CB 4.05Å
260	R	90.3	Very high	73	Confident	59 Å²	59	79 Å²	79	22%	0.223	40%	0.398	C	S	.	.			trans	-145.2	157.3	-177.3	69.1	-163.9	71.8	-170.1	-0.2	112.8	E63 R217 T258 G262	E63-R260 IonicContact OE1-CZ 2.65Å; E63-R260 IonicContact OE1-NH1 2.76Å; E63-R260 PolarHBondContact OE1-NH1 2.96Å; E63-R260 IonicContact OE1-NH2 3.98Å; E63-R260 IonicContact OE2-CZ 3.62Å; E63-R260 IonicContact OE2-NH1 3.56Å; E63-R260 PolarHBondContact OE2-NH1 3.13Å; E63-R260 IonicContact OE2-NH2 2.81Å; E63-R260 PolarHBondContact OE2-NH2 3.26Å; R217-R260 HydrophobicContact CG-CB 4.14Å; T258-R260 PolarHBondContact O-NH2 3.3Å; R260-G262 PolarHBondContact O-N 2.76Å
261	P	85.6	Confident	70.4	Confident	19 Å²	19	76.3 Å²	76.3	12%	0.123	39%	0.386	C	S	.	.	S	Bend	trans	-74.3	106.5	171.1	28.4	-30.5	0	0	0	109.6	V213 I214 G216	V213-P261 WeakPolarHBondContact O-CB 2.96Å; I214-P261 WeakPolarHBondContact O-CB 3.46Å; G216-P261 WeakPolarHBondContact O-CD 3.46Å
262	G	65.9	Low	67.8	Low	13 Å²	13	81.4 Å²	81.4	13%	0.134	39%	0.392	C	S	.	.			trans	77.8	97.7	167.4	0	0	0	0	0	115.1	R260 V288	R260-G262 PolarHBondContact O-N 2.76Å; G262-V288 WeakPolarHBondContact CA-O 3.23Å
263	E	54	Low	65.3	Low	77 Å²	77	87 Å²	87	36%	0.36	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-72.8	134.8	150.8	-82.4	176.8	171.9	0	0	108.5	R94 S265 V288 Q290	R94-E263 IonicContact NH1-OE2 3.66Å; E263-S265 PolarHBondContact O-N 2.84Å; E263-V288 PolarHBondContact N-O 2.89Å; E263-V288 PolarHBondContact O-N 2.68Å; E263-Q290 VanDerWaalsContact CD-NE2 3.25Å; E263-Q290 PolarHBondContact OE1-NE2 3.19Å
264	V	44.8	Very low	62.9	Low	69 Å²	69	90.1 Å²	90.1	42%	0.418	44%	0.435	S	S	.	.			trans	-68.5	100.8	164.1	-179	0	0	0	0	106.4	W266	V264-W266 VanDerWaalsContact C-N 3.3Å; V264-W266 HydrophobicContact CG1-CD2 4.23Å; V264-W266 HydrophobicContact CG1-CG 4.42Å; V264-W266 HydrophobicContact CG1-CZ2 4.41Å; V264-W266 PolarHBondContact O-N 3.47Å
265	S	40.4	Very low	60.3	Low	77 Å²	77	99.4 Å²	99.4	54%	0.538	48%	0.475	S	S	.	.			trans	-70.2	92.8	166.5	60.3	0	0	0	0	107.8	E263 P267	E263-S265 PolarHBondContact O-N 2.84Å; S265-P267 WeakPolarHBondContact O-CD 3.48Å
266	W	36.9	Very low	57.8	Low	214 Å²	214	100.6 Å²	100.6	81%	0.811	50%	0.501	S	S	*	.			trans	-60.1	125.3	164.3	-70	104.2	0	0	0	107.7	V264 R268	V264-W266 VanDerWaalsContact C-N 3.3Å; V264-W266 HydrophobicContact CG1-CD2 4.23Å; V264-W266 HydrophobicContact CG1-CG 4.42Å; V264-W266 HydrophobicContact CG1-CZ2 4.41Å; V264-W266 PolarHBondContact O-N 3.47Å; W266-R268 PolarHBondContact O-N 2.72Å
267	P	37.5	Very low	55.2	Low	86 Å²	86	105.5 Å²	105.5	56%	0.558	53%	0.532	S	S	*	.			trans	-54.7	131.8	171	-21.3	30.9	0	0	0	108.9	S265 F269	S265-P267 WeakPolarHBondContact O-CD 3.48Å; P267-F269 PolarHBondContact O-N 2.98Å
268	R	40.6	Very low	52.7	Low	255 Å²	255	115.4 Å²	115.4	96%	0.962	58%	0.575	S	S	*	*	S	Bend	trans	-68.4	27.8	172.2	-76.1	-171.1	170.5	-156.9	-0.1	113.3	W266	W266-R268 PolarHBondContact O-N 2.72Å
269	F	39.6	Very low	50	Low	169 Å²	169	121.9 Å²	121.9	74%	0.741	61%	0.609	S	S	*	*			trans	-123.2	92	-178.7	-111.5	-93.5	0	0	0	110.8	P267 Q271	P267-F269 PolarHBondContact O-N 2.98Å; F269-Q271 VanDerWaalsContact C-N 3.29Å; F269-Q271 HydrophobicContact CD1-CG 4.5Å; F269-Q271 PolarHBondContact O-N 2.7Å; F269-Q271 VanDerWaalsContact O-N 3.16Å
270	I	41.5	Very low	47.4	Very low	158 Å²	158	126.3 Å²	126.3	81%	0.81	64%	0.64	S	S	*	*			trans	-77.3	89.8	154.8	-58.3	178.9	0	0	0	106	K272	I270-K272 HydrophobicContact CG2-CG 4.41Å; I270-K272 PolarHBondContact O-N 2.66Å; I270-K272 VanDerWaalsContact O-N 3.13Å
271	Q	37.8	Very low	44.9	Very low	131 Å²	131	128.5 Å²	128.5	61%	0.612	66%	0.659	S	S	*	*			trans	-73.3	103.5	164.5	-135.4	175.4	9.8	0	0	107	F269 F273	F269-Q271 VanDerWaalsContact C-N 3.29Å; F269-Q271 HydrophobicContact CD1-CG 4.5Å; F269-Q271 PolarHBondContact O-N 2.7Å; F269-Q271 VanDerWaalsContact O-N 3.16Å; Q271-F273 HydrophobicContact CB-CD2 4.31Å; Q271-F273 HydrophobicContact CB-CE2 4.17Å; Q271-F273 HydrophobicContact CG-CE2 4.24Å; Q271-F273 PolarHBondContact O-N 2.77Å
272	K	37.8	Very low	42.8	Very low	191 Å²	191	135.4 Å²	135.4	83%	0.83	69%	0.694	S	S	*	*			trans	-63.7	96.5	170	-77	-176.1	178	179.2	0	108.2	I270 S274	I270-K272 HydrophobicContact CG2-CG 4.41Å; I270-K272 PolarHBondContact O-N 2.66Å; I270-K272 VanDerWaalsContact O-N 3.13Å; K272-S274 PolarHBondContact O-N 3.26Å
273	F	42	Very low	41.6	Very low	172 Å²	172	139.2 Å²	139.2	75%	0.754	72%	0.715	S	S	*	*			trans	-79.5	108.6	162	-85.4	-83.8	0	0	0	108.4	Q271	Q271-F273 HydrophobicContact CB-CD2 4.31Å; Q271-F273 HydrophobicContact CB-CE2 4.17Å; Q271-F273 HydrophobicContact CG-CE2 4.24Å; Q271-F273 PolarHBondContact O-N 2.77Å
274	S	44.5	Very low	40.9	Very low	105 Å²	105	142.6 Å²	142.6	73%	0.734	74%	0.736	S	S	*	*			trans	-66.2	134	167.5	-67.1	0	0	0	0	109.2	K272	K272-S274 PolarHBondContact O-N 3.26Å
275	F	42.7	Very low	40.9	Very low	204 Å²	204	142.3 Å²	142.3	90%	0.895	74%	0.737	S	S	*	*	S	Bend	trans	79.2	90.5	174.9	-76.4	-94.7	0	0	0	117.8	V277	F275-V277 PolarHBondContact O-N 2.84Å
276	G	46.4	Very low	41.5	Very low	83 Å²	83	142.3 Å²	142.3	86%	0.856	74%	0.737	S	S	*	*	S	Bend		90.1	-0.1	119.3	0	0	0	0	0	119.1
277	V	43.1	Very low	42.6	Very low	122 Å²	122	134 Å²	134	74%	0.739	71%	0.708	S	S	*	*			trans	-137.5	106.1	168.8	-175.5	0	0	0	0	108.6	F275 L279	F275-V277 PolarHBondContact O-N 2.84Å; V277-L279 VanDerWaalsContact C-N 3.27Å; V277-L279 HydrophobicContact CG1-CB 4.47Å; V277-L279 PolarHBondContact O-N 3.3Å
278	F	44.1	Very low	44.3	Very low	214 Å²	214	131 Å²	131	94%	0.939	69%	0.688	S	S	*	*			trans	-73.8	88.7	161.8	-99.8	-89.6	0	0	0	107.1	S280	F278-S280 PolarHBondContact O-N 3.09Å
279	L	40.5	Very low	46.4	Very low	141 Å²	141	119.4 Å²	119.4	74%	0.738	64%	0.644	S	S	*	*			trans	-85.5	100	157.2	-162.8	77.2	0	0	0	105.7	V277 V281	V277-L279 VanDerWaalsContact C-N 3.27Å; V277-L279 HydrophobicContact CG1-CB 4.47Å; V277-L279 PolarHBondContact O-N 3.3Å; L279-V281 VanDerWaalsContact C-N 3.3Å; L279-V281 PolarHBondContact O-N 2.77Å
280	S	39.7	Very low	48.9	Very low	94 Å²	94	111.7 Å²	111.7	66%	0.657	61%	0.611	S	S	*	*			trans	-63.1	98.3	165	57.5	0	0	0	0	107	F278 L282	F278-S280 PolarHBondContact O-N 3.09Å; S280-L282 VanDerWaalsContact C-N 3.33Å; S280-L282 PolarHBondContact O-N 2.65Å
281	V	37.8	Very low	51.4	Low	104 Å²	104	104.2 Å²	104.2	63%	0.63	57%	0.572	S	S	*	*			trans	-67.3	103.6	162.1	-179.2	0	0	0	0	104.6	L279 T283	L279-V281 VanDerWaalsContact C-N 3.3Å; L279-V281 PolarHBondContact O-N 2.77Å; V281-T283 HydrophobicContact CG1-CG2 3.66Å; V281-T283 PolarHBondContact O-N 3.18Å
282	L	42.1	Very low	54.3	Low	164 Å²	164	98 Å²	98	86%	0.859	54%	0.543	S	S	*	.			trans	-66.5	84.4	162.7	-67.9	171.6	0	0	0	105.8	S280 D284	S280-L282 VanDerWaalsContact C-N 3.33Å; S280-L282 PolarHBondContact O-N 2.65Å; L282-D284 PolarHBondContact O-N 3.23Å
283	T	40.5	Very low	57.2	Low	94 Å²	94	88.9 Å²	88.9	58%	0.577	50%	0.504	S	S	*	.			trans	-69.3	115.6	163.1	51.4	0	0	0	0	105.8	V281 S285	V281-T283 HydrophobicContact CG1-CG2 3.66Å; V281-T283 PolarHBondContact O-N 3.18Å; T283-S285 PolarHBondContact O-N 3.43Å
284	D	38.7	Very low	59.9	Low	148 Å²	148	80.8 Å²	80.8	79%	0.791	47%	0.468	S	S	*	.			trans	-27.3	105.6	170	-167.4	6.6	0	0	0	110.8	L282 S286	L282-D284 PolarHBondContact O-N 3.23Å; D284-S286 PolarHBondContact O-N 3.45Å
285	S	45.7	Very low	62.4	Low	63 Å²	63	75.8 Å²	75.8	44%	0.441	43%	0.433	S	S	.	.			trans	-75.8	73.6	174.2	58.9	0	0	0	0	106.9	T283 L287	T283-S285 PolarHBondContact O-N 3.43Å; S285-L287 PolarHBondContact O-N 3.21Å
286	S	51.7	Low	65	Low	76 Å²	76	69 Å²	69	53%	0.531	41%	0.406	S	S	.	.			trans	-60.2	111.3	171.6	61.5	0	0	0	0	106.9	D284 V288	D284-S286 PolarHBondContact O-N 3.45Å; S286-V288 PolarHBondContact O-N 3.28Å
287	L	61.5	Low	67.4	Low	40 Å²	40	72 Å²	72	21%	0.209	39%	0.392	C	S	.	.			trans	-52.9	110.3	175.4	-71.5	169	0	0	0	108.6	A47 S285 R289	A47-L287 HydrophobicContact CB-CD1 3.43Å; A47-L287 VanDerWaalsContact CB-CD1 3.43Å; A47-L287 HydrophobicContact CB-CD2 4.09Å; A47-L287 HydrophobicContact CB-CG 4.41Å; S285-L287 PolarHBondContact O-N 3.21Å; L287-R289 PolarHBondContact O-N 3.07Å
288	V	72.1	Confident	70	Confident	23 Å²	23	67.1 Å²	67.1	14%	0.139	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-76.8	97.1	177.4	-176.3	0	0	0	0	108.2	R94 G262 E263 S286	R94-V288 HydrophobicContact CB-CG1 3.67Å; R94-V288 HydrophobicContact CG-CG1 4.3Å; G262-V288 WeakPolarHBondContact CA-O 3.23Å; E263-V288 PolarHBondContact N-O 2.89Å; E263-V288 PolarHBondContact O-N 2.68Å; S286-V288 PolarHBondContact O-N 3.28Å
289	R	84.1	Confident	72.6	Confident	11 Å²	11	58.5 Å²	58.5	4%	0.042	32%	0.321	C	S	.	.			trans	-65.5	142.8	-178.1	-68.7	-175.5	176.2	80.2	7.4	111.2	R94 G95 D98 T100 E212 L287	R94-R289 CarbonylContact C-O 3.5Å; R94-R289 VanDerWaalsContact CA-O 3.3Å; R94-R289 WeakPolarHBondContact CA-O 3.35Å; G95-R289 PolarHBondContact N-O 3.22Å; D98-R289 IonicContact OD1-NH1 2.66Å; T100-R289 VanDerWaalsContact CA-NH2 3.26Å; T100-R289 PolarHBondContact OG1-NH1 2.88Å; T100-R289 PolarHBondContact OG1-NH2 2.92Å; E212-R289 WeakPolarHBondContact OE1-CD 3.21Å; L287-R289 PolarHBondContact O-N 3.07Å
290	Q	92.2	Very high	75.4	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.037	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133	176.3	-67.3	175.6	0.6	0	0	109.7	I92 R94 V259 E263	I92-Q290 HydrophobicContact CG2-CB 4Å; I92-Q290 HydrophobicContact CG2-CG 4.17Å; R94-Q290 HydrophobicContact CG-CG 3.99Å; V259-Q290 HydrophobicContact CG1-CB 3.95Å; E263-Q290 VanDerWaalsContact CD-NE2 3.25Å; E263-Q290 PolarHBondContact OE1-NE2 3.19Å
291	V	95.6	Very high	78.1	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.4	171.2	-179.2	0	0	0	0	108.4	I92 I93 V96 P179 F210 E212	I92-V291 CarbonylContact C-O 3.57Å; I92-V291 WeakPolarHBondContact CA-O 2.96Å; I93-V291 PolarHBondContact N-O 3.11Å; I93-V291 PolarHBondContact O-N 3.42Å; V96-V291 HydrophobicContact CG1-CB 4.48Å; V96-V291 HydrophobicContact CG1-CG2 4.02Å; P179-V291 HydrophobicContact CG-CB 4.44Å; P179-V291 HydrophobicContact CG-CG1 3.69Å; P179-V291 HydrophobicContact CG-CG2 4.29Å; F210-V291 HydrophobicContact CB-CG1 3.84Å; F210-V291 HydrophobicContact CD1-CG1 3.85Å; F210-V291 HydrophobicContact CG-CG1 4.27Å; E212-V291 HydrophobicContact CB-CG2 4.19Å; E212-V291 HydrophobicContact CG-CG2 4.07Å
292	L	98	Very high	80.9	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	131.5	169.3	173.5	68.3	0	0	0	109.7	I68 P90 I92 F210 S211 W220 V259	I68-L292 HydrophobicContact CD1-CD1 3.96Å; I68-L292 HydrophobicContact CG2-CD1 4.39Å; P90-L292 HydrophobicContact CB-CD1 4.3Å; I92-L292 HydrophobicContact CG1-CD1 4.05Å; F210-L292 CarbonylContact C-O 3.57Å; F210-L292 WeakPolarHBondContact CA-O 3.42Å; S211-L292 PolarHBondContact N-O 3.09Å; S211-L292 PolarHBondContact O-N 3.29Å; W220-L292 HydrophobicContact CB-CD2 3.98Å; W220-L292 HydrophobicContact CD2-CD2 3.2Å; W220-L292 HydrophobicContact CE3-CD2 3.43Å; W220-L292 VanDerWaalsContact CE3-CD2 3.43Å; W220-L292 HydrophobicContact CG-CD2 3.46Å; W220-L292 VanDerWaalsContact CG-CD2 3.46Å; W220-L292 HydrophobicContact CH2-CD2 4.44Å; W220-L292 HydrophobicContact CZ2-CD2 4.29Å; W220-L292 HydrophobicContact CZ3-CD2 4.03Å; V259-L292 HydrophobicContact CG2-CB 4.05Å
293	Y	98.5	Very high	83.5	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	135.5	159.8	177.8	-106	0	0	0	110.4	F81 F85 A86 P90 V91 P208 G209 F210 P295 L315	F81-Y293 AromaticContact CE2-CD1 3.71Å; F81-Y293 HydrophobicContact CE2-CD1 3.71Å; F81-Y293 AromaticContact CE2-CD2 3.91Å; F81-Y293 HydrophobicContact CE2-CD2 3.91Å; F81-Y293 AromaticContact CE2-CE1 3.88Å; F81-Y293 HydrophobicContact CE2-CE1 3.88Å; F81-Y293 HydrophobicContact CE2-CE2 4.07Å; F81-Y293 AromaticContact CE2-CG 3.72Å; F81-Y293 HydrophobicContact CE2-CG 3.72Å; F81-Y293 HydrophobicContact CZ-CD1 4.16Å; F81-Y293 AromaticContact CZ-CD2 3.83Å; F81-Y293 HydrophobicContact CZ-CD2 3.83Å; F81-Y293 AromaticContact CZ-CE1 3.93Å; F81-Y293 HydrophobicContact CZ-CE1 3.93Å; F81-Y293 AromaticContact CZ-CE2 3.58Å; F81-Y293 HydrophobicContact CZ-CE2 3.58Å; F81-Y293 HydrophobicContact CZ-CG 4.1Å; F81-Y293 AromaticContact CZ-CZ 3.62Å; F85-Y293 HydrophobicContact CB-CD1 4.49Å; A86-Y293 WeakPolarHBondContact CA-OH 3.39Å; A86-Y293 PolarHBondContact O-OH 3.13Å; P90-Y293 WeakPolarHBondContact CA-O 3.46Å; P90-Y293 VanDerWaalsContact CB-O 3.24Å; P90-Y293 WeakPolarHBondContact CB-O 3.26Å; V91-Y293 HydrophobicContact CG1-CD1 4.39Å; V91-Y293 PolarHBondContact N-O 3.03Å; V91-Y293 PolarHBondContact O-N 3.32Å; P208-Y293 HydrophobicContact CB-CE2 4.18Å; P208-Y293 WeakPolarHBondContact CB-OH 3.15Å; G209-Y293 WeakPolarHBondContact O-CA 3.29Å; G209-Y293 WeakPolarHBondContact O-CD2 3.28Å; F210-Y293 AromaticContact CD1-CD2 3.79Å; F210-Y293 HydrophobicContact CD1-CD2 3.79Å; F210-Y293 HydrophobicContact CD1-CG 4.28Å; F210-Y293 HydrophobicContact CD2-CD2 4.41Å; F210-Y293 AromaticContact CE1-CD2 3.4Å; F210-Y293 HydrophobicContact CE1-CD2 3.4Å; F210-Y293 HydrophobicContact CE1-CE2 4.39Å; F210-Y293 AromaticContact CE1-CG 3.84Å; F210-Y293 HydrophobicContact CE1-CG 3.84Å; F210-Y293 HydrophobicContact CE2-CD2 4.08Å; F210-Y293 HydrophobicContact CE2-CE2 4.43Å; F210-Y293 HydrophobicContact CG-CD2 4.26Å; F210-Y293 AromaticContact CZ-CD2 3.52Å; F210-Y293 HydrophobicContact CZ-CD2 3.52Å; F210-Y293 HydrophobicContact CZ-CE2 4.08Å; F210-Y293 HydrophobicContact CZ-CG 4.3Å; Y293-P295 HydrophobicContact CE1-CB 4.23Å; Y293-P295 HydrophobicContact CE1-CG 3.96Å; Y293-L315 HydrophobicContact CE2-CD1 4.24Å
294	F	98.3	Very high	86.2	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.9	167.9	56.6	-92.8	0	0	0	110.6	H206 G207 P208 G209 W220 L222 F314	H206-F294 AromaticContact CE1-CE2 3.38Å; H206-F294 WeakPolarHBondContact CE1-CE2 3.44Å; H206-F294 AromaticContact CE1-CZ 3.63Å; H206-F294 AromaticContact ND1-CE2 3.8Å; G207-F294 WeakPolarHBondContact O-CE2 2.88Å; P208-F294 WeakPolarHBondContact CA-O 3.4Å; G209-F294 PolarHBondContact N-O 3.29Å; G209-F294 VanDerWaalsContact N-O 3.09Å; G209-F294 WeakPolarHBondContact O-CD1 3.13Å; G209-F294 PolarHBondContact O-N 2.81Å; W220-F294 HydrophobicContact CH2-CD1 4.32Å; W220-F294 HydrophobicContact CH2-CE1 4.05Å; W220-F294 HydrophobicContact CZ3-CD1 4.06Å; W220-F294 HydrophobicContact CZ3-CE1 4.17Å; L222-F294 HydrophobicContact CD2-CB 3.84Å; F294-F314 HydrophobicContact CZ-CD1 4.39Å; F294-F314 HydrophobicContact CZ-CE1 4.08Å
295	P	98	Very high	88.8	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.006	12%	0.123	C	C	.	.			trans	-74.6	171	179.5	-12.1	26.4	0	0	0	113.5	R89 Y293 W298	R89-P295 VanDerWaalsContact C-CG 3.46Å; Y293-P295 HydrophobicContact CE1-CB 4.23Å; Y293-P295 HydrophobicContact CE1-CG 3.96Å; P295-W298 VanDerWaalsContact CB-CD1 3.49Å; P295-W298 HydrophobicContact CB-CG 4.35Å; P295-W298 HydrophobicContact CG-CD2 4.45Å; P295-W298 HydrophobicContact CG-CG 4.19Å; P295-W298 PolarHBondContact O-N 3.24Å
296	D	97	Very high	91.1	Very high	60 Å²	60	22.6 Å²	22.6	32%	0.321	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	137.5	176.5	-168.8	27.3	0	0	0	111.6	G207 P208 W298	G207-D296 WeakPolarHBondContact CA-OD1 3.26Å; P208-D296 HydrophobicContact CG-CB 4.24Å; D296-W298 PolarHBondContact O-N 3.25Å; D296-W298 VanDerWaalsContact O-N 3.07Å
297	R	96.8	Very high	93.1	Very high	147 Å²	147	19.2 Å²	19.2	56%	0.555	9%	0.088	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	10	177.3	-56.2	-173.1	176.5	-174.3	-3.3	116.6	W205 H206 P225 W299	W205-R297 HydrophobicContact CE3-CB 4.27Å; W205-R297 HydrophobicContact CE3-CG 3.9Å; W205-R297 HydrophobicContact CZ3-CG 4.09Å; H206-R297 PolarHBondContact O-N 2.92Å; P225-R297 HydrophobicContact CB-CB 4.14Å; P225-R297 HydrophobicContact CG-CB 4.12Å; R297-W299 PolarHBondContact O-N 2.83Å
298	W	98.2	Very high	94.7	Very high	19 Å²	19	17.3 Å²	17.3	7%	0.072	8%	0.078	C	C	.	.			trans	-66.9	128.1	171.6	-86.4	64.3	0	0	0	110	S88 R89 P90 W205 L222 Y223 P224 L255 P295 D296 H300	S88-W298 WeakPolarHBondContact O-CZ2 3.47Å; S88-W298 PolarHBondContact O-NE1 2.98Å; R89-W298 HydrophobicContact CB-CH2 4.33Å; R89-W298 HydrophobicContact CB-CZ2 4.09Å; P90-W298 VanDerWaalsContact CD-CH2 3.42Å; P90-W298 VanDerWaalsContact CD-CZ3 3.41Å; P90-W298 HydrophobicContact CG-CE3 4.14Å; P90-W298 HydrophobicContact CG-CH2 4.33Å; P90-W298 HydrophobicContact CG-CZ3 3.9Å; W205-W298 WeakPolarHBondContact CB-O 3.46Å; L222-W298 HydrophobicContact CB-CE3 4.07Å; L222-W298 HydrophobicContact CB-CZ3 4.42Å; Y223-W298 VanDerWaalsContact C-CE3 3.4Å; P224-W298 HydrophobicContact CB-CH2 3.79Å; P224-W298 HydrophobicContact CB-CZ2 3.81Å; P224-W298 HydrophobicContact CB-CZ3 4.22Å; L255-W298 HydrophobicContact CD1-CH2 4.11Å; L255-W298 HydrophobicContact CD1-CZ3 3.84Å; P295-W298 VanDerWaalsContact CB-CD1 3.49Å; P295-W298 HydrophobicContact CB-CG 4.35Å; P295-W298 HydrophobicContact CG-CD2 4.45Å; P295-W298 HydrophobicContact CG-CG 4.19Å; P295-W298 PolarHBondContact O-N 3.24Å; D296-W298 PolarHBondContact O-N 3.25Å; D296-W298 VanDerWaalsContact O-N 3.07Å; W298-H300 PolarHBondContact O-N 3.11Å; W298-H300 PolarHBondContact O-ND1 3.34Å
299	W	98.3	Very high	95.8	Very high	33 Å²	33	16.2 Å²	16.2	13%	0.125	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	129.7	171.3	-68.7	99.4	0	0	0	108.4	F203 H204 W205 L222 Y223 P225 E228 P229 F231 R297	F203-W299 HydrophobicContact CB-CE3 4.29Å; F203-W299 HydrophobicContact CD1-CB 4.42Å; H204-W299 CarbonylContact O-C 3.44Å; H204-W299 WeakPolarHBondContact O-CA 2.93Å; W205-W299 AromaticContact CD1-CD2 3.88Å; W205-W299 AromaticContact CD1-CE2 3.82Å; W205-W299 AromaticContact CD1-CE3 3.77Å; W205-W299 AromaticContact CD1-CH2 3.63Å; W205-W299 AromaticContact CD1-CZ2 3.71Å; W205-W299 AromaticContact CD1-CZ3 3.66Å; W205-W299 AromaticContact NE1-CH2 3.81Å; W205-W299 AromaticContact NE1-CZ2 3.9Å; L222-W299 CarbonylContact C-O 3.56Å; L222-W299 WeakPolarHBondContact CA-O 3.11Å; Y223-W299 PolarHBondContact N-O 2.92Å; Y223-W299 PolarHBondContact O-N 3.09Å; P225-W299 PolarHBondContact O-NE1 2.82Å; E228-W299 HydrophobicContact CB-CZ2 4.34Å; E228-W299 HydrophobicContact CG-CH2 4.3Å; E228-W299 HydrophobicContact CG-CZ2 3.87Å; P229-W299 HydrophobicContact CG-CB 4.18Å; P229-W299 HydrophobicContact CG-CD2 4.25Å; P229-W299 HydrophobicContact CG-CE3 4.3Å; P229-W299 HydrophobicContact CG-CG 4.21Å; F231-W299 HydrophobicContact CE1-CZ3 4.12Å; F231-W299 HydrophobicContact CZ-CZ3 4.14Å; R297-W299 PolarHBondContact O-N 2.83Å
300	H	98.1	Very high	96.4	Very high	3 Å²	3	15.8 Å²	15.8	1%	0.014	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	140.5	177.4	55.2	-82.9	0	0	0	112.2	F203 H204 H206 W220 F221 L222 W298	F203-H300 WeakPolarHBondContact CA-O 3.28Å; H204-H300 AromaticContact CD2-NE2 3.9Å; H204-H300 AromaticContact CE1-CD2 3.64Å; H204-H300 AromaticContact CE1-NE2 3.55Å; H204-H300 PolarHBondContact N-O 3.24Å; H204-H300 VanDerWaalsContact N-O 3.15Å; H204-H300 PolarHBondContact ND1-O 2.92Å; H204-H300 AromaticContact NE2-CD2 3.93Å; H204-H300 AromaticContact NE2-NE2 3.34Å; H204-H300 PolarHBondContact NE2-NE2 3.44Å; H204-H300 PolarHBondContact O-N 2.86Å; H204-H300 PolarHBondContact O-ND1 2.91Å; H206-H300 AromaticContact CE1-CE1 3.4Å; H206-H300 PolarHBondContact CE1-CE1 2.77Å; H206-H300 VanDerWaalsContact CE1-CE1 3.4Å; H206-H300 AromaticContact CE1-NE2 3.4Å; H206-H300 PolarHBondContact CE1-NE2 3.24Å; H206-H300 AromaticContact ND1-CE1 3.88Å; H206-H300 AromaticContact NE2-CE1 3.59Å; H206-H300 AromaticContact NE2-NE2 3.26Å; H206-H300 PolarHBondContact NE2-NE2 3.22Å; W220-H300 HydrophobicContact CE3-CB 4.3Å; W220-H300 HydrophobicContact CZ3-CB 4.27Å; W220-H300 AromaticContact CZ3-CD2 3.78Å; F221-H300 CarbonylContact O-C 3.41Å; F221-H300 WeakPolarHBondContact O-CA 3.2Å; L222-H300 HydrophobicContact CD2-CB 4.21Å; L222-H300 HydrophobicContact CG-CB 4.15Å; W298-H300 PolarHBondContact O-N 3.11Å; W298-H300 PolarHBondContact O-ND1 3.34Å
301	A	97.6	Very high	96.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	152.3	168.8	0	0	0	0	0	109.6	V201 F203 F221 T237	V201-A301 CarbonylContact O-C 3.46Å; V201-A301 VanDerWaalsContact O-CA 3.23Å; V201-A301 WeakPolarHBondContact O-CA 3.41Å; F203-A301 HydrophobicContact CD1-CB 3.66Å; F203-A301 HydrophobicContact CD2-CB 3.88Å; F203-A301 HydrophobicContact CE1-CB 3.65Å; F203-A301 HydrophobicContact CE2-CB 3.86Å; F203-A301 HydrophobicContact CG-CB 3.78Å; F203-A301 HydrophobicContact CZ-CB 3.75Å; F221-A301 HydrophobicContact CB-CB 4.42Å; F221-A301 HydrophobicContact CD2-CB 4.34Å; F221-A301 PolarHBondContact N-O 3.09Å; F221-A301 PolarHBondContact O-N 3.08Å; T237-A301 HydrophobicContact CG2-CB 4.04Å
302	T	96.6	Very high	96.6	Very high	11 Å²	11	15.5 Å²	15.5	7%	0.067	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	151	-179.9	55.7	0	0	0	0	111.3	G200 V201 K218 R219 W220 T237	G200-T302 CarbonylContact C-O 3.55Å; G200-T302 VanDerWaalsContact CA-O 3.27Å; G200-T302 WeakPolarHBondContact CA-O 3.34Å; V201-T302 PolarHBondContact N-O 3.15Å; V201-T302 PolarHBondContact N-OG1 3.09Å; V201-T302 PolarHBondContact O-N 2.66Å; K218-T302 HydrophobicContact CD-CG2 4.19Å; R219-T302 CarbonylContact O-C 3.49Å; R219-T302 WeakPolarHBondContact O-CA 3.09Å; W220-T302 HydrophobicContact CD2-CG2 3.64Å; W220-T302 HydrophobicContact CE3-CG2 3.59Å; W220-T302 HydrophobicContact CG-CG2 4.42Å; W220-T302 HydrophobicContact CH2-CG2 3.62Å; W220-T302 HydrophobicContact CZ2-CG2 3.63Å; W220-T302 HydrophobicContact CZ3-CG2 3.61Å; T237-T302 VanDerWaalsContact CB-O 3.24Å; T237-T302 WeakPolarHBondContact CB-O 3.42Å; T237-T302 WeakPolarHBondContact CG2-O 3.41Å; T237-T302 PolarHBondContact OG1-O 3.39Å
303	L	96.8	Very high	96.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	122	172.6	-175.8	70.2	0	0	0	109.6	L60 G198 K218 R219 F221 T237 L238 L241 L305	L60-L303 HydrophobicContact CD1-CD1 4.36Å; L60-L303 HydrophobicContact CD1-CD2 3.82Å; L60-L303 HydrophobicContact CD1-CG 4.18Å; G198-L303 WeakPolarHBondContact O-CD1 3.43Å; K218-L303 CarbonylContact C-O 3.57Å; K218-L303 WeakPolarHBondContact CA-O 3.39Å; R219-L303 HydrophobicContact CB-CB 4.42Å; R219-L303 PolarHBondContact N-O 3.15Å; R219-L303 PolarHBondContact O-N 2.91Å; F221-L303 HydrophobicContact CE2-CB 4.35Å; T237-L303 HydrophobicContact CG2-CB 4.17Å; L238-L303 HydrophobicContact CB-CD1 4.04Å; L238-L303 HydrophobicContact CD1-CD1 4.48Å; L241-L303 HydrophobicContact CD2-CD2 3.4Å; L241-L303 VanDerWaalsContact CD2-CD2 3.4Å; L303-L305 HydrophobicContact CD2-CD2 3.9Å; L303-L305 HydrophobicContact CG-CD2 4.15Å
304	N	95.9	Very high	96.4	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	119.1	172.2	-58.6	-68.7	0	0	0	108.3	A195 P197 G198 T199 K218 S308	A195-N304 WeakPolarHBondContact CB-ND2 3.48Å; P197-N304 CarbonylContact C-O 3.57Å; G198-N304 PolarHBondContact N-O 3.07Å; T199-N304 PolarHBondContact O-N 3.24Å; T199-N304 PolarHBondContact O-ND2 2.81Å; T199-N304 PolarHBondContact OG1-ND2 2.91Å; K218-N304 WeakPolarHBondContact CE-OD1 3.44Å; N304-S308 WeakPolarHBondContact OD1-CB 3.39Å
305	L	94.6	Very high	96.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	-83.4	-26.6	178.6	-51.5	-177.8	0	0	0	111.3	G59 L60 E63 R217 R219 T258 L303	G59-L305 CarbonylContact C-O 3.55Å; G59-L305 WeakPolarHBondContact CA-O 3.29Å; L60-L305 HydrophobicContact CB-CB 4.29Å; L60-L305 HydrophobicContact CB-CD2 4Å; L60-L305 HydrophobicContact CD1-CD2 4.17Å; L60-L305 PolarHBondContact N-O 3.1Å; E63-L305 HydrophobicContact CB-CD1 4.26Å; E63-L305 HydrophobicContact CG-CD1 3.94Å; R217-L305 HydrophobicContact CB-CB 4.13Å; R217-L305 HydrophobicContact CB-CD1 4.2Å; R217-L305 HydrophobicContact CB-CG 4.43Å; R217-L305 PolarHBondContact O-N 3.45Å; R219-L305 HydrophobicContact CB-CD1 4.42Å; R219-L305 HydrophobicContact CB-CD2 4.13Å; R219-L305 HydrophobicContact CB-CG 4.35Å; T258-L305 HydrophobicContact CG2-CD1 3.7Å; L303-L305 HydrophobicContact CD2-CD2 3.9Å; L303-L305 HydrophobicContact CG-CD2 4.15Å
306	D	93.1	Very high	95.6	Very high	39 Å²	39	22.2 Å²	22.2	21%	0.209	12%	0.121	C	C	.	.	S	Bend	trans	-126.8	179.1	173.7	-45.1	-65.2	0	0	0	110.3	R217 S308	R217-D306 VanDerWaalsContact CB-OD2 3.3Å; R217-D306 WeakPolarHBondContact CB-OD2 3.38Å; R217-D306 VanDerWaalsContact CG-OD2 3.28Å; R217-D306 WeakPolarHBondContact CG-OD2 3.36Å; R217-D306 IonicContact CZ-OD1 3.85Å; R217-D306 IonicContact CZ-OD2 3.24Å; R217-D306 PolarHBondContact N-OD2 3Å; R217-D306 IonicContact NE-OD1 3.44Å; R217-D306 IonicContact NE-OD2 3.22Å; R217-D306 PolarHBondContact NE-OD2 2.9Å; R217-D306 IonicContact NH2-OD1 3.8Å; R217-D306 PolarHBondContact NH2-OD1 3.37Å; R217-D306 IonicContact NH2-OD2 3.05Å; R217-D306 PolarHBondContact NH2-OD2 3.49Å; D306-S308 PolarHBondContact O-N 3.16Å; D306-S308 PolarHBondContact O-OG 2.92Å
307	T	94.1	Very high	95.6	Very high	6 Å²	6	20.4 Å²	20.4	4%	0.037	11%	0.111	C	C	.	.	S	Bend	trans	-56.4	113	158.2	-56.9	0	0	0	0	108	W52 Q54 L145 I194 A195	W52-T307 HydrophobicContact CB-CG2 4Å; W52-T307 HydrophobicContact CD2-CG2 4.43Å; W52-T307 HydrophobicContact CE3-CG2 3.94Å; W52-T307 VanDerWaalsContact O-CB 3.3Å; W52-T307 WeakPolarHBondContact O-CB 3.45Å; W52-T307 PolarHBondContact O-OG1 3.09Å; Q54-T307 WeakPolarHBondContact CG-OG1 3.37Å; L145-T307 HydrophobicContact CD1-CG2 4.35Å; L145-T307 HydrophobicContact CD2-CG2 3.88Å; L145-T307 HydrophobicContact CG-CG2 4.27Å; I194-T307 HydrophobicContact CG2-CG2 4.5Å; A195-T307 CarbonylContact O-C 3.54Å; A195-T307 WeakPolarHBondContact O-CA 3.45Å
308	S	94.7	Very high	95.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.6	-170.1	-61.2	0	0	0	0	110	I194 A195 Y215 R217 N304 D306 F310	I194-S308 VanDerWaalsContact CA-O 3.29Å; I194-S308 WeakPolarHBondContact CA-O 3.42Å; A195-S308 PolarHBondContact N-O 3.43Å; A195-S308 PolarHBondContact O-N 2.96Å; Y215-S308 CarbonylContact O-C 3.51Å; Y215-S308 VanDerWaalsContact O-CA 3.25Å; Y215-S308 WeakPolarHBondContact O-CA 3.45Å; R217-S308 PolarHBondContact O-OG 2.95Å; N304-S308 WeakPolarHBondContact OD1-CB 3.39Å; D306-S308 PolarHBondContact O-N 3.16Å; D306-S308 PolarHBondContact O-OG 2.92Å; S308-F310 WeakPolarHBondContact O-CD1 3.31Å
309	V	96.3	Very high	95.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.7	166.2	-177.1	0	0	0	0	107.1	W52 C106 F192 I194 I214 Y215	W52-V309 HydrophobicContact CD2-CG2 3.98Å; W52-V309 HydrophobicContact CG-CG2 4.2Å; W52-V309 HydrophobicContact CZ2-CG2 3.97Å; C106-V309 HydrophobicContact CB-CG1 4.13Å; F192-V309 HydrophobicContact CE2-CG1 3.61Å; F192-V309 HydrophobicContact CZ-CG1 3.52Å; I194-V309 HydrophobicContact CD1-CG2 4.28Å; I194-V309 HydrophobicContact CG1-CG1 4.29Å; I194-V309 HydrophobicContact CG1-CG2 4.13Å; I194-V309 HydrophobicContact CG2-CG2 4.21Å; I214-V309 WeakPolarHBondContact CA-O 3.34Å; I214-V309 HydrophobicContact CB-CB 4.28Å; I214-V309 HydrophobicContact CB-CG1 4.14Å; I214-V309 WeakPolarHBondContact CB-O 3.07Å; I214-V309 PolarHBondContact N-O 3.2Å; Y215-V309 HydrophobicContact CD2-CB 4.2Å; Y215-V309 HydrophobicContact CD2-CG2 4.17Å; Y215-V309 PolarHBondContact N-O 3.12Å; Y215-V309 VanDerWaalsContact N-O 3.15Å; Y215-V309 PolarHBondContact O-N 3.2Å
310	F	95.9	Very high	95.2	Very high	1 Å²	1	12.2 Å²	12.2	0%	0.004	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	161.2	-172.1	58.6	-88.6	0	0	0	111.5	Y159 F161 G193 A195 E212 S308	Y159-F310 HydrophobicContact CE2-CZ 4.41Å; F161-F310 HydrophobicContact CB-CZ 4.39Å; F161-F310 HydrophobicContact CD2-CD2 4.3Å; F161-F310 AromaticContact CD2-CE2 3.27Å; F161-F310 HydrophobicContact CD2-CE2 3.27Å; F161-F310 AromaticContact CD2-CZ 3.86Å; F161-F310 HydrophobicContact CD2-CZ 3.86Å; F161-F310 HydrophobicContact CE2-CD2 4.32Å; F161-F310 AromaticContact CE2-CE2 3.57Å; F161-F310 HydrophobicContact CE2-CE2 3.57Å; F161-F310 HydrophobicContact CG-CE2 4.19Å; F161-F310 HydrophobicContact CG-CZ 4.4Å; G193-F310 PolarHBondContact N-O 3.22Å; G193-F310 PolarHBondContact O-N 3.43Å; A195-F310 HydrophobicContact CB-CE1 3.85Å; A195-F310 HydrophobicContact CB-CZ 4.44Å; E212-F310 WeakPolarHBondContact O-CA 3.44Å; E212-F310 VanDerWaalsContact O-CB 3.29Å; E212-F310 WeakPolarHBondContact O-CB 3.35Å; S308-F310 WeakPolarHBondContact O-CD1 3.31Å
311	I	96.5	Very high	95	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	140.3	176.5	-170.6	161.9	0	0	0	109.8	F102 L173 Y176 Y190 S191 F192 E212 I214	F102-I311 HydrophobicContact CE1-CG2 4.3Å; F102-I311 HydrophobicContact CZ-CD1 4Å; L173-I311 HydrophobicContact CD2-CD1 4.09Å; Y176-I311 HydrophobicContact CD1-CD1 3.73Å; Y176-I311 HydrophobicContact CD1-CG1 4.44Å; Y176-I311 HydrophobicContact CD1-CG2 4.49Å; Y176-I311 HydrophobicContact CD2-CD1 4.21Å; Y176-I311 HydrophobicContact CD2-CG2 3.86Å; Y176-I311 HydrophobicContact CE1-CD1 4.19Å; Y176-I311 HydrophobicContact CE1-CG1 4.41Å; Y176-I311 HydrophobicContact CE1-CG2 4.06Å; Y176-I311 HydrophobicContact CE2-CG2 3.36Å; Y176-I311 HydrophobicContact CG-CD1 3.75Å; Y176-I311 HydrophobicContact CG-CG2 4.4Å; Y176-I311 VanDerWaalsContact CZ-CG2 3.49Å; Y190-I311 HydrophobicContact CG-CD1 4.47Å; S191-I311 CarbonylContact O-C 3.54Å; S191-I311 WeakPolarHBondContact O-CA 3.44Å; F192-I311 HydrophobicContact CD2-CB 4.34Å; F192-I311 HydrophobicContact CD2-CD1 4.48Å; E212-I311 HydrophobicContact CB-CG2 4.2Å; E212-I311 PolarHBondContact N-O 3.39Å; E212-I311 PolarHBondContact O-N 3.02Å; I214-I311 HydrophobicContact CD1-CG2 4.16Å; I214-I311 HydrophobicContact CG1-CG2 4.45Å
312	S	96.1	Very high	94.8	Very high	3 Å²	3	13.7 Å²	13.7	2%	0.021	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.7	173.4	-56.4	0	0	0	0	110.2	Y190 S191 F210 S211	Y190-S312 CarbonylContact C-O 3.59Å; Y190-S312 WeakPolarHBondContact CA-O 3.25Å; S191-S312 PolarHBondContact N-O 3.21Å; S191-S312 PolarHBondContact O-N 2.61Å; F210-S312 CarbonylContact O-C 3.57Å; F210-S312 WeakPolarHBondContact O-CA 3.3Å; F210-S312 WeakPolarHBondContact O-CB 3.38Å; S211-S312 PolarHBondContact OG-OG 3.44Å
313	T	96.5	Very high	94.7	Very high	4 Å²	4	13.9 Å²	13.9	3%	0.025	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	105.3	171.7	-57	0	0	0	0	108.2	A188 A189 Y190 G209 F210 L315	A188-T313 HydrophobicContact CB-CG2 3.7Å; A189-T313 CarbonylContact O-C 3.59Å; A189-T313 WeakPolarHBondContact O-CA 3.19Å; Y190-T313 HydrophobicContact CD1-CG2 4.12Å; Y190-T313 HydrophobicContact CE1-CG2 3.88Å; Y190-T313 WeakPolarHBondContact CE1-OG1 3.47Å; G209-T313 CarbonylContact C-O 3.48Å; G209-T313 WeakPolarHBondContact CA-O 3.41Å; F210-T313 PolarHBondContact N-O 2.76Å; F210-T313 PolarHBondContact O-N 3.12Å; T313-L315 HydrophobicContact CG2-CD2 4.23Å
314	F	95.4	Very high	94.6	Very high	52 Å²	52	14.9 Å²	14.9	23%	0.228	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.9	176.2	-63	-66.1	0	0	0	110.5	F161 A188 A189 H206 F294	F161-F314 HydrophobicContact CZ-CZ 4.1Å; A188-F314 CarbonylContact C-O 3.59Å; A188-F314 WeakPolarHBondContact CA-O 3.25Å; A189-F314 PolarHBondContact N-O 3.13Å; A189-F314 PolarHBondContact O-N 2.74Å; H206-F314 AromaticContact CE1-CD1 3.96Å; H206-F314 AromaticContact CE1-CE1 3.35Å; H206-F314 WeakPolarHBondContact CE1-CE1 3.36Å; H206-F314 AromaticContact NE2-CE1 3.57Å; F294-F314 HydrophobicContact CZ-CD1 4.39Å; F294-F314 HydrophobicContact CZ-CE1 4.08Å
315	L	95.3	Very high	94.5	Very high	11 Å²	11	16.1 Å²	16.1	6%	0.058	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	85.2	-180	-53.6	178	0	0	0	108.7	L183 R186 S187 A188 P208 F210 Y293 T313	L183-L315 HydrophobicContact CD1-CB 4.05Å; L183-L315 HydrophobicContact CD1-CD1 3.8Å; L183-L315 HydrophobicContact CG-CD1 3.76Å; R186-L315 WeakPolarHBondContact CD-O 3.37Å; R186-L315 PolarHBondContact NH1-O 3.48Å; S187-L315 CarbonylContact O-C 3.57Å; S187-L315 WeakPolarHBondContact O-CA 3.48Å; A188-L315 HydrophobicContact CB-CD2 4.43Å; P208-L315 HydrophobicContact CG-CB 4.19Å; P208-L315 PolarHBondContact O-N 2.91Å; F210-L315 HydrophobicContact CD2-CD1 4.29Å; F210-L315 HydrophobicContact CE2-CD1 3.75Å; F210-L315 HydrophobicContact CE2-CG 4.47Å; Y293-L315 HydrophobicContact CE2-CD1 4.24Å; T313-L315 HydrophobicContact CG2-CD2 4.23Å
316	G	84.9	Confident	94.4	Very high	77 Å²	77	17.5 Å²	17.5	79%	0.794	13%	0.125	S	C	*	.			trans	-90.3	0	-178.2	0	0	0	0	0	112.3	R186 S187	R186-G316 CarbonylContact C-O 3.55Å; R186-G316 WeakPolarHBondContact CA-O 3.45Å; S187-G316 PolarHBondContact N-O 3.18Å; S187-G316 PolarHBondContact O-N 3.5Å; S187-G316 PolarHBondContact OG-O 3.36Å; S187-G316 VanDerWaalsContact OG-O 3.1Å

Retrieved 316 of 316 residues in 438.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).